COCC(C)(C)CCNS(=O)(=O)c1ccc(CC(=O)O)cc1	ZINC000872000017	ED	On-Demand	Anodyne	TBXA2R	53	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(OCCC(=O)O)cc2)C1	ZINC000872000021	GF	On-Demand	Anodyne	MMP13	53	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(OCCC(=O)O)cc2)C1	ZINC000872000021	GF	On-Demand	Anodyne	ADAM17	50	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(OCCC(=O)O)cc2)C1	ZINC000872000021	GF	On-Demand	Anodyne	PLA2G4B	40	32
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872000032	FD	On-Demand	Anodyne	TGM2	55	41
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872000032	FD	On-Demand	Anodyne	F13A1	42	33
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872000032	FD	On-Demand	Anodyne	SFRP1	23	45
CN(Cc1ccc2cc[nH]c2c1)S(=O)(=O)N1CCC[C@H](C(=O)O)C1	ZINC000872000042	FD	On-Demand	Anodyne	SLC6A1	89	35
CN(Cc1ccc2cc[nH]c2c1)S(=O)(=O)N1CCC[C@@H](C(=O)O)C1	ZINC000872000044	FD	On-Demand	Anodyne	SLC6A1	89	35
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872000071	FD	On-Demand	Anodyne	PKM	40	41
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872000071	FD	On-Demand	Anodyne	AKR1C3	77	52
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872000071	FD	On-Demand	Anodyne	SFRP1	45	50
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872000072	FD	On-Demand	Anodyne	PKM	40	41
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872000072	FD	On-Demand	Anodyne	AKR1C3	77	52
O=C(O)c1cccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872000072	FD	On-Demand	Anodyne	SFRP1	45	50
O=C(O)[C@@H]1CCCN1S(=O)(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000872000074	FD	On-Demand	Anodyne	CCR5	42	33
O=C(O)[C@H]1CCCN1S(=O)(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000872000075	FD	On-Demand	Anodyne	CCR5	42	33
O=C(O)c1ccoc1S(=O)(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872000077	FD	On-Demand	Anodyne	LIPG	24	46
O=C(O)CCCCCS(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872000085	FF	On-Demand	Anodyne	OXTR	68	45
O=C(O)CCCCCS(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872000087	FF	On-Demand	Anodyne	OXTR	68	45
O=C(O)Cc1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872000132	FD	On-Demand	Anodyne	TGM2	46	39
O=C(O)Cc1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872000133	FD	On-Demand	Anodyne	TGM2	46	39
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872000154	DD	On-Demand	Anodyne	TBXA2R	15	45
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872000155	DD	On-Demand	Anodyne	TBXA2R	15	45
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872000156	DD	On-Demand	Anodyne	TBXA2R	15	45
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872000157	DD	On-Demand	Anodyne	TBXA2R	15	45
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872000158	ED	On-Demand	Anodyne	TGM2	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872000158	ED	On-Demand	Anodyne	F13A1	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872000159	ED	On-Demand	Anodyne	TGM2	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872000159	ED	On-Demand	Anodyne	F13A1	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000872000160	ED	On-Demand	Anodyne	TGM2	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000872000160	ED	On-Demand	Anodyne	F13A1	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000872000161	ED	On-Demand	Anodyne	TGM2	52	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000872000161	ED	On-Demand	Anodyne	F13A1	52	38
CC(C)(C(=O)O)c1ccc(S(=O)(=O)NCC(C)(C)C(C)(F)F)cc1	ZINC000872000165	FG	On-Demand	Anodyne	SFRP1	69	35
Cc1ncc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1C(=O)O	ZINC000872000189	FE	On-Demand	Anodyne	GCKR	68	35
COCC1CC(NS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2)C1	ZINC000872000210	ED	On-Demand	Anodyne	CACNA1I	51	35
Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@@H]3C2)c(C(=O)O)c1	ZINC000872000235	EE	On-Demand	Anodyne	EPHX2	27	47
Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@H]3C2)c(C(=O)O)c1	ZINC000872000236	EE	On-Demand	Anodyne	EPHX2	27	47
Cc1ccc(S(=O)(=O)N2CC[C@H]3CSC[C@@H]3C2)c(C(=O)O)c1	ZINC000872000237	EE	On-Demand	Anodyne	EPHX2	27	47
Cc1ccc(S(=O)(=O)N2CC[C@@H]3CSC[C@H]3C2)c(C(=O)O)c1	ZINC000872000238	EE	On-Demand	Anodyne	EPHX2	27	47
O=C(O)c1ccoc1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872000247	EE	On-Demand	Anodyne	OXTR	58	39
O=C(O)c1ccoc1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872000248	EE	On-Demand	Anodyne	OXTR	58	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(CC(=O)O)c(F)c2)C1	ZINC000872000251	FE	On-Demand	Anodyne	SFRP1	64	34
COCC(C)(C)CCNS(=O)(=O)c1ccc(C(C)(C)C(=O)O)cc1	ZINC000872000259	FE	On-Demand	Anodyne	TBXA2R	42	34
O=C(O)CCCCCS(=O)(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000872000264	FF	On-Demand	Anodyne	CCR5	54	34
C=CC(C)(C)CCCNS(=O)(=O)c1ccc(CC(=O)O)cc1	ZINC000872000284	EF	On-Demand	Mild	TBXA2R	49	36
C=CC(C)(C)CCCNS(=O)(=O)c1ccc(CC(=O)O)cc1	ZINC000872000284	EF	On-Demand	Mild	TBXAS1	41	40
CN(Cc1ccc2cc[nH]c2c1)S(=O)(=O)CCCCCC(=O)O	ZINC000872000288	EF	On-Demand	Anodyne	FFAR2	38	46
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)C1	ZINC000872000291	FE	On-Demand	Anodyne	SLC6A1	119	41
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)C1	ZINC000872000291	FE	On-Demand	Anodyne	CCR5	85	36
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)C1	ZINC000872000292	FE	On-Demand	Anodyne	SLC6A1	119	41
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)C1	ZINC000872000292	FE	On-Demand	Anodyne	CCR5	85	36
COc1ccccc1[C@H]1CCCN(S(=O)(=O)c2cncc(C(=O)O)c2)CC1	ZINC000872000309	GF	On-Demand	Anodyne	AKR1C3	43	48
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)c2cncc(C(=O)O)c2)CC1	ZINC000872000311	GF	On-Demand	Anodyne	AKR1C3	43	48
O=C(NCc1ccc(NC(=O)c2ccco2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872000313	GG	On-Demand	Anodyne	NAMPT	57	36
O=C(O)[C@H]1CCCN1S(=O)(=O)NCC(F)(F)c1ccc(F)cc1F	ZINC000872000349	FD	On-Demand	Anodyne	SFRP1	91	35
O=C(O)[C@H]1CCCN1S(=O)(=O)NCC(F)(F)c1ccc(F)cc1F	ZINC000872000349	FD	On-Demand	Anodyne	WNT3	80	35
O=C(O)[C@@H]1CCCN1S(=O)(=O)NCC(F)(F)c1ccc(F)cc1F	ZINC000872000350	FD	On-Demand	Anodyne	SFRP1	91	35
O=C(O)[C@@H]1CCCN1S(=O)(=O)NCC(F)(F)c1ccc(F)cc1F	ZINC000872000350	FD	On-Demand	Anodyne	WNT3	80	35
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000352	GD	On-Demand	Anodyne	MMP13	50	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000352	GD	On-Demand	Anodyne	ADAM17	41	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000352	GD	On-Demand	Anodyne	MMP7	41	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000352	GD	On-Demand	Anodyne	MMP1	46	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000352	GD	On-Demand	Anodyne	GCKR	58	30
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000353	GD	On-Demand	Anodyne	MMP13	50	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000353	GD	On-Demand	Anodyne	ADAM17	41	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000353	GD	On-Demand	Anodyne	MMP7	41	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000353	GD	On-Demand	Anodyne	MMP1	46	38
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000353	GD	On-Demand	Anodyne	GCKR	58	30
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000354	GD	On-Demand	Anodyne	MMP13	50	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000354	GD	On-Demand	Anodyne	ADAM17	41	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000354	GD	On-Demand	Anodyne	MMP7	41	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000354	GD	On-Demand	Anodyne	MMP1	46	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872000354	GD	On-Demand	Anodyne	GCKR	58	30
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000356	GD	On-Demand	Anodyne	MMP13	50	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000356	GD	On-Demand	Anodyne	ADAM17	41	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000356	GD	On-Demand	Anodyne	MMP7	41	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000356	GD	On-Demand	Anodyne	MMP1	46	38
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872000356	GD	On-Demand	Anodyne	GCKR	58	30
O=C(O)c1cncc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872000375	FD	On-Demand	Anodyne	AKR1C3	28	48
O=C(O)c1cncc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872000376	FD	On-Demand	Anodyne	AKR1C3	28	48
COc1ccc(CC(=O)O)cc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccsc1	ZINC000872000382	FE	On-Demand	Anodyne	CPT1B	59	37
O=C(O)c1ncccc1S(=O)(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872000387	FD	On-Demand	Anodyne	SFRP1	45	35
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2C(=O)O)CC1	ZINC000872000396	GE	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2C(=O)O)CC1	ZINC000872000399	GE	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC[C@H]2C(=O)O)CC1	ZINC000872000400	GE	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC[C@H]2C(=O)O)CC1	ZINC000872000401	GE	On-Demand	Anodyne	HTR1A	17	40
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	BMP1	60	39
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP13	55	60
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP2	42	48
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP3	48	43
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP8	36	60
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP9	46	48
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP12	42	60
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	CA9	22	42
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	MMP1	51	43
COc1ccc(CCS(=O)(=O)N[C@H](C)CC(=O)O)cc1	ZINC000872000410	DD	On-Demand	Anodyne	FFAR1	27	42
Cc1ccccc1S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F	ZINC000872000411	FE	On-Demand	Anodyne	ITGAV	28	43
Cc1ccccc1S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F	ZINC000872000412	FE	On-Demand	Anodyne	ITGAV	28	43
C[C@H](CC(=O)O)NS(=O)(=O)Cc1ccc(Cl)cc1	ZINC000872000438	CD	On-Demand	Anodyne	TMPRSS11D	40	35
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872000495	ED	On-Demand	Anodyne	AKR1C3	56	40
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872000496	ED	On-Demand	Anodyne	AKR1C3	56	40
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872000497	ED	On-Demand	Anodyne	AKR1C3	56	40
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872000498	ED	On-Demand	Anodyne	AKR1C3	56	40
COCC(C)(C)CCNS(=O)(=O)c1ccc(CC(=O)O)c(F)c1	ZINC000872000538	ED	On-Demand	Anodyne	TBXA2R	52	37
COCC(C)(C)CCNS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1	ZINC000872000546	EE	On-Demand	Anodyne	TBXA2R	43	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872000549	GE	On-Demand	Anodyne	GCKR	46	31
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872000550	GE	On-Demand	Anodyne	GCKR	46	31
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872000551	GE	On-Demand	Anodyne	GCKR	46	31
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872000552	GE	On-Demand	Anodyne	GCKR	46	31
C[C@H]1CN(S(=O)(=O)c2csnc2C(=O)O)Cc2ccccc21	ZINC000872000556	EE	On-Demand	Anodyne	AKR1C3	56	39
O=C(O)C1CCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872000566	FD	On-Demand	Anodyne	OXTR	69	43
O=C(O)C1CCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872000566	FD	On-Demand	Anodyne	SLC18A3	18	43
O=C(O)C1CCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872000567	FD	On-Demand	Anodyne	OXTR	69	43
O=C(O)C1CCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872000567	FD	On-Demand	Anodyne	SLC18A3	18	43
O=C(O)[C@@H]1CCCN1S(=O)(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872000568	FD	On-Demand	Anodyne	LIPG	17	46
O=C(O)[C@H]1CCCN1S(=O)(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872000569	FD	On-Demand	Anodyne	LIPG	17	46
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(CC(=O)O)c2)C1	ZINC000872000571	FE	On-Demand	Anodyne	AKR1C3	59	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(CC(=O)O)c2)C1	ZINC000872000571	FE	On-Demand	Anodyne	SFRP1	77	38
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(CC(=O)O)c2)C1	ZINC000872000571	FE	On-Demand	Anodyne	WNT3	42	32
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCOCC2)cc1C(F)(F)F	ZINC000872000572	GE	On-Demand	Anodyne	SFRP1	127	38
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCOCC2)cc1C(F)(F)F	ZINC000872000572	GE	On-Demand	Anodyne	WNT3	83	38
O=C(O)c1cccc2c(S(=O)(=O)N[C@@H]3C[C@H]3C3CCOCC3)cccc12	ZINC000872000577	GF	On-Demand	Anodyne	CCR8	78	38
Cc1ncc(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)cc1C(=O)O	ZINC000872000579	GF	On-Demand	Anodyne	CCR5	67	34
O=C(O)c1cncc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872000592	FE	On-Demand	Anodyne	OXTR	59	40
O=C(O)c1cncc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872000592	FE	On-Demand	Anodyne	AKR1C3	67	61
O=C(O)c1cncc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872000593	FE	On-Demand	Anodyne	OXTR	59	40
O=C(O)c1cncc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872000593	FE	On-Demand	Anodyne	AKR1C3	67	61
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000872000612	GD	On-Demand	Anodyne	CPT1A	57	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000872000612	GD	On-Demand	Anodyne	CPT2	48	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000872000612	GD	On-Demand	Anodyne	CPT1B	52	36
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000872000613	GD	On-Demand	Anodyne	CPT1A	57	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000872000613	GD	On-Demand	Anodyne	CPT2	48	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000872000613	GD	On-Demand	Anodyne	CPT1B	52	36
C[C@@H]1CN(S(=O)(=O)c2ccc(CC(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872000614	GE	On-Demand	Anodyne	GCKR	62	31
C[C@@H]1CN(S(=O)(=O)c2ccc(CC(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872000615	GE	On-Demand	Anodyne	GCKR	62	31
C[C@H]1CN(S(=O)(=O)c2ccc(CC(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872000616	GE	On-Demand	Anodyne	GCKR	62	31
C[C@H]1CN(S(=O)(=O)c2ccc(CC(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872000617	GE	On-Demand	Anodyne	GCKR	62	31
COCC(C)(C)CCNS(=O)(=O)c1cc(Cl)ccc1C(=O)O	ZINC000872000620	EE	On-Demand	Anodyne	CPT2	44	34
COCC(C)(C)CCNS(=O)(=O)c1cc(Cl)ccc1C(=O)O	ZINC000872000620	EE	On-Demand	Anodyne	PTGDR2	22	40
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@@H](C3CC3)C2)c(Br)c1	ZINC000872000654	GD	On-Demand	Anodyne	SFRP1	67	35
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@H](C3CC3)C2)c(Br)c1	ZINC000872000655	GD	On-Demand	Anodyne	SFRP1	67	35
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@H](C3CC3)C2)c(Br)c1	ZINC000872000656	GD	On-Demand	Anodyne	SFRP1	67	35
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@@H](C3CC3)C2)c(Br)c1	ZINC000872000657	GD	On-Demand	Anodyne	SFRP1	67	35
O=C(O)c1cc(F)c(F)c(S(=O)(=O)N[C@@H]2CO[C@@H](C3CC3)C2)c1	ZINC000872000670	ED	On-Demand	Anodyne	SFRP1	65	33
O=C(O)c1cc(F)c(F)c(S(=O)(=O)N[C@H]2CO[C@H](C3CC3)C2)c1	ZINC000872000671	ED	On-Demand	Anodyne	SFRP1	65	33
O=C(O)c1cc(F)c(F)c(S(=O)(=O)N[C@H]2CO[C@@H](C3CC3)C2)c1	ZINC000872000672	ED	On-Demand	Anodyne	SFRP1	65	33
O=C(O)c1cc(F)c(F)c(S(=O)(=O)N[C@@H]2CO[C@H](C3CC3)C2)c1	ZINC000872000673	ED	On-Demand	Anodyne	SFRP1	65	33
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@@H](C3CC3)C2)cc1F	ZINC000872000676	ED	On-Demand	Anodyne	SFRP1	54	32
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@H](C3CC3)C2)cc1F	ZINC000872000677	ED	On-Demand	Anodyne	SFRP1	54	32
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@@H](C3CC3)C2)cc1F	ZINC000872000678	ED	On-Demand	Anodyne	SFRP1	54	32
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@H](C3CC3)C2)cc1F	ZINC000872000679	ED	On-Demand	Anodyne	SFRP1	54	32
O=C(O)CS[C@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000872000680	ED	On-Demand	Anodyne	SFRP1	95	37
O=C(O)CS[C@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000872000680	ED	On-Demand	Anodyne	WNT3	56	36
O=C(O)CS[C@@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000872000681	ED	On-Demand	Anodyne	SFRP1	95	37
O=C(O)CS[C@@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000872000681	ED	On-Demand	Anodyne	WNT3	56	36
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872000723	FE	On-Demand	Anodyne	TBXA2R	17	45
C[C@@H]1CN(S(=O)(=O)Cc2ccccc2C(=O)O)Cc2ccccc21	ZINC000872000730	EF	On-Demand	Anodyne	AKR1C3	46	39
C[C@H]1CN(S(=O)(=O)Cc2ccccc2C(=O)O)Cc2ccccc21	ZINC000872000731	EF	On-Demand	Anodyne	AKR1C3	46	39
O=C(O)Cc1ccc(S(=O)(=O)NCCC[C@@H]2C=CCC2)cc1	ZINC000872000732	DE	On-Demand	Anodyne	TBXA2R	46	33
O=C(O)Cc1ccc(S(=O)(=O)NCCC[C@H]2C=CCC2)cc1	ZINC000872000733	DE	On-Demand	Anodyne	TBXA2R	46	33
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1C(F)(F)F	ZINC000872000737	GF	On-Demand	Anodyne	SFRP1	124	36
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1C(F)(F)F	ZINC000872000737	GF	On-Demand	Anodyne	WNT3	84	35
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1C(F)(F)F	ZINC000872000738	GF	On-Demand	Anodyne	SFRP1	124	36
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1C(F)(F)F	ZINC000872000738	GF	On-Demand	Anodyne	WNT3	84	35
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1C(F)(F)F	ZINC000872000739	GF	On-Demand	Anodyne	SFRP1	124	36
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1C(F)(F)F	ZINC000872000739	GF	On-Demand	Anodyne	WNT3	84	35
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1C(F)(F)F	ZINC000872000740	GF	On-Demand	Anodyne	SFRP1	124	36
O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1C(F)(F)F	ZINC000872000740	GF	On-Demand	Anodyne	WNT3	84	35
O=C(O)c1coc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000758	FD	On-Demand	Anodyne	LIPG	20	45
O=C(O)[C@@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000759	GD	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000759	GD	On-Demand	Anodyne	SFRP1	78	33
O=C(O)[C@@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000759	GD	On-Demand	Anodyne	WNT3	48	33
O=C(O)[C@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000760	GD	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000760	GD	On-Demand	Anodyne	SFRP1	78	33
O=C(O)[C@H]1CCCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)C1	ZINC000872000760	GD	On-Demand	Anodyne	WNT3	48	33
O=C(O)Cc1cccc(S(=O)(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000872000763	DE	On-Demand	Anodyne	TBXA2R	27	43
O=C(O)Cc1cccc(S(=O)(=O)NCCC[C@H]2C=CCC2)c1	ZINC000872000764	DE	On-Demand	Anodyne	TBXA2R	27	43
O=C(O)c1cncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000773	FD	On-Demand	Anodyne	HRH1	15	42
O=C(O)c1cncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000773	FD	On-Demand	Anodyne	CCR3	20	42
O=C(O)c1cncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000773	FD	On-Demand	Anodyne	AKR1C3	36	47
O=C(O)c1cncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000773	FD	On-Demand	Anodyne	LIPG	26	45
O=C(O)Cn1cc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)cn1	ZINC000872000778	FD	On-Demand	Anodyne	OXTR	64	39
O=C(O)Cn1cc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)cn1	ZINC000872000779	FD	On-Demand	Anodyne	OXTR	64	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	RARA	46	35
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	RARG	63	35
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	RARB	53	35
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	RXRA	40	36
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	HSD11B1	15	43
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	AKR1C3	45	35
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)C1	ZINC000872000782	EE	On-Demand	Anodyne	SFRP1	69	44
COCC(C)(C)CCNS(=O)(=O)c1cc(Cl)cc(C(=O)O)c1	ZINC000872000797	EE	On-Demand	Anodyne	TBXA2R	42	35
Cc1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c(C(=O)O)c1	ZINC000872000804	FE	On-Demand	Anodyne	EPHX2	30	45
Cc1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c(C(=O)O)c1	ZINC000872000805	FE	On-Demand	Anodyne	EPHX2	30	45
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872000806	GE	On-Demand	Anodyne	HSD11B1	21	46
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872000807	GE	On-Demand	Anodyne	HSD11B1	21	46
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000814	GE	On-Demand	Anodyne	HRH1	21	42
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000814	GE	On-Demand	Anodyne	PRSS2	43	35
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000814	GE	On-Demand	Anodyne	CCR3	41	42
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000814	GE	On-Demand	Anodyne	AKR1C3	43	38
O=C(O)Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872000814	GE	On-Demand	Anodyne	LIPG	16	41
O=C(O)Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872000819	ED	On-Demand	Anodyne	TBXA2R	15	42
CCCCS(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F	ZINC000872000866	DD	On-Demand	Anodyne	EST1_PIG	42	32
CCCCS(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F	ZINC000872000867	DD	On-Demand	Anodyne	EST1_PIG	42	32
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC[C@H](C(=O)O)C2)CC1	ZINC000872000878	GE	On-Demand	Anodyne	SLC6A1	133	43
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC[C@H](C(=O)O)C2)CC1	ZINC000872000879	GE	On-Demand	Anodyne	SLC6A1	133	43
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H](C(=O)O)C2)CC1	ZINC000872000880	GE	On-Demand	Anodyne	SLC6A1	133	43
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H](C(=O)O)C2)CC1	ZINC000872000881	GE	On-Demand	Anodyne	SLC6A1	133	43
O=C(O)CS[C@H](CNS(=O)(=O)c1ccc(Cl)s1)C(F)(F)F	ZINC000872000893	GE	On-Demand	Anodyne	CCR4	43	32
O=C(O)CS[C@@H](CNS(=O)(=O)c1ccc(Cl)s1)C(F)(F)F	ZINC000872000894	GE	On-Demand	Anodyne	CCR4	43	32
COc1cccc(CS(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000918	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(CS(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000918	GD	On-Demand	Anodyne	FFAR1	22	40
COc1cccc(CS(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000918	GD	On-Demand	Anodyne	PDS	51	33
COc1cccc(CS(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000919	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(CS(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000919	GD	On-Demand	Anodyne	FFAR1	22	40
COc1cccc(CS(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872000919	GD	On-Demand	Anodyne	PDS	51	33
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000920	GE	On-Demand	Anodyne	SFRP1	140	40
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000920	GE	On-Demand	Anodyne	WNT3	92	38
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000921	GE	On-Demand	Anodyne	SFRP1	140	40
O=C(O)c1ccc(S(=O)(=O)N[C@H]2CO[C@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000921	GE	On-Demand	Anodyne	WNT3	92	38
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000922	GE	On-Demand	Anodyne	SFRP1	140	40
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000922	GE	On-Demand	Anodyne	WNT3	92	38
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000923	GE	On-Demand	Anodyne	SFRP1	140	40
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CO[C@H](C3CC3)C2)cc1C(F)(F)F	ZINC000872000923	GE	On-Demand	Anodyne	WNT3	92	38
CCOc1ccc(S(=O)(=O)N2Cc3cccc(OC)c3C2)cc1C(=O)O	ZINC000872000926	GE	On-Demand	Anodyne	PDE5A	29	40
CCOc1ccc(S(=O)(=O)N2Cc3cccc(OC)c3C2)cc1C(=O)O	ZINC000872000926	GE	On-Demand	Anodyne	CPT2	20	40
CCOc1ccc(S(=O)(=O)N2Cc3cccc(OC)c3C2)cc1C(=O)O	ZINC000872000926	GE	On-Demand	Anodyne	PPARD	15	49
CCOc1ccc(S(=O)(=O)N2Cc3cccc(OC)c3C2)cc1C(=O)O	ZINC000872000926	GE	On-Demand	Anodyne	SSTR1	49	36
CCOc1ccc(S(=O)(=O)N2Cc3cccc(OC)c3C2)cc1C(=O)O	ZINC000872000926	GE	On-Demand	Anodyne	AKR1C3	71	57
O=C(O)c1nscc1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872000945	FE	On-Demand	Anodyne	OXTR	62	39
O=C(O)c1nscc1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872000946	FE	On-Demand	Anodyne	OXTR	62	39
C[C@@H]1CN(S(=O)(=O)Cc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872000959	EF	On-Demand	Anodyne	AKR1C3	49	39
C[C@H]1CN(S(=O)(=O)Cc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872000960	EF	On-Demand	Anodyne	AKR1C3	49	39
CN(CCC(=O)O)S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872000965	ED	On-Demand	Anodyne	OXTR	71	47
CN(CCC(=O)O)S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872000966	ED	On-Demand	Anodyne	OXTR	71	47
COc1ccccc1[C@H]1CCCN(S(=O)(=O)CCCCCC(=O)O)CC1	ZINC000872000974	GG	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)CCCCCC(=O)O)CC1	ZINC000872000975	GG	On-Demand	Anodyne	HTR1A	22	41
COCC(C)(C)CCNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	ZINC000872000984	GF	On-Demand	Anodyne	SFRP1	116	36
COCC(C)(C)CCNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	ZINC000872000984	GF	On-Demand	Anodyne	WNT3	76	34
O=C(O)c1cc(S(=O)(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872000994	ED	On-Demand	Anodyne	PKM	38	41
O=C(O)c1cc(S(=O)(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872000994	ED	On-Demand	Anodyne	AKR1C3	54	41
O=C(O)c1cc(S(=O)(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872000994	ED	On-Demand	Anodyne	AKR1C1	22	41
COc1ccc(C(=O)O)c(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872000995	GD	On-Demand	Anodyne	EPHX2	20	41
COc1ccc(C(=O)O)c(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872000996	GD	On-Demand	Anodyne	EPHX2	20	41
Cc1cccc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCOCC2)c1C(=O)O	ZINC000872001002	ED	On-Demand	Anodyne	CCR8	43	35
O=C(O)c1cccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872001012	ED	On-Demand	Anodyne	AKR1C3	51	38
O=C(O)c1cccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872001013	ED	On-Demand	Anodyne	AKR1C3	51	38
O=C(O)c1cccc(S(=O)(=O)NC[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872001014	ED	On-Demand	Anodyne	AKR1C3	51	38
O=C(O)c1cccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872001015	ED	On-Demand	Anodyne	AKR1C3	51	38
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(/C=C/C(=O)O)cc2)C1	ZINC000872001027	FF	On-Demand	Anodyne	SFRP1	43	36
O=C(O)c1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@]3(CO)C2)cc1C(F)(F)F	ZINC000872001039	GE	On-Demand	Anodyne	CACNA1B	20	41
O=C(O)c1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@]3(CO)C2)cc1C(F)(F)F	ZINC000872001039	GE	On-Demand	Anodyne	SFRP1	95	36
O=C(O)c1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@]3(CO)C2)cc1C(F)(F)F	ZINC000872001039	GE	On-Demand	Anodyne	WNT3	47	32
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872001043	GE	On-Demand	Anodyne	HTR1A	18	41
COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872001043	GE	On-Demand	Anodyne	SLC6A1	44	38
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872001044	GE	On-Demand	Anodyne	HTR1A	18	41
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872001044	GE	On-Demand	Anodyne	SLC6A1	44	38
O=C(O)CS[C@H](CNS(=O)(=O)c1cccnc1)C(F)(F)F	ZINC000872001078	ED	On-Demand	Anodyne	TBXAS1	57	45
O=C(O)CS[C@@H](CNS(=O)(=O)c1cccnc1)C(F)(F)F	ZINC000872001079	ED	On-Demand	Anodyne	TBXAS1	57	45
O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872001094	EF	On-Demand	Anodyne	SFRP1	63	37
COc1ccc(CC(=O)O)cc1S(=O)(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000872001123	GD	On-Demand	Anodyne	CPT1B	49	39
COc1ccc(CC(=O)O)cc1S(=O)(=O)NC[C@H]1CCN1C1CCCC1	ZINC000872001124	GD	On-Demand	Anodyne	CPT1B	49	39
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(/C=C\C(=O)O)cc2)C1	ZINC000872001129	FF	On-Demand	Anodyne	SFRP1	43	36
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(C(=O)O)c2)C1	ZINC000872001152	EE	On-Demand	Anodyne	AKR1C3	82	54
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(C(=O)O)c2)C1	ZINC000872001152	EE	On-Demand	Anodyne	SFRP1	114	49
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2cccc(C(=O)O)c2)C1	ZINC000872001152	EE	On-Demand	Anodyne	WNT3	66	32
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872001164	FD	On-Demand	Anodyne	SLC6A1	115	37
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872001164	FD	On-Demand	Anodyne	LIPG	15	45
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872001165	FD	On-Demand	Anodyne	SLC6A1	115	37
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872001165	FD	On-Demand	Anodyne	LIPG	15	45
O=C(O)c1cccc(CS(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872001172	FD	On-Demand	Anodyne	AKR1C3	40	34
O=C(O)c1cccc(CS(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872001173	FD	On-Demand	Anodyne	AKR1C3	40	34
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001174	GE	On-Demand	Anodyne	CPT1A	51	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001174	GE	On-Demand	Anodyne	CPT2	48	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001174	GE	On-Demand	Anodyne	CPT1B	43	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001175	GE	On-Demand	Anodyne	CPT1A	51	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001175	GE	On-Demand	Anodyne	CPT2	48	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000872001175	GE	On-Demand	Anodyne	CPT1B	43	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001176	GE	On-Demand	Anodyne	CPT1A	51	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001176	GE	On-Demand	Anodyne	CPT2	48	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001176	GE	On-Demand	Anodyne	CPT1B	43	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001177	GE	On-Demand	Anodyne	CPT1A	51	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001177	GE	On-Demand	Anodyne	CPT2	48	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000872001177	GE	On-Demand	Anodyne	CPT1B	43	35
O=C(O)c1ncsc1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872001179	FE	On-Demand	Anodyne	OXTR	58	37
O=C(O)c1ncsc1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872001180	FE	On-Demand	Anodyne	OXTR	58	37
O=C(O)C1CCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872001190	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)C1CCN(S(=O)(=O)NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872001190	GD	On-Demand	Anodyne	SFRP1	57	33
C[C@H]1CN(S(=O)(=O)c2cncc(C(=O)O)c2)Cc2ccccc21	ZINC000872001197	EE	On-Demand	Anodyne	AKR1C3	75	67
CN(CCC(=O)O)S(=O)(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000872001200	ED	On-Demand	Anodyne	FFAR1	28	41
Cc1ncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872001205	GE	On-Demand	Anodyne	HRH1	17	41
Cc1ncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872001205	GE	On-Demand	Anodyne	CCR3	20	41
Cc1ncc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872001205	GE	On-Demand	Anodyne	LIPG	33	45
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	RARA	25	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	RARG	34	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	RARB	32	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	CPT1A	63	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	CPT2	48	37
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000872001218	FE	On-Demand	Anodyne	CPT1B	49	37
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	RARA	25	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	RARG	34	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	RARB	32	40
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	CPT1A	63	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	CPT2	48	37
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000872001219	FE	On-Demand	Anodyne	CPT1B	49	37
O=C(O)c1ncccc1S(=O)(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000872001222	FE	On-Demand	Anodyne	CCR5	58	34
Cc1ncc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872001223	GD	On-Demand	Anodyne	GCK	52	33
Cc1ncc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872001223	GD	On-Demand	Anodyne	GCKR	69	34
Cc1ncc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872001224	GD	On-Demand	Anodyne	GCK	52	33
Cc1ncc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)cc1C(=O)O	ZINC000872001224	GD	On-Demand	Anodyne	GCKR	69	34
Cc1ncc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872001225	GD	On-Demand	Anodyne	GCK	52	33
Cc1ncc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872001225	GD	On-Demand	Anodyne	GCKR	69	34
Cc1ncc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872001226	GD	On-Demand	Anodyne	GCK	52	33
Cc1ncc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)cc1C(=O)O	ZINC000872001226	GD	On-Demand	Anodyne	GCKR	69	34
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	CNR1	15	49
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	CNR2	17	43
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	CASR	48	37
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	HTR7	47	40
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	ADCY5	21	49
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	PTGDS	48	49
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	EPHX2	21	51
O=C(O)c1cc(NS(=O)(=O)CCCN2CCOCC2)cc2ccccc12	ZINC000872001232	GE	On-Demand	Anodyne	HPGDS	23	41
CN(Cc1ccc2cc[nH]c2c1)S(=O)(=O)CCCC(=O)O	ZINC000872001259	DD	On-Demand	Anodyne	FFAR2	38	47
COc1ccccc1[C@H]1CCCN(S(=O)(=O)CCCC(=O)O)CC1	ZINC000872001275	FE	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@@H]1CCCN(S(=O)(=O)CCCC(=O)O)CC1	ZINC000872001276	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(O)COc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccsc2)cc1Cl	ZINC000872001277	GF	On-Demand	Anodyne	PTGDR2	32	41
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872001285	GG	On-Demand	Anodyne	SFRP1	66	32
COc1cccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872001294	FD	On-Demand	Anodyne	ITGAV	16	47
COc1cccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872001294	FD	On-Demand	Anodyne	AKR1C3	23	48
COc1cccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872001295	FD	On-Demand	Anodyne	ITGAV	16	47
COc1cccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)c1	ZINC000872001295	FD	On-Demand	Anodyne	AKR1C3	23	48
COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872001306	GF	On-Demand	Anodyne	CPT1A	45	39
COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872001306	GF	On-Demand	Anodyne	CPT2	45	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872001306	GF	On-Demand	Anodyne	SFRP1	47	32
O=C(O)c1cccc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872001342	ED	On-Demand	Anodyne	AKR1C3	62	43
O=C(O)c1cc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c[nH]1	ZINC000872001346	FD	On-Demand	Anodyne	CCR3	17	41
O=C(O)c1cc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c[nH]1	ZINC000872001346	FD	On-Demand	Anodyne	LIPG	17	44
Cc1ncc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872001353	FE	On-Demand	Anodyne	OXTR	61	37
Cc1ncc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872001353	FE	On-Demand	Anodyne	AKR1C3	49	38
Cc1ncc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872001354	FE	On-Demand	Anodyne	OXTR	61	37
Cc1ncc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872001354	FE	On-Demand	Anodyne	AKR1C3	49	38
O=C(O)c1ncccc1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872001355	FE	On-Demand	Anodyne	OXTR	62	39
O=C(O)c1ncccc1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872001356	FE	On-Demand	Anodyne	OXTR	62	39
O=C(O)Cc1cccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872001358	FD	On-Demand	Anodyne	AKR1C3	57	37
O=C(O)Cc1cccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872001359	FD	On-Demand	Anodyne	AKR1C3	57	37
O=C(O)Cc1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1F	ZINC000872001366	GD	On-Demand	Anodyne	PKM	41	38
O=C(O)Cc1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1F	ZINC000872001367	GD	On-Demand	Anodyne	PKM	41	38
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)nc2)C1	ZINC000872001369	ED	On-Demand	Anodyne	GCK	58	33
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C(=O)O)nc2)C1	ZINC000872001369	ED	On-Demand	Anodyne	GCKR	74	36
COCC(C)(C)CCNS(=O)(=O)Cc1cccc(C(=O)O)c1	ZINC000872001370	ED	On-Demand	Anodyne	AKR1C3	29	44
O=C(O)[C@@H]1CCCN1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872001385	FD	On-Demand	Anodyne	OXTR	67	45
O=C(O)[C@H]1CCCN1S(=O)(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872001386	FD	On-Demand	Anodyne	OXTR	67	45
O=C(O)[C@@H]1CCCN1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872001387	FD	On-Demand	Anodyne	OXTR	67	45
O=C(O)[C@H]1CCCN1S(=O)(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872001388	FD	On-Demand	Anodyne	OXTR	67	45
O=C(O)c1ncsc1S(=O)(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000872001389	FF	On-Demand	Anodyne	CCR5	43	33
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	HRH1	15	41
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	MMP13	45	48
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	CCR3	31	41
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	ADAM17	30	41
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	EPHX2	15	43
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	TGM2	43	39
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	MMP1	41	38
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	F13A1	40	39
O=C(O)Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872001390	GE	On-Demand	Anodyne	LIPG	17	42
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872001403	FE	On-Demand	Anodyne	SFRP1	18	42
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001404	FE	On-Demand	Anodyne	SFRP1	18	42
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872001405	FE	On-Demand	Anodyne	SFRP1	18	42
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001406	FE	On-Demand	Anodyne	SFRP1	18	42
COCC(C)(C)CCNS(=O)(=O)c1ccccc1C(=O)O	ZINC000872001411	DD	On-Demand	Anodyne	PRTN3	44	31
C=CC(C)(C)CCCNS(=O)(=O)c1cccc(CC(=O)O)c1	ZINC000872001412	EF	On-Demand	Mild	TBXA2R	31	42
C=CC(C)(C)CCCNS(=O)(=O)c1cccc(CC(=O)O)c1	ZINC000872001412	EF	On-Demand	Mild	TBXAS1	34	40
COCC(C)(C)CCNS(=O)(=O)c1ccc(C(=O)O)cc1	ZINC000872001422	DD	On-Demand	Anodyne	TBXA2R	46	40
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@](C)(C(F)(F)F)C2)cc1	ZINC000872001427	GG	On-Demand	Anodyne	HSD11B1	21	47
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@](C)(C(F)(F)F)C2)cc1	ZINC000872001427	GG	On-Demand	Anodyne	SFRP1	103	39
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@](C)(C(F)(F)F)C2)cc1	ZINC000872001427	GG	On-Demand	Anodyne	WNT3	60	32
COc1cccc(S(=O)(=O)N2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872001429	GF	On-Demand	Anodyne	MMP13	16	43
COc1cccc(S(=O)(=O)N2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872001429	GF	On-Demand	Anodyne	PKM	20	45
COc1cccc(S(=O)(=O)N2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872001429	GF	On-Demand	Anodyne	MMP1	16	43
COc1cccc(S(=O)(=O)N2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872001429	GF	On-Demand	Anodyne	AKR1C3	48	42
O=C(O)COc1ccc(S(=O)(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872001430	GE	On-Demand	Anodyne	MMP13	15	44
O=C(O)COc1ccc(S(=O)(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872001430	GE	On-Demand	Anodyne	MMP14	17	44
O=C(O)CS[C@H](CNS(=O)(=O)c1cccc(F)c1)C(F)(F)F	ZINC000872001452	FD	On-Demand	Anodyne	SFRP1	41	33
O=C(O)CS[C@@H](CNS(=O)(=O)c1cccc(F)c1)C(F)(F)F	ZINC000872001453	FD	On-Demand	Anodyne	SFRP1	41	33
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP13	45	43
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP2	32	43
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP3	18	42
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP8	15	42
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP14	22	43
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP9	25	42
CCOc1ccc(S(=O)(=O)NC[C@@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001467	GE	On-Demand	Anodyne	MMP7	15	42
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP13	45	43
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP2	32	43
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP3	18	42
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP8	15	42
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP14	22	43
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP9	25	42
CCOc1ccc(S(=O)(=O)NC[C@H](SCC(=O)O)C(F)(F)F)cc1	ZINC000872001468	GE	On-Demand	Anodyne	MMP7	15	42
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@@](C)(C(F)(F)F)C2)cc1	ZINC000872001471	GG	On-Demand	Anodyne	HSD11B1	21	47
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@@](C)(C(F)(F)F)C2)cc1	ZINC000872001471	GG	On-Demand	Anodyne	SFRP1	103	39
CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CC[C@@](C)(C(F)(F)F)C2)cc1	ZINC000872001471	GG	On-Demand	Anodyne	WNT3	60	32
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872001480	FD	On-Demand	Anodyne	SLC6A1	111	35
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872001480	FD	On-Demand	Anodyne	OXTR	65	42
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872001481	FD	On-Demand	Anodyne	SLC6A1	111	35
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872001481	FD	On-Demand	Anodyne	OXTR	65	42
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872001482	FD	On-Demand	Anodyne	SLC6A1	111	35
O=C(O)[C@@H]1CCCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872001482	FD	On-Demand	Anodyne	OXTR	65	42
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872001483	FD	On-Demand	Anodyne	SLC6A1	111	35
O=C(O)[C@H]1CCCN(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872001483	FD	On-Demand	Anodyne	OXTR	65	42
O=C(O)c1ccc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)o1	ZINC000872001490	EE	On-Demand	Anodyne	OXTR	56	39
O=C(O)c1ccc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)o1	ZINC000872001490	EE	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)c1ccc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)o1	ZINC000872001491	EE	On-Demand	Anodyne	OXTR	56	39
O=C(O)c1ccc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)o1	ZINC000872001491	EE	On-Demand	Anodyne	SLC18A3	15	40
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)C1	ZINC000872001510	FG	On-Demand	Anodyne	SFRP1	42	37
Cc1ncc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1C(=O)O	ZINC000872001511	FD	On-Demand	Anodyne	GCK	51	32
Cc1ncc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1C(=O)O	ZINC000872001512	FD	On-Demand	Anodyne	GCK	51	32
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cn1	ZINC000872001518	FD	On-Demand	Anodyne	GCK	59	35
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cn1	ZINC000872001518	FD	On-Demand	Anodyne	GCKR	59	32
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cn1	ZINC000872001519	FD	On-Demand	Anodyne	GCK	59	35
O=C(O)c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cn1	ZINC000872001519	FD	On-Demand	Anodyne	GCKR	59	32
O=C(O)c1cccc(S(=O)(=O)NC2([C@@H]3CCCCO3)CCC2)c1	ZINC000872001533	EE	On-Demand	Anodyne	AKR1C3	54	40
O=C(O)c1cccc(S(=O)(=O)NC2([C@H]3CCCCO3)CCC2)c1	ZINC000872001534	EE	On-Demand	Anodyne	AKR1C3	54	40
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000872001537	FE	On-Demand	Anodyne	RARA	40	31
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000872001537	FE	On-Demand	Anodyne	RARG	49	36
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000872001537	FE	On-Demand	Anodyne	RARB	46	36
O=C(O)c1coc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872001554	EE	On-Demand	Anodyne	OXTR	59	39
O=C(O)c1coc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872001554	EE	On-Demand	Anodyne	AKR1C3	54	37
O=C(O)c1coc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872001555	EE	On-Demand	Anodyne	OXTR	59	39
O=C(O)c1coc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872001555	EE	On-Demand	Anodyne	AKR1C3	54	37
O=C(O)c1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000872001556	FD	On-Demand	Anodyne	LIPG	19	41
O=C(O)c1ccc(S(=O)(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000872001556	FD	On-Demand	Anodyne	GCKR	75	34
C[C@]1(C(F)(F)F)CCN(S(=O)(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000872001558	FE	On-Demand	Anodyne	AKR1C3	47	35
Cc1ncc(S(=O)(=O)N2Cc3ccccc3[C@H](C)C2)cc1C(=O)O	ZINC000872001587	EE	On-Demand	Anodyne	AKR1C3	64	44
Cc1ncc(S(=O)(=O)N2Cc3ccccc3[C@H](C)C2)cc1C(=O)O	ZINC000872001587	EE	On-Demand	Anodyne	GCKR	73	34
Cc1ncc(S(=O)(=O)N2Cc3ccccc3[C@@H](C)C2)cc1C(=O)O	ZINC000872001588	EE	On-Demand	Anodyne	AKR1C3	64	44
Cc1ncc(S(=O)(=O)N2Cc3ccccc3[C@@H](C)C2)cc1C(=O)O	ZINC000872001588	EE	On-Demand	Anodyne	GCKR	73	34
O=C(O)c1cncc(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872001589	FE	On-Demand	Anodyne	CCR5	83	35
O=C(O)c1cncc(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872001589	FE	On-Demand	Anodyne	AKR1C3	58	51
O=C(O)c1cncc(S(=O)(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872001589	FE	On-Demand	Anodyne	MLYCD	16	41
O=C(O)/C=C\c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872001596	GE	On-Demand	Anodyne	TGM2	42	35
O=C(O)/C=C\c1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872001597	GE	On-Demand	Anodyne	TGM2	42	35
O=C(O)/C=C/c1ccc(S(=O)(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872001598	GE	On-Demand	Anodyne	TGM2	42	35
O=C(O)/C=C/c1ccc(S(=O)(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872001599	GE	On-Demand	Anodyne	TGM2	42	35
CN(CCC(=O)O)S(=O)(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872001600	EC	On-Demand	Anodyne	PRSS2	57	34
CN(CCC(=O)O)S(=O)(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872001600	EC	On-Demand	Anodyne	EPHX2	16	44
C=CC(C)(C)CCCNS(=O)(=O)c1ccc(OCC(=O)O)cc1	ZINC000872001602	EE	On-Demand	Mild	MMP13	15	43
C=CC(C)(C)CCCNS(=O)(=O)c1ccc(OCC(=O)O)cc1	ZINC000872001602	EE	On-Demand	Mild	PRTN3	56	38
O=C(O)c1cc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c[nH]1	ZINC000872001604	ED	On-Demand	Anodyne	OXTR	60	37
O=C(O)c1cc(S(=O)(=O)N2CC[C@@]3(CCc4ccccc43)C2)c[nH]1	ZINC000872001604	ED	On-Demand	Anodyne	AKR1C3	55	36
O=C(O)c1cc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c[nH]1	ZINC000872001605	ED	On-Demand	Anodyne	OXTR	60	37
O=C(O)c1cc(S(=O)(=O)N2CC[C@]3(CCc4ccccc43)C2)c[nH]1	ZINC000872001605	ED	On-Demand	Anodyne	AKR1C3	55	36
C=CC(C)(C)CCCNS(=O)(=O)Cc1ccc(C(=O)O)cc1	ZINC000872001608	EF	On-Demand	Mild	TMPRSS11D	50	33
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)N1CCc3ccccc3C1)CC2	ZINC000872001618	FD	On-Demand	Anodyne	AKR1C3	60	41
COc1ccccc1[C@@H]1CSCCCN1S(=O)(=O)c1c[nH]c(C(=O)O)c1	ZINC000872001631	GF	On-Demand	Anodyne	MMP13	18	43
COc1ccccc1[C@@H]1CSCCCN1S(=O)(=O)c1c[nH]c(C(=O)O)c1	ZINC000872001631	GF	On-Demand	Anodyne	MMP3	24	43
COc1ccccc1[C@@H]1CSCCCN1S(=O)(=O)c1c[nH]c(C(=O)O)c1	ZINC000872001631	GF	On-Demand	Anodyne	MMP1	23	43
Cc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c(C)c1	ZINC000872001633	DE	On-Demand	Anodyne	EPHX2	20	45
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	FKBP1A	25	41
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	CASP3	42	35
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	MMP3	40	39
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	CASP7	40	35
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	MMP7	41	38
COc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001646	ED	On-Demand	Anodyne	AKR1C3	22	40
Cc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)o1	ZINC000872001676	CD	On-Demand	Anodyne	LPL	41	31
CN(C)c1ccc(S(=O)(=O)N2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cn1	ZINC000872001690	FD	On-Demand	Anodyne	GCK	62	35
CN(C)c1ccc(S(=O)(=O)N2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cn1	ZINC000872001690	FD	On-Demand	Anodyne	GCKR	78	37
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(F)c(F)c1)CC2	ZINC000872001717	ED	On-Demand	Anodyne	APP	42	42
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@H](C(F)(F)F)O1	ZINC000872001732	FD	On-Demand	Anodyne	GCK	60	36
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@H](C(F)(F)F)O1	ZINC000872001732	FD	On-Demand	Anodyne	GCKR	81	36
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001733	FD	On-Demand	Anodyne	GCK	60	36
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001733	FD	On-Demand	Anodyne	GCKR	81	36
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001734	FD	On-Demand	Anodyne	GCK	60	36
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000872001734	FD	On-Demand	Anodyne	GCKR	81	36
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@H](C(F)(F)F)O1	ZINC000872001735	FD	On-Demand	Anodyne	GCK	60	36
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)O)nc2)CC[C@H](C(F)(F)F)O1	ZINC000872001735	FD	On-Demand	Anodyne	GCKR	81	36
Cc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001736	DE	On-Demand	Anodyne	AKR1C3	43	38
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccccc1C(F)(F)F)CC2	ZINC000872001776	FF	On-Demand	Anodyne	RBP4	44	37
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccccc1C(F)(F)F)CC2	ZINC000872001776	FF	On-Demand	Anodyne	SFRP1	118	34
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccccc1C(F)(F)F)CC2	ZINC000872001776	FF	On-Demand	Anodyne	WNT3	80	33
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(Br)cc1)CC2	ZINC000872001785	FE	On-Demand	Anodyne	MMP13	20	42
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(Br)cc1)CC2	ZINC000872001785	FE	On-Demand	Anodyne	MMP3	25	42
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(Br)cc1)CC2	ZINC000872001785	FE	On-Demand	Anodyne	MMP7	33	42
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(Br)cc1)CC2	ZINC000872001785	FE	On-Demand	Anodyne	MMP1	24	42
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc3c(c1)OCO3)CC2	ZINC000872001795	ED	On-Demand	Anodyne	PKM	35	40
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1OCC	ZINC000872001805	GF	On-Demand	Anodyne	CASP3	48	34
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1OCC	ZINC000872001805	GF	On-Demand	Anodyne	CASP7	48	37
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1OCC	ZINC000872001805	GF	On-Demand	Anodyne	HCN1	40	32
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1OCC	ZINC000872001805	GF	On-Demand	Anodyne	HCN4	41	32
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000872001814	DD	On-Demand	Anodyne	SLC6A4	16	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000872001814	DD	On-Demand	Anodyne	SLC6A3	40	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000872001815	DD	On-Demand	Anodyne	SLC6A4	16	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000872001815	DD	On-Demand	Anodyne	SLC6A3	40	43
Cc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872001817	DE	On-Demand	Anodyne	ITGA4	21	41
Cc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872001817	DE	On-Demand	Anodyne	CAPNS1	23	42
N#Cc1cccc(S(=O)(=O)N2CC[C@@]3(C(=O)O)CCC[C@@H]23)c1	ZINC000872001818	DD	On-Demand	Mild	ITGA4	57	36
CCOc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001829	EE	On-Demand	Anodyne	CASP3	51	37
CCOc1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001829	EE	On-Demand	Anodyne	CASP7	47	37
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cc(F)cc(F)c1)CC2	ZINC000872001854	ED	On-Demand	Anodyne	APP	16	40
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(Cl)cc1)CC2	ZINC000872001890	EE	On-Demand	Anodyne	APP	61	42
COc1cccc(CS(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872001899	ED	On-Demand	Anodyne	FKBP1A	22	45
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)c(C(=O)O)c1	ZINC000872001906	GE	On-Demand	Anodyne	EPHX2	20	43
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)c(C(=O)O)c1	ZINC000872001907	GE	On-Demand	Anodyne	EPHX2	20	43
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)c(C(=O)O)c1	ZINC000872001908	GE	On-Demand	Anodyne	EPHX2	20	43
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)c(C(=O)O)c1	ZINC000872001909	GE	On-Demand	Anodyne	EPHX2	20	43
COCC1(N(C)S(=O)(=O)c2ccc(OCCC(=O)O)cc2)CCC1	ZINC000872001925	FD	On-Demand	Anodyne	MMP1	21	42
CN1C(=O)Cc2cc(S(=O)(=O)N3CC[C@]4(C(=O)O)CCC[C@H]34)ccc21	ZINC000872001945	FD	On-Demand	Anodyne	CASP3	55	37
CN1C(=O)Cc2cc(S(=O)(=O)N3CC[C@]4(C(=O)O)CCC[C@H]34)ccc21	ZINC000872001945	FD	On-Demand	Anodyne	CASP7	56	39
COc1ccc(C(=O)O)cc1S(=O)(=O)NC1(C)CC(F)(F)C1	ZINC000872001955	ED	On-Demand	Anodyne	RARG	24	40
COc1ccc(C(=O)O)cc1S(=O)(=O)NC1(C)CC(F)(F)C1	ZINC000872001955	ED	On-Demand	Anodyne	RARB	25	40
COc1ccc(C(=O)O)cc1S(=O)(=O)NC1(C)CC(F)(F)C1	ZINC000872001955	ED	On-Demand	Anodyne	CPT1A	50	40
COc1ccc(C(=O)O)cc1S(=O)(=O)NC1(C)CC(F)(F)C1	ZINC000872001955	ED	On-Demand	Anodyne	CPT2	45	35
C[C@H]1CN(S(=O)(=O)c2cccc(CC(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872001963	GE	On-Demand	Anodyne	AKR1C3	57	38
C[C@H]1CN(S(=O)(=O)c2cccc(CC(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872001964	GE	On-Demand	Anodyne	AKR1C3	57	38
C[C@@H]1CN(S(=O)(=O)c2cccc(CC(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872001965	GE	On-Demand	Anodyne	AKR1C3	57	38
C[C@@H]1CN(S(=O)(=O)c2cccc(CC(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872001968	GE	On-Demand	Anodyne	AKR1C3	57	38
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc3c(c1)OCCCO3)CC2	ZINC000872002002	FD	On-Demand	Anodyne	PKM	39	45
COCC1(N(C)S(=O)(=O)c2cc(OC)ccc2C(=O)O)CCC1	ZINC000872002008	ED	On-Demand	Anodyne	AKR1C2	40	36
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc3ccccc3c1)CC2	ZINC000872002038	EF	On-Demand	Anodyne	TRY2_BOVIN	60	33
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc3ccccc3c1)CC2	ZINC000872002038	EF	On-Demand	Anodyne	AKR1C3	16	51
CC(=O)c1cccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872002042	ED	On-Demand	Anodyne	AKR1C3	62	43
COCCOc1ccc(F)cc1S(=O)(=O)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872002050	GD	On-Demand	Anodyne	ACKR3	45	33
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	CASP3	53	36
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP13	90	49
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	ADAM17	65	40
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP2	40	48
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP3	76	49
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP9	44	41
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	CASP7	58	38
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP7	73	49
COCCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002061	FD	On-Demand	Anodyne	MMP1	82	49
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc(C(F)F)o2)CC1	ZINC000872002067	FF	On-Demand	Anodyne	KCNQ2	44	36
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc(C(F)F)o2)CC1	ZINC000872002067	FF	On-Demand	Anodyne	CREBBP	44	36
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc(C(F)F)o2)CC1	ZINC000872002067	FF	On-Demand	Anodyne	BRD9	44	36
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(C(F)(F)F)cc1)CC2	ZINC000872002073	FF	On-Demand	Anodyne	HSD11B1	17	41
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872002084	FE	On-Demand	Anodyne	AVPR1B	46	33
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872002084	FE	On-Demand	Anodyne	CPT1A	85	42
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872002084	FE	On-Demand	Anodyne	CPT2	55	41
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872002084	FE	On-Demand	Anodyne	CPT1B	78	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3nc(C4CC4)cs3)cc2N1	ZINC000872002086	GH	On-Demand	Anodyne	PKM	35	45
COc1ccc(C(=O)O)c(S(=O)(=O)NC2(C)CC(F)(F)C2)c1	ZINC000872002124	ED	On-Demand	Anodyne	AKR1C3	22	40
COc1ccc(C(=O)O)c(S(=O)(=O)NC2(C)CC(F)(F)C2)c1	ZINC000872002124	ED	On-Demand	Anodyne	AKR1C2	46	40
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	FKBP1A	21	41
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	MMP13	53	38
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	MMP2	28	40
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	MMP3	53	40
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	CASP7	45	38
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	MMP7	56	38
COCCc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002134	FD	On-Demand	Anodyne	MMP1	50	38
CC(C)n1nccc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872002140	GG	On-Demand	Anodyne	PKM	43	50
CC(C)n1nccc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872002153	EG	On-Demand	Anodyne	P2RX7	46	43
CCOc1ccc(S(=O)(=O)Nc2nc(SC)n[nH]2)cc1C(C)C	ZINC000872002171	FF	On-Demand	Anodyne	MTNN	49	30
Cn1ncc(C(F)(F)F)c1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872002189	GE	On-Demand	Anodyne	MAPK10	15	40
Cn1ncc(C(F)(F)F)c1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872002189	GE	On-Demand	Anodyne	STAT6	46	31
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCn4ncnc43)cc2N1	ZINC000872002207	GD	On-Demand	Anodyne	PKM	19	40
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cccnc1N1CCOCC1	ZINC000872002251	GF	On-Demand	Anodyne	P2RX7	35	42
O=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1ccc2onc(Cl)c2c1	ZINC000872002257	GF	On-Demand	Anodyne	PLAU	15	42
COCC1(N(C)S(=O)(=O)c2cc(C(=O)O)ccc2OC)CCC1	ZINC000872002260	ED	On-Demand	Anodyne	CPT1A	46	36
COCC1(N(C)S(=O)(=O)c2cc(C(=O)O)ccc2OC)CCC1	ZINC000872002260	ED	On-Demand	Anodyne	CPT1B	50	34
O=C(O)c1cc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc(Br)c1Cl	ZINC000872002262	JI	On-Demand	Anodyne	KCNQ2	77	42
Cc1nc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)sc1C	ZINC000872002266	GG	On-Demand	Anodyne	PKM	43	53
O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cnn(C2CCCC2)c1	ZINC000872002272	GG	On-Demand	Clean	NPY5R	16	48
O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cnn(C2CCCC2)c1	ZINC000872002272	GG	On-Demand	Clean	KCNN1	27	43
N#Cc1cc(F)cc(S(=O)(=O)Nc2cccnc2N2CCCC2)c1	ZINC000872002275	EE	On-Demand	Mild	GRM5	21	42
CN1CCN(c2ccc(NS(=O)(=O)c3ccc4c(c3)nnn4C)cc2)CC1	ZINC000872002276	GD	On-Demand	Anodyne	HTR6	19	44
N#Cc1cc(F)cc(S(=O)(=O)Nc2ccc(N3CCOCC3)cn2)c1	ZINC000872002281	FD	On-Demand	Mild	STAT6	51	36
COCC1(N(C)S(=O)(=O)c2cccc(C(=O)O)c2)CCC1	ZINC000872002283	DD	On-Demand	Anodyne	AKR1C3	53	38
COCC1(N(C)S(=O)(=O)c2ccc(C(=O)O)cc2)CCC1	ZINC000872002289	DD	On-Demand	Anodyne	TRPM8	42	33
Cc1nc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)sc1C	ZINC000872002298	EH	On-Demand	Anodyne	CA2	25	41
Cc1nc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)sc1C	ZINC000872002298	EH	On-Demand	Anodyne	CA1	24	41
Cc1nc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)sc1C	ZINC000872002298	EH	On-Demand	Anodyne	CA4	39	41
CN1CCN(c2ccccc2NS(=O)(=O)c2cc(F)cc(C#N)c2)CC1	ZINC000872002304	FE	On-Demand	Mild	HTR6	18	43
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	MMP13	51	35
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	APP	41	34
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	ADAM17	52	38
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	MMP3	45	35
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	MMP7	50	35
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc(OCC(F)F)cc1)CC2	ZINC000872002313	GE	On-Demand	Anodyne	MMP1	54	37
COc1cc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)ccc1Cl	ZINC000872002314	FE	On-Demand	Anodyne	HTR4	51	34
COc1cc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)ccc1Cl	ZINC000872002314	FE	On-Demand	Anodyne	CASP3	40	34
COc1cc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)ccc1Cl	ZINC000872002314	FE	On-Demand	Anodyne	CASP7	43	34
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1ccc3c(c1)OCCO3)CC2	ZINC000872002320	FD	On-Demand	Anodyne	PKM	42	48
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	CASP3	41	35
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP13	88	42
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	APP	43	37
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	ADAM17	75	40
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP2	36	42
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP3	72	42
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP14	17	42
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP9	41	42
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP7	75	40
CCOc1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002328	EE	On-Demand	Anodyne	MMP1	78	42
CN(C)c1ccc(S(=O)(=O)N2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872002351	ED	On-Demand	Anodyne	MMP3	17	41
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872002354	GF	On-Demand	Anodyne	CACNA1B	51	36
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872002354	GF	On-Demand	Anodyne	CCR2	43	36
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872002354	GF	On-Demand	Anodyne	LIPG	41	32
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872002359	FF	On-Demand	Anodyne	CACNA1B	60	40
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872002359	FF	On-Demand	Anodyne	BDKRB1	18	41
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872002359	FF	On-Demand	Anodyne	SFRP1	78	33
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872002359	FF	On-Demand	Anodyne	WNT3	59	30
C[C@H]1CN(S(=O)(=O)c2cncc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872002366	FD	On-Demand	Anodyne	AKR1C3	22	46
C[C@H]1CN(S(=O)(=O)c2cncc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872002368	FD	On-Demand	Anodyne	AKR1C3	22	46
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cnccc1C(F)(F)F)CC2	ZINC000872002379	FE	On-Demand	Anodyne	SFRP1	68	34
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)c1cnccc1C(F)(F)F)CC2	ZINC000872002379	FE	On-Demand	Anodyne	WNT3	55	34
COCC1(N(C)S(=O)(=O)c2ccc(OCC(=O)O)cc2)CCC1	ZINC000872002389	ED	On-Demand	Anodyne	PLA2G4B	43	33
O=S(=O)(Nc1cccnc1N1CCOCC1)c1ccc2onc(Cl)c2c1	ZINC000872002417	GF	On-Demand	Anodyne	CREBBP	35	40
O=S(=O)(Nc1cccnc1N1CCOCC1)c1ccc2onc(Cl)c2c1	ZINC000872002417	GF	On-Demand	Anodyne	PIK3C3	42	43
O=S(=O)(Nc1cccnc1N1CCOCC1)c1ccc2onc(Cl)c2c1	ZINC000872002417	GF	On-Demand	Anodyne	BRD9	35	40
Cn1ncc(S(=O)(=O)Nc2ccc(N3CCCCC3)nc2)c1C(F)(F)F	ZINC000872002434	GF	On-Demand	Anodyne	DGAT1	15	40
CCOc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1C(C)C	ZINC000872002438	DE	On-Demand	Anodyne	MGAT1	51	29
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cnn(C2CCCC2)c1	ZINC000872002499	GF	On-Demand	Anodyne	MTOR	41	34
O=C(O)[C@]12CCC[C@H]1N(S(=O)(=O)Cc1ccc(Cl)cc1)CC2	ZINC000872002505	EE	On-Demand	Anodyne	PA	25	40
CCOc1ccc(S(=O)(=O)N2CCCn3ncnc32)cc1C(C)C	ZINC000872002513	FE	On-Demand	Anodyne	PDE5A	26	42
O=S(=O)(Cc1ccc(F)cc1Cl)N1CCCn2ncnc21	ZINC000872002517	ED	On-Demand	Anodyne	P2RX7	57	38
CN(C)c1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cn1	ZINC000872002544	GF	On-Demand	Anodyne	PKM	49	58
Cn1nccc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872002556	FE	On-Demand	Anodyne	PKM	44	53
CCOc1ccc(S(=O)(=O)Nc2nccs2)cc1C(C)C	ZINC000872002560	EG	On-Demand	Anodyne	MAP1	43	35
Cc1nc2cc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)ccc2o1	ZINC000872002566	EF	On-Demand	Anodyne	NR1I2	43	33
O=S(=O)(Nc1cccnc1N1CCCC1)c1ccc2onc(Cl)c2c1	ZINC000872002569	GG	On-Demand	Anodyne	HTR7	15	42
O=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1ccc(F)c(C(F)F)c1	ZINC000872002575	GF	On-Demand	Anodyne	STAT6	56	37
Cn1ncc(S(=O)(=O)Nc2ccc(N3CCOCC3)cn2)c1C(F)(F)F	ZINC000872002587	GD	On-Demand	Anodyne	STAT6	46	31
CN1CCN(c2ccccc2NS(=O)(=O)c2cn(C)nc2C(C)(C)C)CC1	ZINC000872002597	GE	On-Demand	Anodyne	CREBBP	43	38
CN1CCN(c2ccccc2NS(=O)(=O)c2cn(C)nc2C(C)(C)C)CC1	ZINC000872002597	GE	On-Demand	Anodyne	BRD9	43	38
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872002610	GG	On-Demand	Anodyne	STAT6	47	36
Cc1nc(NS(=O)(=O)Cc2ccc(F)cc2Cl)sc1C	ZINC000872002611	EG	On-Demand	Anodyne	P2RX7	42	38
Cn1ncc(S(=O)(=O)Nc2ccc(N3CCOCC3)cc2)c1C(F)(F)F	ZINC000872002628	GE	On-Demand	Anodyne	STAT6	53	32
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1C(F)(F)F	ZINC000872002632	FF	On-Demand	Anodyne	KCNQ2	69	40
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1C(F)(F)F	ZINC000872002632	FF	On-Demand	Anodyne	SFRP1	64	33
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1C(F)(F)F	ZINC000872002632	FF	On-Demand	Anodyne	WNT3	56	33
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc3c(c2)nnn3C)CC1	ZINC000872002652	GD	On-Demand	Anodyne	HTR6	25	48
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc3c(c2)nnn3C)CC1	ZINC000872002652	GD	On-Demand	Anodyne	CREBBP	46	43
CN1CCN(c2ccccc2NS(=O)(=O)c2ccc3c(c2)nnn3C)CC1	ZINC000872002652	GD	On-Demand	Anodyne	BRD9	46	43
CN1CCN(c2ccccc2NS(=O)(=O)c2c3c(nn2C)CCCC3)CC1	ZINC000872002655	GD	On-Demand	Anodyne	CREBBP	42	38
CN1CCN(c2ccccc2NS(=O)(=O)c2c3c(nn2C)CCCC3)CC1	ZINC000872002655	GD	On-Demand	Anodyne	BRD9	42	38
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1ccc(N2CCOCC2)cn1	ZINC000872002668	GF	On-Demand	Anodyne	P2RX7	34	44
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1ccc(N2CCOCC2)cn1	ZINC000872002668	GF	On-Demand	Anodyne	STAT6	57	38
CCOc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(C)C	ZINC000872002669	DG	On-Demand	Anodyne	ADRB2	16	42
CCOc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(C)C	ZINC000872002669	DG	On-Demand	Anodyne	ADRB3	50	42
CCOc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(C)C	ZINC000872002669	DG	On-Demand	Anodyne	ALPL	31	64
CCOc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(C)C	ZINC000872002669	DG	On-Demand	Anodyne	MTNN	44	32
N#Cc1cc(F)cc(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)c1	ZINC000872002675	EE	On-Demand	Mild	FASN	16	40
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc2onc(Cl)c2c1	ZINC000872002703	FG	On-Demand	Anodyne	CA2	30	42
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc2onc(Cl)c2c1	ZINC000872002703	FG	On-Demand	Anodyne	CA1	32	42
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc2onc(Cl)c2c1	ZINC000872002703	FG	On-Demand	Anodyne	CA4	58	42
CC(C)c1cc(NS(=O)(=O)Cc2ccc(F)cc2Cl)no1	ZINC000872002705	EH	On-Demand	Anodyne	P2RX7	47	45
CCOc1ccc(S(=O)(=O)Nc2ccc(=O)n(C)c2)cc1C(C)C	ZINC000872002711	FF	On-Demand	Anodyne	MGAT1	47	35
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872002712	EG	On-Demand	Anodyne	CA2	31	44
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872002712	EG	On-Demand	Anodyne	CA1	29	44
O=S(=O)(Nc1nnc(C2CC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872002712	EG	On-Demand	Anodyne	CA4	49	44
CCC[C@H](C)c1cc(NS(=O)(=O)c2cccc(F)c2OC)n[nH]1	ZINC000872002719	EG	On-Demand	Anodyne	MTNN	56	32
CCOc1ccc(S(=O)(=O)Nc2onc(C)c2C)cc1C(C)C	ZINC000872002730	EH	On-Demand	Anodyne	EDNRA	79	55
CN(C)c1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)nc1	ZINC000872002733	GF	On-Demand	Anodyne	PKM	43	51
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	CA2	34	49
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	CA1	37	49
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	CA4	65	49
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	CYNT	19	46
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	ALPI	26	41
Cc1nnc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)s1	ZINC000872002743	EG	On-Demand	Anodyne	A6YCJ1_9METZ	24	40
CCOC(=O)c1nnc(NS(=O)(=O)Cc2ccc(F)cc2Cl)s1	ZINC000872002766	GE	On-Demand	Anodyne	TLR4	15	41
Cc1cncc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1	ZINC000872002769	FG	On-Demand	Anodyne	PKM	49	59
CCOc1ccc(S(=O)(=O)Nc2n[nH]c(C)c2C)cc1C(C)C	ZINC000872002784	EG	On-Demand	Anodyne	MTNN	44	31
O=C(O)c1cc(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)cc(Br)c1Cl	ZINC000872002786	JI	On-Demand	Anodyne	NPY2R	46	36
O=C(O)c1cc(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)cc(Br)c1Cl	ZINC000872002786	JI	On-Demand	Anodyne	SLC6A9	18	42
CN(c1ccccn1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872002836	FF	On-Demand	Anodyne	PKM	28	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1ccnc1	ZINC000872002886	FF	On-Demand	Anodyne	CASP3	89	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1ccnc1	ZINC000872002886	FF	On-Demand	Anodyne	CASP7	98	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1ccnc1	ZINC000872002888	FF	On-Demand	Anodyne	CASP3	89	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1ccnc1	ZINC000872002888	FF	On-Demand	Anodyne	CASP7	98	39
Cc1ccncc1N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872002892	GG	On-Demand	Anodyne	PKM	36	44
CCOc1ccc(S(=O)(=O)Nc2cnc(C)nc2)cc1C(C)C	ZINC000872002897	EG	On-Demand	Anodyne	ALPL	30	47
CCOc1ccc(S(=O)(=O)Nc2cnc(C)nc2)cc1C(C)C	ZINC000872002897	EG	On-Demand	Anodyne	MTNN	41	31
CCOc1ccc(S(=O)(=O)Nc2cnc(C)nc2)cc1C(C)C	ZINC000872002897	EG	On-Demand	Anodyne	MGAT1	44	31
Cc1nc2cc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)ccc2n1C	ZINC000872002913	FF	On-Demand	Anodyne	NR1I2	57	40
CCOc1ccc(S(=O)(=O)Nc2nnc(C)s2)cc1C(C)C	ZINC000872002924	EG	On-Demand	Anodyne	CA1	34	40
CCOc1ccc(S(=O)(=O)Nc2nnc(C)s2)cc1C(C)C	ZINC000872002924	EG	On-Demand	Anodyne	CA4	62	40
CCOc1ccc(S(=O)(=O)Nc2nnc(C)s2)cc1C(C)C	ZINC000872002924	EG	On-Demand	Anodyne	CA9	16	40
CCOc1ccc(S(=O)(=O)Nc2nnc(C)s2)cc1C(C)C	ZINC000872002924	EG	On-Demand	Anodyne	ALPI	27	41
CN(C(C)(C)C#N)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872002943	FF	On-Demand	Mild	PKM	28	42
CCOc1ccc(S(=O)(=O)Nc2ccc(=O)n(CC)c2)cc1C(C)C	ZINC000872002945	FG	On-Demand	Anodyne	MGAT1	45	34
CCOC(=O)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872002979	GF	On-Demand	Anodyne	CA2	36	45
CCOC(=O)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872002979	GF	On-Demand	Anodyne	CA1	38	45
CCOC(=O)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872002979	GF	On-Demand	Anodyne	CA4	66	45
CCOC(=O)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872002979	GF	On-Demand	Anodyne	CA9	15	45
CCOC(=O)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872002979	GF	On-Demand	Anodyne	LEF	33	41
CCOc1ccc(S(=O)(=O)Nc2cccnc2C)cc1C(C)C	ZINC000872002980	EH	On-Demand	Anodyne	CCR2	15	48
CCOc1ccc(S(=O)(=O)Nc2cccnc2C)cc1C(C)C	ZINC000872002980	EH	On-Demand	Anodyne	MTNN	41	32
COc1cccc(Br)c1CS(=O)(=O)Nc1onc(C)c1C	ZINC000872002988	GG	On-Demand	Anodyne	EDNRA	59	52
CCOc1ccc(S(=O)(=O)Nc2nccc(=O)n2C)cc1C(C)C	ZINC000872003150	FE	On-Demand	Anodyne	PDE5A	33	43
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cnc(C2CC2)nc1	ZINC000872003163	EG	On-Demand	Anodyne	P2RX7	40	36
N#Cc1ccc(NS(=O)(=O)c2cc(Br)c(Cl)c(C(=O)O)c2)cc1C(F)(F)F	ZINC000872003167	JI	On-Demand	Mild	AR	32	45
N#CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003184	DD	On-Demand	Mild	PKM	40	50
CC(C)c1nnc(NS(=O)(=O)c2ccc3onc(Cl)c3c2)s1	ZINC000872003200	FG	On-Demand	Anodyne	CA2	31	43
CC(C)c1nnc(NS(=O)(=O)c2ccc3onc(Cl)c3c2)s1	ZINC000872003200	FG	On-Demand	Anodyne	CA1	37	43
CC(C)c1nnc(NS(=O)(=O)c2ccc3onc(Cl)c3c2)s1	ZINC000872003200	FG	On-Demand	Anodyne	CA4	65	43
CN(c1cccnc1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003214	FF	On-Demand	Anodyne	PKM	28	41
CC(C)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872003223	FH	On-Demand	Anodyne	CA2	35	46
CC(C)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872003223	FH	On-Demand	Anodyne	CA1	38	46
CC(C)c1nnc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872003223	FH	On-Demand	Anodyne	CA4	66	46
Cn1ncc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)c1C(F)(F)F	ZINC000872003225	ED	On-Demand	Anodyne	PKNB	71	36
Cc1ccncc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003269	FG	On-Demand	Anodyne	PKM	47	57
CCOc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1C(C)C	ZINC000872003270	GH	On-Demand	Anodyne	CA4	57	37
CCOc1ccc(S(=O)(=O)Nc2ncc(C)cn2)cc1C(C)C	ZINC000872003282	EG	On-Demand	Anodyne	ALPL	16	41
CN(c1ccn(C)n1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003316	FE	On-Demand	Anodyne	PKM	33	42
CC(C)c1cc(NS(=O)(=O)Cc2ccc(F)cc2Cl)n[nH]1	ZINC000872003392	EG	On-Demand	Anodyne	P2RX7	38	45
CSc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)nc1	ZINC000872003452	GH	On-Demand	Anodyne	PKM	42	51
Cc1nc2cc(NS(=O)(=O)c3cnn(C)c3C(F)(F)F)ccc2n1C	ZINC000872003457	FE	On-Demand	Anodyne	NR1I2	49	39
Cn1ncc(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)c1C(F)(F)F	ZINC000872003463	GF	On-Demand	Anodyne	PKM	16	40
CCOC(=O)c1nc(NS(=O)(=O)Cc2ccc(F)cc2Cl)oc1C	ZINC000872003478	GF	On-Demand	Anodyne	P2RX7	40	39
CCOC(=O)c1nc(NS(=O)(=O)Cc2ccc(F)cc2Cl)oc1C	ZINC000872003478	GF	On-Demand	Anodyne	TLR4	15	41
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)c1	ZINC000872003500	ED	On-Demand	Mild	CASP3	64	37
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)c1	ZINC000872003500	ED	On-Demand	Mild	CASP7	71	37
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000872003501	ED	On-Demand	Mild	CASP3	64	37
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000872003501	ED	On-Demand	Mild	CASP7	71	37
CCOc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1C(C)C	ZINC000872003587	DG	On-Demand	Anodyne	PPIA	18	47
COCCc1nc2cc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)ccc2o1	ZINC000872003600	GF	On-Demand	Anodyne	NR1I2	45	32
O=S(=O)(Nc1cc(C2CC2)[nH]n1)c1ccc(F)c(C(F)F)c1	ZINC000872003631	EG	On-Demand	Anodyne	PKNB	68	40
CC(C)c1cc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)no1	ZINC000872003679	EH	On-Demand	Anodyne	PPIA	15	40
CN(C)c1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1Cl	ZINC000872003727	GF	On-Demand	Anodyne	SGK1	40	35
O=S(=O)(c1ccc2onc(Cl)c2c1)N1CCC[C@@H]1Cn1ccnc1	ZINC000872003785	FF	On-Demand	Anodyne	CASP3	79	36
O=S(=O)(c1ccc2onc(Cl)c2c1)N1CCC[C@@H]1Cn1ccnc1	ZINC000872003785	FF	On-Demand	Anodyne	CASP7	87	35
O=S(=O)(c1ccc2onc(Cl)c2c1)N1CCC[C@H]1Cn1ccnc1	ZINC000872003786	FF	On-Demand	Anodyne	CASP3	79	36
O=S(=O)(c1ccc2onc(Cl)c2c1)N1CCC[C@H]1Cn1ccnc1	ZINC000872003786	FF	On-Demand	Anodyne	CASP7	87	35
Cc1c(C(F)(F)F)nn(C)c1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872003807	GG	On-Demand	Anodyne	P2RX7	46	42
Cn1ncc(S(=O)(=O)Nc2ncc(C3CCCCC3)s2)c1C(F)(F)F	ZINC000872003839	GH	On-Demand	Anodyne	CDK5	41	35
C[C@H](C#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003885	ED	On-Demand	Mild	PKM	39	48
C[C@@H](C#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003886	ED	On-Demand	Mild	PKM	39	48
COCCc1cc(NS(=O)(=O)Cc2ccc(F)cc2Cl)n(C)n1	ZINC000872003910	FE	On-Demand	Anodyne	P2RX7	39	41
Cc1nc(N2CCOCC2)ccc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872003932	GF	On-Demand	Anodyne	P2RX7	47	41
Cc1nc(N2CCOCC2)ccc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872003932	GF	On-Demand	Anodyne	PIK3CB	43	39
O=C(O)c1cc(S(=O)(=O)Nc2cccc(-c3nn[nH]n3)c2)cc(Br)c1Cl	ZINC000872003934	JF	On-Demand	Anodyne	MTNN	78	36
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cccc(CN2CCOCC2)n1	ZINC000872003942	GF	On-Demand	Anodyne	P2RX7	31	44
CC[C@H](C#N)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872003945	CE	On-Demand	Mild	LEF	32	43
CC[C@H](C#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872003946	EE	On-Demand	Mild	PKM	38	46
CNS(=O)(=O)c1ccccc1NS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1	ZINC000872004060	JF	On-Demand	Anodyne	PRTN3	53	33
O=S(=O)(Nc1cc(C2CCOCC2)[nH]n1)c1ccc2c3c(cccc13)CC2	ZINC000872004088	GG	On-Demand	Anodyne	PKNB	62	37
N#CC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872004105	ED	On-Demand	Mild	PKM	36	47
O=S(=O)(Nc1nnc(CC(F)(F)F)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004109	GH	On-Demand	Anodyne	CA2	30	43
O=S(=O)(Nc1nnc(CC(F)(F)F)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004109	GH	On-Demand	Anodyne	CA1	33	43
O=S(=O)(Nc1nnc(CC(F)(F)F)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004109	GH	On-Demand	Anodyne	CA4	58	43
CCOc1ccc(S(=O)(=O)Nc2cc(C)c(=O)n(C)c2)cc1C(C)C	ZINC000872004112	FG	On-Demand	Anodyne	MGAT1	43	32
CN(C1(C#N)CCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872004115	FF	On-Demand	Mild	PKM	31	42
N#C[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCCCC1	ZINC000872004131	EH	On-Demand	Mild	LEF	25	48
N#C[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCCCC1	ZINC000872004132	EH	On-Demand	Mild	LEF	25	48
O=C(O)c1cc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc(Br)c1Cl	ZINC000872004282	JK	On-Demand	Anodyne	CCR2	16	52
C[C@@H](CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)Cn1ccnc1	ZINC000872004284	EF	On-Demand	Anodyne	TBXAS1	15	45
C[C@H](CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)Cn1ccnc1	ZINC000872004285	EF	On-Demand	Anodyne	TBXAS1	15	45
CCOc1ccc(S(=O)(=O)Nc2c[nH]nc2C)cc1C(C)C	ZINC000872004302	DG	On-Demand	Anodyne	MTNN	51	32
CN(C1(C#N)CCCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872004309	GG	On-Demand	Mild	PKM	31	42
O=S(=O)(Nc1cnccc1N1CCCC1)c1ccc2onc(Cl)c2c1	ZINC000872004331	GG	On-Demand	Anodyne	PIK3CA	15	44
O=S(=O)(Nc1cnccc1N1CCCC1)c1ccc2onc(Cl)c2c1	ZINC000872004331	GG	On-Demand	Anodyne	PIK3C3	40	40
COc1ncnc(N(C)C)c1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872004364	FD	On-Demand	Anodyne	EDNRA	15	48
CCCc1cc(NS(=O)(=O)Cc2ccc(F)cc2Cl)n(C)n1	ZINC000872004374	EG	On-Demand	Anodyne	P2RX7	43	42
O=S(=O)(Nc1cc(C2CCOCC2)[nH]n1)c1ccc(F)c(C(F)F)c1	ZINC000872004387	GG	On-Demand	Anodyne	PKNB	43	35
O=C1CCCN1c1ccc(NS(=O)(=O)Cc2ccc(F)cc2Cl)nc1	ZINC000872004389	GF	On-Demand	Anodyne	P2RX7	45	47
CCOc1ccc(S(=O)(=O)N2CCn3nccc32)cc1C(C)C	ZINC000872004424	EF	On-Demand	Anodyne	PDE5A	28	43
CC(C)(C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872004442	CF	On-Demand	Anodyne	LEF	30	40
O=S(=O)(N[C@@H](C1CC1)C(F)(F)F)c1ccc(F)c(C(F)F)c1	ZINC000872004443	EG	On-Demand	Anodyne	LEF	32	44
O=S(=O)(N[C@H](C1CC1)C(F)(F)F)c1ccc(F)c(C(F)F)c1	ZINC000872004444	EG	On-Demand	Anodyne	LEF	32	44
O=S(=O)(Nc1cc(Cl)cnc1Cl)c1cnn(C2CCCC2)c1	ZINC000872004451	FH	On-Demand	Anodyne	PIK3C3	46	32
O=S(=O)(Nc1nnc(C2CCOCC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004455	GG	On-Demand	Anodyne	CA2	27	41
O=S(=O)(Nc1nnc(C2CCOCC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004455	GG	On-Demand	Anodyne	CA1	23	41
O=S(=O)(Nc1nnc(C2CCOCC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004455	GG	On-Demand	Anodyne	CA4	34	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCn4nccc43)cc2N1	ZINC000872004457	FE	On-Demand	Anodyne	PKM	18	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC(F)F)cc2N1	ZINC000872004459	EE	On-Demand	Anodyne	PKM	42	50
CCOc1ccc(S(=O)(=O)Nc2nc3n(n2)CCCC3)cc1C(C)C	ZINC000872004461	FF	On-Demand	Anodyne	PDE5A	25	40
Cc1nc(NS(=O)(=O)Cc2ccc(F)cc2Cl)nn1C	ZINC000872004478	DD	On-Demand	Anodyne	P2RX7	50	44
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)Cn1ccnc1	ZINC000872004499	GE	On-Demand	Anodyne	PKM	37	46
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)Cn1ccnc1	ZINC000872004500	GE	On-Demand	Anodyne	PKM	37	46
CCOc1ccc(S(=O)(=O)Nc2cn[nH]c2)cc1C(C)C	ZINC000872004521	DF	On-Demand	Anodyne	ALPL	16	41
CCOc1ccc(S(=O)(=O)Nc2cn[nH]c2)cc1C(C)C	ZINC000872004521	DF	On-Demand	Anodyne	MTNN	52	32
CCOc1ccc(S(=O)(=O)Nc2cn[nH]c2)cc1C(C)C	ZINC000872004521	DF	On-Demand	Anodyne	MGAT1	45	31
C[C@@H](C#N)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872004572	CD	On-Demand	Mild	LEF	36	42
C[C@H](C#N)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872004573	CD	On-Demand	Mild	LEF	36	42
Cn1nc2c(c1NS(=O)(=O)c1cc3c(cc1Cl)CCCC(=O)N3)CCC2	ZINC000872004586	GF	On-Demand	Anodyne	PKM	41	51
N#CC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCCC1	ZINC000872004591	GG	On-Demand	Mild	PKM	33	45
O=S(=O)(Cc1ccc(F)cc1Cl)N1CCn2nccc21	ZINC000872004626	DE	On-Demand	Anodyne	P2RX7	50	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCc2ncccc21	ZINC000872004665	EG	On-Demand	Anodyne	CYP11B2	26	42
O=S(=O)(Nc1ncc(C2CCOCC2)s1)c1ccc2onc(Cl)c2c1	ZINC000872004680	GH	On-Demand	Anodyne	CDK5	42	33
O=S(=O)(Cc1ccc(F)cc1Cl)N1CCCc2ncccc21	ZINC000872004695	EG	On-Demand	Anodyne	P2RX7	40	46
Cn1ncc(C(F)(F)F)c1S(=O)(=O)N(CC(F)(F)F)c1ccccc1	ZINC000872004699	GG	On-Demand	Anodyne	NR1I2	22	42
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cc(C2CCOCC2)[nH]n1	ZINC000872004783	FG	On-Demand	Anodyne	P2RX7	43	38
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cc(C2CCOCC2)[nH]n1	ZINC000872004783	FG	On-Demand	Anodyne	PKNB	46	38
CN(CC#N)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872004803	ED	On-Demand	Mild	PKM	31	42
Cn1nc2c(c1NS(=O)(=O)Cc1ccc(F)cc1Cl)CCC2	ZINC000872004809	EF	On-Demand	Anodyne	P2RX7	46	39
Cn1ncc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)c1C(F)(F)F	ZINC000872004818	FF	On-Demand	Anodyne	PKNB	47	34
CCCc1cc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n(C)n1	ZINC000872004842	GG	On-Demand	Anodyne	PKM	39	48
CC[C@H](C#N)NS(=O)(=O)c1ccc2onc(Cl)c2c1	ZINC000872004848	CE	On-Demand	Mild	MMP12	40	36
Cc1cc(C)c(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c(C)c1	ZINC000872004850	EG	On-Demand	Anodyne	FFAR4	27	42
CCOc1ccc(S(=O)(=O)Nc2ncccn2)cc1C(C)C	ZINC000872004853	DF	On-Demand	Anodyne	ALPL	18	42
CC[C@H](C#N)NS(=O)(=O)c1ccccc1NC(=O)C(F)(F)F	ZINC000872004859	ED	On-Demand	Mild	CTSF	49	32
Cn1nc2c(c1S(=O)(=O)Nc1cc(Cl)cnc1Cl)CCCC2	ZINC000872004891	FF	On-Demand	Anodyne	PIK3C3	44	31
CC1(C)C[C@@]1(C#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872004963	FF	On-Demand	Mild	PKM	36	47
O=S(=O)(Nc1ncc(C2CCOCC2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872004968	GH	On-Demand	Anodyne	CDK5	42	33
Cc1cnc2c(c1)N(S(=O)(=O)Cc1ccc(F)cc1Cl)CC2	ZINC000872004975	EG	On-Demand	Anodyne	P2RX7	50	40
O=S1(=O)CCN(S(=O)(=O)Cc2ccc(F)cc2Cl)[C@H](C2CC2)C1	ZINC000872004992	GD	On-Demand	Anodyne	P2RX7	35	41
O=S1(=O)CCN(S(=O)(=O)Cc2ccc(F)cc2Cl)[C@@H](C2CC2)C1	ZINC000872004995	GD	On-Demand	Anodyne	P2RX7	35	41
N#Cc1cc(F)cc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)c1	ZINC000872005037	EF	On-Demand	Mild	PKNB	46	38
Cc1cc(C)c(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c(C)c1	ZINC000872005065	EG	On-Demand	Anodyne	FFAR4	31	43
CCOc1ccc(S(=O)(=O)Nc2cnc(O)c(C)c2)cc1C(C)C	ZINC000872005076	FG	On-Demand	Anodyne	ALPL	24	40
CCOc1ccc(S(=O)(=O)Nc2c(C(F)F)n[nH]c2C)cc1C(C)C	ZINC000872005077	FH	On-Demand	Anodyne	MTNN	46	31
CCN(CC)Cc1cccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c1	ZINC000872005091	GG	On-Demand	Anodyne	NR1I2	40	34
O=S1(=O)CCN(CCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872005113	GC	On-Demand	Anodyne	HTR7	29	41
Cc1nnc(N(C)S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)s1	ZINC000872005116	GF	On-Demand	Anodyne	PKM	25	41
C[C@H](C#N)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005127	EE	On-Demand	Mild	PKM	30	41
C[C@@H](C#N)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005129	EE	On-Demand	Mild	PKM	30	41
CCOc1ccc(S(=O)(=O)Nc2c(C)ccnc2C)cc1C(C)C	ZINC000872005140	EI	On-Demand	Anodyne	FFAR4	31	41
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1ncn(CC(F)(F)F)n1	ZINC000872005175	FF	On-Demand	Anodyne	P2RX7	29	40
CC(C)(C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005180	EF	On-Demand	Anodyne	PKM	42	54
O=S(=O)(NCC(F)(F)F)c1ccc(F)c(C(F)F)c1	ZINC000872005195	DF	On-Demand	Anodyne	PNMT	15	49
CN(c1cccnn1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005198	FE	On-Demand	Anodyne	PKM	27	40
O=S(=O)(Nc1cnc(CC2CC2)nc1)c1ccc2onc(Cl)c2c1	ZINC000872005220	FG	On-Demand	Anodyne	PIK3C3	44	31
Cn1ncc(S(=O)(=O)N(CC(F)(F)F)c2ccccc2)c1C(F)(F)F	ZINC000872005336	GG	On-Demand	Anodyne	NR1I2	22	44
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1ncccc1N1CCOCC1	ZINC000872005376	GF	On-Demand	Anodyne	P2RX7	37	48
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cc([C@H]2CCCO2)[nH]n1	ZINC000872005402	FF	On-Demand	Anodyne	P2RX7	43	37
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cc([C@@H]2CCCO2)[nH]n1	ZINC000872005403	FF	On-Demand	Anodyne	P2RX7	43	37
CCN(CC)Cc1cccc(NS(=O)(=O)c2cc(Br)c(Cl)c(C(=O)O)c2)c1	ZINC000872005409	JI	On-Demand	Anodyne	NR1I2	40	38
CCN(CC)Cc1cccc(NS(=O)(=O)c2cc(Br)c(Cl)c(C(=O)O)c2)c1	ZINC000872005409	JI	On-Demand	Anodyne	LIMK2	31	44
CCOC(=O)c1cnn(C)c1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872005425	GE	On-Demand	Anodyne	P2RY12	15	40
CCOC(=O)c1cnn(C)c1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872005425	GE	On-Demand	Anodyne	P2RX7	46	45
CCOC(=O)c1cnn(C)c1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872005425	GE	On-Demand	Anodyne	TLR4	15	43
CN(c1cccc2cccnc12)S(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872005428	FG	On-Demand	Anodyne	C0L093_TOBAC	41	32
CCOc1ccc(S(=O)(=O)N2CCCn3nccc32)cc1C(C)C	ZINC000872005456	EG	On-Demand	Anodyne	PDE5A	24	42
O=S(=O)(NCC(F)(F)C(F)F)c1ccc(F)c(C(F)F)c1	ZINC000872005552	EF	On-Demand	Mild	PNMT	15	42
CN1Cc2cccc(NS(=O)(=O)Cc3ccc(F)cc3Cl)c2C1	ZINC000872005570	FG	On-Demand	Anodyne	P2RX7	43	37
CN(c1ncccn1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005590	FE	On-Demand	Anodyne	PKM	29	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC(F)(F)C(F)F)cc2N1	ZINC000872005647	GF	On-Demand	Anodyne	PKM	37	44
O=S(=O)(Cc1ccc(F)cc1Cl)NCC(F)(F)F	ZINC000872005652	DE	On-Demand	Anodyne	P2RX7	43	37
O=S(=O)(Cc1ccc(F)cc1Cl)Nc1cncc(N2CCCC2)n1	ZINC000872005666	FF	On-Demand	Anodyne	P2RX7	42	37
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC(F)(F)F)cc2N1	ZINC000872005708	FE	On-Demand	Anodyne	PKM	39	47
CCc1ncsc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872005769	GG	On-Demand	Anodyne	PKM	39	48
Cc1c(C2CCCCC2)noc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872005792	GH	On-Demand	Anodyne	EDNRA	17	40
CCc1ncsc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872005799	EG	On-Demand	Anodyne	P2RX7	31	42
CN(C)CCc1ccccc1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872005810	FH	On-Demand	Anodyne	HTR6	15	43
O=S(=O)(Cc1ccc(F)cc1Cl)N1CCCn2nccc21	ZINC000872005811	EE	On-Demand	Anodyne	P2RX7	41	37
O=S(=O)(Nc1ncccc1N1CCOCC1)c1ccc2onc(Cl)c2c1	ZINC000872005860	GF	On-Demand	Anodyne	PIK3C3	23	42
COc1cncc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000872005882	DF	On-Demand	Anodyne	FFAR4	25	41
COc1cncc(NS(=O)(=O)c2ccc3c(c2)N(C)CC3)c1	ZINC000872005890	DD	On-Demand	Anodyne	HTR6	17	40
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)Nc1cncc(OC)c1	ZINC000872005898	GF	On-Demand	Anodyne	ALPL	21	48
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2ncc3c(n2)COC3)cc1	ZINC000872005908	FF	On-Demand	Anodyne	PRTN3	44	31
COc1cncc(NS(=O)(=O)c2ccc(OC(C)C)cc2)c1	ZINC000872005909	DF	On-Demand	Anodyne	MMP13	15	40
COc1cncc(NS(=O)(=O)c2ccc(OC(C)C)cc2)c1	ZINC000872005909	DF	On-Demand	Anodyne	FFAR4	27	45
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA2	33	49
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	ADRB2	26	48
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	ADRB1	19	48
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	ADRB3	77	48
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	NQO2	57	41
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA1	35	49
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA7	15	41
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA14	21	41
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	MTNR1A	83	42
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	MTNR1B	75	41
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA12	24	49
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	CA9	29	47
COc1cncc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1	ZINC000872005921	ED	On-Demand	Anodyne	LIMK2	28	45
COc1cncc(NS(=O)(=O)c2ccc(OC)c(C)c2C)c1	ZINC000872005933	DF	On-Demand	Anodyne	ALPL	23	49
Cn1nc(C2CCOCC2)cc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872005942	GG	On-Demand	Anodyne	P2RX7	44	41
COc1cncc(NS(=O)(=O)c2cc(Cl)ccc2OC[C@@H]2CCOC2)c1	ZINC000872005943	GF	On-Demand	Anodyne	ALPL	21	49
COc1cncc(NS(=O)(=O)c2cc(Cl)ccc2OC[C@H]2CCOC2)c1	ZINC000872005944	GF	On-Demand	Anodyne	ALPL	21	49
COc1cncc(NS(=O)(=O)c2cc(C)sc2C)c1	ZINC000872005946	CF	On-Demand	Anodyne	ALPL	19	40
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1	ZINC000872005949	EE	On-Demand	Anodyne	PKM	44	53
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1	ZINC000872005949	EE	On-Demand	Anodyne	MGAT1	41	41
COc1cncc(NS(=O)(=O)c2cc(C)cc(C)c2OC)c1	ZINC000872006001	DF	On-Demand	Anodyne	ALPL	23	44
COc1cncc(NS(=O)(=O)c2cc(C)cc(C)c2OC)c1	ZINC000872006001	DF	On-Demand	Anodyne	FFAR4	22	41
COc1cncc(NS(=O)(=O)c2cc(C)c(OC)c(C)c2)c1	ZINC000872006010	DF	On-Demand	Anodyne	FFAR4	25	41
COc1cncc(NS(=O)(=O)c2cc(C)oc2C)c1	ZINC000872006023	CE	On-Demand	Anodyne	ALPL	19	42
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cc(C)nc(C)n2)c1	ZINC000872006031	FG	On-Demand	Anodyne	CA6	18	48
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cc(C)nc(C)n2)c1	ZINC000872006031	FG	On-Demand	Anodyne	CA7	22	48
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cc(C)nc(C)n2)c1	ZINC000872006031	FG	On-Demand	Anodyne	CA13	44	48
COc1cncc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	ZINC000872006032	EE	On-Demand	Anodyne	PKM	32	45
COc1cncc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	ZINC000872006032	EE	On-Demand	Anodyne	FFAR4	25	48
COc1cncc(NS(=O)(=O)c2c(C)cc(OC)cc2C)c1	ZINC000872006046	DF	On-Demand	Anodyne	FFAR4	18	43
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ccc(-n2cccn2)nc1	ZINC000872006054	EG	On-Demand	Anodyne	AMP1_PLAFQ	40	33
COc1cncc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)c1	ZINC000872006075	ED	On-Demand	Anodyne	MAPK14	36	40
COc1cncc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)c1	ZINC000872006075	ED	On-Demand	Anodyne	AKR1C3	18	42
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCC3)c1	ZINC000872006077	DE	On-Demand	Anodyne	CYP11B2	19	42
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	CA1	15	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	MMP13	19	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	CA4	16	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	MMP2	19	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	MMP8	15	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	FFAR4	24	40
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1	ZINC000872006082	EF	On-Demand	Anodyne	LIMK2	25	44
COCCCOc1ccc(Cl)cc1S(=O)(=O)Nc1cncc(OC)c1	ZINC000872006091	GF	On-Demand	Anodyne	CPT1A	46	39
COCCCOc1ccc(Cl)cc1S(=O)(=O)Nc1cncc(OC)c1	ZINC000872006091	GF	On-Demand	Anodyne	CPT1B	41	39
COCCCOc1ccc(Cl)cc1S(=O)(=O)Nc1cncc(OC)c1	ZINC000872006091	GF	On-Demand	Anodyne	ALPL	25	54
CCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)c(C)c1	ZINC000872006098	DF	On-Demand	Anodyne	CYP11B2	15	43
CCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)c(C)c1	ZINC000872006098	DF	On-Demand	Anodyne	ALPL	26	45
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA2	26	51
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	ADRB3	18	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA1	32	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP13	39	42
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA4	22	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA14	16	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP2	29	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP3	18	42
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP8	21	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP9	19	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP12	44	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA12	34	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MMP7	15	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	CA9	28	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	LEF	15	42
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	IDO1	30	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	MTCA1	27	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000872006101	EE	On-Demand	Anodyne	P96878_MYCTU	31	41
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)c1	ZINC000872006112	FD	On-Demand	Anodyne	CYP11B1	40	63
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)c1	ZINC000872006112	FD	On-Demand	Anodyne	CYP11B2	45	63
CC(=O)Nc1ncc(S(=O)(=O)NC2(CN3CCCCC3)CCC2)s1	ZINC000872006113	FD	On-Demand	Anodyne	MGEA5	32	40
COc1cncc(NS(=O)(=O)c2ccc(OC3CC3)cc2)c1	ZINC000872006125	DE	On-Demand	Anodyne	FFAR4	26	43
CCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006154	DF	On-Demand	Anodyne	ADRB3	15	41
CCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006154	DF	On-Demand	Anodyne	MMP13	21	40
CCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006154	DF	On-Demand	Anodyne	ALPL	30	46
CCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006154	DF	On-Demand	Anodyne	CA9	17	40
CCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006154	DF	On-Demand	Anodyne	FFAR4	29	43
COCCc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006169	DE	On-Demand	Anodyne	ADRB2	17	45
COCCc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006169	DE	On-Demand	Anodyne	ADRB3	41	45
COCCc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006169	DE	On-Demand	Anodyne	FFAR4	29	40
COCCc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006169	DE	On-Demand	Anodyne	LIMK2	22	41
C#CCCN1CCC(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)CC1	ZINC000872006176	FD	On-Demand	Mild	SFRP1	130	42
C#CCCN1CCC(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)CC1	ZINC000872006176	FD	On-Demand	Mild	WNT3	86	36
CC(C)n1cnc(NS(=O)(=O)Cc2ccc(F)cc2Cl)n1	ZINC000872006203	EF	On-Demand	Anodyne	P2RX7	49	43
COc1cccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872006220	GF	On-Demand	Anodyne	PKM	41	50
COCc1ccnc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1	ZINC000872006230	GF	On-Demand	Anodyne	PKM	40	48
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C(F)(F)F	ZINC000872006231	EG	On-Demand	Anodyne	CASP3	52	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C(F)(F)F	ZINC000872006231	EG	On-Demand	Anodyne	CASP7	71	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C(F)(F)F	ZINC000872006232	EG	On-Demand	Anodyne	CASP3	52	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C(F)(F)F	ZINC000872006232	EG	On-Demand	Anodyne	CASP7	71	38
COc1cncc(NS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)c1	ZINC000872006292	GD	On-Demand	Anodyne	MMP13	22	44
COc1cncc(NS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)c1	ZINC000872006292	GD	On-Demand	Anodyne	BTK	27	41
COc1cncc(NS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)c1	ZINC000872006292	GD	On-Demand	Anodyne	LRRK2	32	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	CA2	24	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	CA1	29	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	CA4	25	41
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	PRTN3	54	34
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	CA12	34	43
COc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1	ZINC000872006295	FF	On-Demand	Anodyne	IDO1	30	43
COc1cncc(NS(=O)(=O)c2cc(OC)c(OC)cc2C)c1	ZINC000872006299	EE	On-Demand	Anodyne	ALPL	23	49
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1	ZINC000872006326	FD	On-Demand	Anodyne	CYP11B1	22	57
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1	ZINC000872006326	FD	On-Demand	Anodyne	CYP11B2	36	57
COc1cncc(NS(=O)(=O)c2ccc(CN(C)C)cc2)c1	ZINC000872006331	DD	On-Demand	Anodyne	FFAR4	28	40
COc1cncc(NS(=O)(=O)c2ccc(CN(C)C)cc2)c1	ZINC000872006331	DD	On-Demand	Anodyne	LIMK2	33	48
COCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006332	ED	On-Demand	Anodyne	ALPL	30	43
COCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006332	ED	On-Demand	Anodyne	FFAR4	29	43
COCCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1	ZINC000872006332	ED	On-Demand	Anodyne	LIMK2	15	48
COc1cncc(NS(=O)(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000872006335	EF	On-Demand	Mild	EDNRB	15	40
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)c1	ZINC000872006337	ED	On-Demand	Anodyne	CYP11B2	28	45
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2cncc(N(C)C)c2)c1	ZINC000872006340	FD	On-Demand	Anodyne	CPT1A	39	40
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2cncc(N(C)C)c2)c1	ZINC000872006340	FD	On-Demand	Anodyne	ALPL	22	44
COc1cncc(NS(=O)(=O)c2ccc(OC)c(C(=O)N(C)C)c2)c1	ZINC000872006355	FD	On-Demand	Anodyne	LIMK2	18	40
CCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1OCC	ZINC000872006370	FF	On-Demand	Anodyne	ALPL	32	44
Cn1ncc(S(=O)(=O)N2CCc3cc(C#N)ccc32)c1C(F)(F)F	ZINC000872006376	FE	On-Demand	Mild	CYP11B2	25	41
Cc1ccnc([C@@H](C)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)n1	ZINC000872006388	EF	On-Demand	Anodyne	LEF	34	40
Cc1ccnc([C@H](C)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)n1	ZINC000872006389	EF	On-Demand	Anodyne	LEF	34	40
C[C@@H](CNS(=O)(=O)c1ccc2onc(Cl)c2c1)Cn1ccnc1	ZINC000872006411	FE	On-Demand	Anodyne	TBXAS1	20	43
C[C@H](CNS(=O)(=O)c1ccc2onc(Cl)c2c1)Cn1ccnc1	ZINC000872006412	FE	On-Demand	Anodyne	TBXAS1	20	43
COc1cncc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1	ZINC000872006431	EE	On-Demand	Anodyne	MGAT1	71	50
COc1cncc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1	ZINC000872006431	EE	On-Demand	Anodyne	MOGAT2	28	41
COc1cncc(NS(=O)(=O)c2cc(C)c(OC)cc2C)c1	ZINC000872006455	DF	On-Demand	Anodyne	ALPL	22	48
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CCC(=O)N4CCC3)c1	ZINC000872006456	FE	On-Demand	Anodyne	CYP11B1	35	66
COc1cncc(NS(=O)(=O)c2cc3c4c(c2)CCC(=O)N4CCC3)c1	ZINC000872006456	FE	On-Demand	Anodyne	CYP11B2	41	66
C[C@H](CNS(=O)(=O)c1ccccc1NC(=O)C(F)(F)F)Cn1ccnc1	ZINC000872006461	GD	On-Demand	Anodyne	TBXAS1	26	40
C[C@@H](CNS(=O)(=O)c1ccccc1NC(=O)C(F)(F)F)Cn1ccnc1	ZINC000872006464	GD	On-Demand	Anodyne	TBXAS1	26	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cncc(OC)c2)c1	ZINC000872006474	ED	On-Demand	Anodyne	LIMK2	30	49
COc1cncc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1	ZINC000872006475	GF	On-Demand	Anodyne	PKM	46	54
COc1cncc(NS(=O)(=O)c2c(OC)cc(OC)cc2OC)c1	ZINC000872006487	FD	On-Demand	Anodyne	ALPL	20	43
CCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1C	ZINC000872006491	DF	On-Demand	Anodyne	ALPL	32	44
CCOc1ccc(S(=O)(=O)Nc2cncc(OC)c2)cc1C	ZINC000872006491	DF	On-Demand	Anodyne	FFAR4	29	40
COCCOc1ccc(F)cc1S(=O)(=O)Nc1cncc(OC)c1	ZINC000872006492	FE	On-Demand	Anodyne	ALPL	22	46
COc1cncc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1	ZINC000872006493	EE	On-Demand	Anodyne	CYP11B2	19	46
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)(C)C)cc2)c1	ZINC000872006496	EG	On-Demand	Anodyne	PRTN3	55	34
COc1cncc(NS(=O)(=O)c2ccc(C(=O)C(C)(C)C)cc2)c1	ZINC000872006496	EG	On-Demand	Anodyne	LIMK2	25	43
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCCN3C(C)=O)c1	ZINC000872006531	FE	On-Demand	Anodyne	CYP11B1	17	56
COc1cncc(NS(=O)(=O)c2ccc3c(c2)CCCN3C(C)=O)c1	ZINC000872006531	FE	On-Demand	Anodyne	CYP11B2	35	41
C#CCCN1CCC(NS(=O)(=O)c2cn(CCCC)nc2C)CC1	ZINC000872006545	FD	On-Demand	Mild	CCR8	48	32
C#CCCN1CCC(NS(=O)(=O)c2c(C(F)(F)F)cnn2C)CC1	ZINC000872006555	FD	On-Demand	Mild	SFRP1	128	42
C#CCCN1CCC(NS(=O)(=O)c2c(C(F)(F)F)cnn2C)CC1	ZINC000872006555	FD	On-Demand	Mild	WNT3	85	35
Cn1cncc1CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872006561	GD	On-Demand	Anodyne	PKM	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3Cc4ccncc4C3)cc2N1	ZINC000872006572	GF	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3Cc4cccnc4C3)cc2N1	ZINC000872006592	GF	On-Demand	Anodyne	PKM	28	40
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NCCN1CCOCC1	ZINC000872006601	GC	On-Demand	Anodyne	EPHX2	17	45
C#CCCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)c(F)cc2OC)CC1	ZINC000872006603	GD	On-Demand	Mild	HTR4	49	36
C#CCCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)c(F)cc2OC)CC1	ZINC000872006603	GD	On-Demand	Mild	CCR8	50	32
C#CCCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)c(F)cc2OC)CC1	ZINC000872006603	GD	On-Demand	Mild	SFRP1	87	38
C#CCCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)c(F)cc2OC)CC1	ZINC000872006603	GD	On-Demand	Mild	WNT3	51	32
C#CCCN1CCC(NS(=O)(=O)c2ccc3c(c2)nnn3C)CC1	ZINC000872006604	EC	On-Demand	Mild	SFRP1	48	37
C#CCCN1CCC(NS(=O)(=O)c2cc(C)sc2[N+](=O)[O-])CC1	ZINC000872006617	FD	On-Demand	Mild	SFRP1	45	39
CCOC(=O)Cn1nc(C)cc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872006647	GE	On-Demand	Anodyne	P2RX7	46	43
C#CCCN1CCC(NS(=O)(=O)c2ccc3onc(Cl)c3c2)CC1	ZINC000872006655	FE	On-Demand	Mild	HTR7	32	41
C#CCCN1CCC(NS(=O)(=O)c2ccc3onc(Cl)c3c2)CC1	ZINC000872006655	FE	On-Demand	Mild	SFRP1	57	37
C#CCCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872006693	FF	On-Demand	Mild	HTR7	17	48
C#CCCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872006693	FF	On-Demand	Mild	SFRP1	103	40
C#CCCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872006693	FF	On-Demand	Mild	WNT3	66	33
C#CCCN1CCC(NS(=O)(=O)c2cccc(F)c2OC)CC1	ZINC000872006717	ED	On-Demand	Mild	HTR7	18	41
C#CCCN1CCC(NS(=O)(=O)c2cccc(F)c2OC)CC1	ZINC000872006717	ED	On-Demand	Mild	CCR8	91	38
C#CCCN1CCC(NS(=O)(=O)c2cccc(F)c2OC)CC1	ZINC000872006717	ED	On-Demand	Mild	SFRP1	114	41
C#CCCN1CCC(NS(=O)(=O)c2cccc(F)c2OC)CC1	ZINC000872006717	ED	On-Demand	Mild	WNT3	72	36
CCOc1ccc(S(=O)(=O)Nc2cccnc2F)cc1C(C)C	ZINC000872006723	EH	On-Demand	Anodyne	CCR2	16	43
Cn1cc(S(=O)(=O)N2CCc3cc(C#N)ccc32)c(C(C)(C)C)n1	ZINC000872006748	EE	On-Demand	Mild	CYP11B2	21	40
COC(=O)c1c(C)nn(C)c1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872006767	GE	On-Demand	Anodyne	P2RX7	53	48
Cn1nc(C(F)(F)F)cc1NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872006808	FG	On-Demand	Anodyne	P2RX7	46	41
C#CCCN1CCC(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)CC1	ZINC000872006842	FD	On-Demand	Mild	SFRP1	53	37
C#CCCN1CCC(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)CC1	ZINC000872006842	FD	On-Demand	Mild	WNT3	42	31
CCOc1ccc(S(=O)(=O)N2Cc3cccnc3C2)cc1C(C)C	ZINC000872006856	EG	On-Demand	Anodyne	PDE5A	30	47
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@H](c3ccccn3)C2)c1	ZINC000872006859	EF	On-Demand	Mild	GRM5	25	41
N#Cc1cc(F)cc(S(=O)(=O)N2CCC[C@@H](c3ccccn3)C2)c1	ZINC000872006860	EF	On-Demand	Mild	GRM5	25	41
CCOC(=O)Cn1nc(C)cc1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872006865	FD	On-Demand	Anodyne	CCR4	43	37
O=C(CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NCc1cccnc1	ZINC000872006875	GE	On-Demand	Anodyne	TBXAS1	66	46
O=C(CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NCc1cccnc1	ZINC000872006875	GE	On-Demand	Anodyne	NAMPT	92	48
CCn1[nH]c(C)nc1=NS(=O)(=O)Cc1ccc(F)cc1Cl	ZINC000872006881	ED	On-Demand	Anodyne	P2RX7	46	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCc2cccnc21	ZINC000872006883	EG	On-Demand	Anodyne	CYP11B2	27	42
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccnn1CC1CCC1	ZINC000872006938	EE	On-Demand	Anodyne	NMT1	53	41
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3noc(C(C)(C)C)c3C)ccc21	ZINC000872006942	GG	On-Demand	Anodyne	HSD17B3	47	35
CSc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872006943	EH	On-Demand	Anodyne	EDNRA	28	50
COC(=O)c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872006958	FF	On-Demand	Anodyne	EDNRB	22	41
COC(=O)c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872006958	FF	On-Demand	Anodyne	EDNRA	34	47
COC(=O)c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872006958	FF	On-Demand	Anodyne	PRTN3	51	33
Cc1noc(C)c1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872006998	DF	On-Demand	Anodyne	EDNRA	23	42
CNC(=O)c1cc(S(=O)(=O)N2CCc3cccc(Br)c32)cn1C	ZINC000872007009	GD	On-Demand	Anodyne	AKR1C3	48	44
COc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007024	DG	On-Demand	Anodyne	EDNRB	15	54
COc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007024	DG	On-Demand	Anodyne	EDNRA	42	54
COC(=O)c1c(C)cccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007028	FG	On-Demand	Anodyne	EDNRA	35	43
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccnn2CC2CCC2)c1	ZINC000872007046	GE	On-Demand	Anodyne	CPT1A	41	36
COCCc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007059	FG	On-Demand	Anodyne	EDNRB	20	40
COCCc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007059	FG	On-Demand	Anodyne	EDNRA	38	46
Cc1ccc(F)c(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007073	EH	On-Demand	Anodyne	EDNRA	25	45
Cc1ccc(F)c(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007073	EH	On-Demand	Anodyne	SGK1	25	40
COC(=O)c1c(F)cccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007079	FG	On-Demand	Anodyne	EDNRA	25	42
CCCCN(c1ccc(Cl)nc1)S(=O)(=O)c1ccc(C(=O)N(C)C)cc1	ZINC000872007080	GG	On-Demand	Anodyne	TRPM8	37	43
Cc1cc2c(cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C)OCO2	ZINC000872007082	FG	On-Demand	Anodyne	EDNRA	19	46
CCOc1ccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)cc1C(C)C	ZINC000872007106	FF	On-Demand	Anodyne	SSTR5	44	35
CCOc1ccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)cc1C(C)C	ZINC000872007107	FF	On-Demand	Anodyne	SSTR5	44	35
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(C(F)F)c2)sc1C	ZINC000872007110	GG	On-Demand	Anodyne	CA4	27	41
CCOc1ccc(S(=O)(=O)Nc2cncnc2)cc1C(C)C	ZINC000872007134	DF	On-Demand	Anodyne	ALPL	24	47
CCOc1ccc(S(=O)(=O)Nc2cncnc2)cc1C(C)C	ZINC000872007134	DF	On-Demand	Anodyne	MGAT1	43	30
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(Cl)c2)sc1C	ZINC000872007149	GG	On-Demand	Anodyne	CA2	22	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(Cl)c2)sc1C	ZINC000872007149	GG	On-Demand	Anodyne	CA1	21	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(Cl)c2)sc1C	ZINC000872007149	GG	On-Demand	Anodyne	CA4	37	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(Cl)c2)sc1C	ZINC000872007149	GG	On-Demand	Anodyne	FFAR4	20	40
CCOc1ccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c(C)c1	ZINC000872007158	ED	On-Demand	Anodyne	CCR8	67	37
CCOc1ccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)c(C)c1	ZINC000872007159	ED	On-Demand	Anodyne	CCR8	67	37
COCCS(=O)(=O)Nc1nc2cc(OC)ccc2n1Cc1ccccc1	ZINC000872007165	GE	On-Demand	Anodyne	PLA2G2A	49	40
COCCS(=O)(=O)Nc1nc2cc(OC)ccc2n1Cc1ccccc1	ZINC000872007165	GE	On-Demand	Anodyne	NR1I2	43	36
COCCS(=O)(=O)Nc1nc2cc(OC)ccc2n1Cc1ccccc1	ZINC000872007165	GE	On-Demand	Anodyne	PROKR1	59	37
COC(=O)c1cccc(CS(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007193	FG	On-Demand	Anodyne	PTPRB	17	41
Cc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1F	ZINC000872007212	EH	On-Demand	Anodyne	EDNRA	39	45
CC(=O)c1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007217	EG	On-Demand	Anodyne	EDNRA	29	43
COc1cccc(OC)c1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007238	FG	On-Demand	Anodyne	EDNRB	19	42
COc1cccc(OC)c1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007238	FG	On-Demand	Anodyne	EDNRA	43	43
COCc1ccccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007240	EG	On-Demand	Anodyne	EDNRA	46	40
CCOc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007296	EG	On-Demand	Anodyne	EDNRB	15	43
CCOc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007296	EG	On-Demand	Anodyne	EDNRA	35	43
COC(=O)c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1F	ZINC000872007318	FG	On-Demand	Anodyne	EDNRA	18	43
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)cc1	ZINC000872007337	FD	On-Demand	Anodyne	SFRP1	54	31
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)cc1	ZINC000872007339	FD	On-Demand	Anodyne	SFRP1	54	31
COc1cc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)cnc1Cl	ZINC000872007365	ED	On-Demand	Anodyne	ADRA1D	16	41
COc1cc(S(=O)(=O)N[C@H]2CCn3cncc3C2)cnc1Cl	ZINC000872007366	ED	On-Demand	Anodyne	ADRA1D	16	41
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(COC)cc2)sc1C	ZINC000872007374	FF	On-Demand	Anodyne	CA1	22	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(COC)cc2)sc1C	ZINC000872007374	FF	On-Demand	Anodyne	CA4	37	43
CN(C)S(=O)(=O)Nc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccn1	ZINC000872007388	GD	On-Demand	Anodyne	CHEK1	42	34
CN(C)S(=O)(=O)Nc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccn1	ZINC000872007388	GD	On-Demand	Anodyne	GPR119	50	44
Cc1c(F)cccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007393	EH	On-Demand	Anodyne	EDNRA	33	49
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CC1	ZINC000872007416	JD	On-Demand	Anodyne	CNR2	16	48
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CC1	ZINC000872007416	JD	On-Demand	Anodyne	F13A1	25	48
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CC1	ZINC000872007416	JD	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CCN(c2ccnc(NS(C)(=O)=O)c2)CC1	ZINC000872007421	FD	On-Demand	Anodyne	CHEK1	43	35
CC(C)(C)OC(=O)N1CCN(c2ccnc(NS(C)(=O)=O)c2)CC1	ZINC000872007421	FD	On-Demand	Anodyne	GPR119	54	48
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(F)c(C)c2)sc1C	ZINC000872007424	FF	On-Demand	Anodyne	CA4	42	39
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(F)c(C)c2)sc1C	ZINC000872007424	FF	On-Demand	Anodyne	LEF	39	46
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(C)c2)sc1C	ZINC000872007425	EF	On-Demand	Anodyne	CA2	17	42
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(C)c2)sc1C	ZINC000872007425	EF	On-Demand	Anodyne	CA4	42	42
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(C)c2)sc1C	ZINC000872007425	EF	On-Demand	Anodyne	FBP1	18	41
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(SC(F)(F)F)cc1	ZINC000872007430	GF	On-Demand	Anodyne	SFRP1	82	32
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(SC(F)(F)F)cc1	ZINC000872007430	GF	On-Demand	Anodyne	WNT3	45	32
CC(C)(C)C(=O)c1ccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)cc1	ZINC000872007444	FE	On-Demand	Anodyne	SFRP1	111	35
CC(C)(C)C(=O)c1ccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)cc1	ZINC000872007444	FE	On-Demand	Anodyne	WNT3	71	33
CC(C)(C)C(=O)c1ccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)cc1	ZINC000872007445	FE	On-Demand	Anodyne	SFRP1	111	35
CC(C)(C)C(=O)c1ccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)cc1	ZINC000872007445	FE	On-Demand	Anodyne	WNT3	71	33
Cc1ccccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007461	DG	On-Demand	Anodyne	EDNRA	46	58
COCCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007464	FG	On-Demand	Anodyne	EDNRB	24	42
COCCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007464	FG	On-Demand	Anodyne	EDNRA	40	46
COCCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007464	FG	On-Demand	Anodyne	PRTN3	55	34
Cc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1	ZINC000872007482	DG	On-Demand	Anodyne	EDNRA	40	57
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(Cl)cc2OC)sc1C	ZINC000872007499	GG	On-Demand	Anodyne	CPT1A	57	36
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(Cl)cc2OC)sc1C	ZINC000872007499	GG	On-Demand	Anodyne	CPT1B	66	35
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1n[nH]c(C2CC2)c1-c1ccccc1	ZINC000872007503	GG	On-Demand	Anodyne	NMT1	31	41
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1cccc(C(F)F)c1	ZINC000872007506	EE	On-Demand	Anodyne	SFRP1	66	31
O=S(=O)(N[C@H]1CCn2cncc2C1)c1cccc(C(F)F)c1	ZINC000872007507	EE	On-Demand	Anodyne	SFRP1	66	31
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(COC)c2)sc1C	ZINC000872007510	FF	On-Demand	Anodyne	CA4	25	44
Cc1ccc(-n2nc3c(c2NS(=O)(=O)[C@@H](C)C(=O)N(C)C)CCCC3)cc1	ZINC000872007516	GE	On-Demand	Anodyne	FPR1	40	37
Cc1ccc(-n2nc3c(c2NS(=O)(=O)[C@H](C)C(=O)N(C)C)CCCC3)cc1	ZINC000872007517	GE	On-Demand	Anodyne	FPR1	40	37
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OCC)cc2)sc1C	ZINC000872007519	FF	On-Demand	Anodyne	CA4	41	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCn4cncc4C3)cc2N1	ZINC000872007520	GE	On-Demand	Anodyne	PKM	20	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCn4cncc4C3)cc2N1	ZINC000872007521	GE	On-Demand	Anodyne	PKM	20	40
CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1	ZINC000872007536	FE	On-Demand	Anodyne	SFRP1	71	34
CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1	ZINC000872007537	FE	On-Demand	Anodyne	SFRP1	71	34
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CN(C)C)cc2)sc1C	ZINC000872007558	GE	On-Demand	Anodyne	CA2	16	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CN(C)C)cc2)sc1C	ZINC000872007558	GE	On-Demand	Anodyne	CA1	19	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CN(C)C)cc2)sc1C	ZINC000872007558	GE	On-Demand	Anodyne	CA4	32	42
CC(=O)c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007586	EG	On-Demand	Anodyne	EDNRA	28	49
COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007589	GG	On-Demand	Anodyne	PRTN3	51	32
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1cccc2ncccc12	ZINC000872007602	ED	On-Demand	Anodyne	CCR8	71	34
O=S(=O)(N[C@H]1CCn2cncc2C1)c1cccc2ncccc12	ZINC000872007603	ED	On-Demand	Anodyne	CCR8	71	34
COc1ccc(Cl)cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007624	FH	On-Demand	Anodyne	EDNRA	19	47
COc1ccc(Cl)cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007624	FH	On-Demand	Anodyne	CPT1A	68	44
COc1ccc(Cl)cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007624	FH	On-Demand	Anodyne	CPT2	45	36
COc1ccc(Cl)cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872007624	FH	On-Demand	Anodyne	CPT1B	60	38
CC(=O)N1CCc2cc(S(=O)(=O)Nc3noc(C(C)(C)C)c3C)ccc21	ZINC000872007639	GF	On-Demand	Anodyne	HSD17B3	47	35
Cc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1Cl	ZINC000872007687	EI	On-Demand	Anodyne	EDNRA	47	44
CCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007689	EG	On-Demand	Anodyne	EDNRB	20	41
CCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007689	EG	On-Demand	Anodyne	EDNRA	37	47
CCOc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)cc1	ZINC000872007689	EG	On-Demand	Anodyne	PRTN3	53	34
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	CA2	29	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	CA1	34	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP13	46	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	CA4	45	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP2	32	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP8	28	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP9	39	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP12	28	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP7	28	41
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	CA9	25	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	MMP1	35	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2)sc1C	ZINC000872007765	FE	On-Demand	Anodyne	FFAR4	26	44
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(OCC)c2)sc1C	ZINC000872007779	FF	On-Demand	Anodyne	CA4	29	41
CCOC(=O)c1nc(NS(=O)(=O)CCc2ccc(OC)cc2)sc1C	ZINC000872007781	GF	On-Demand	Anodyne	CA9	17	42
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	MMP13	21	41
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	ADAM17	27	41
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	MMP14	16	41
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	TGM2	21	45
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	F13A1	24	45
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007794	GF	On-Demand	Anodyne	SFRP1	57	31
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	MMP13	21	41
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	ADAM17	27	41
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	MMP14	16	41
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	TGM2	21	45
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	F13A1	24	45
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc(OCc2ccccc2)cc1	ZINC000872007795	GF	On-Demand	Anodyne	SFRP1	57	31
COC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1	ZINC000872007810	FC	On-Demand	Anodyne	SFRP1	52	31
COC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1	ZINC000872007811	FC	On-Demand	Anodyne	SFRP1	52	31
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872007812	FF	On-Demand	Bother	ITGAL	18	44
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872007812	FF	On-Demand	Bother	GPR119	35	41
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(Cl)s2)sc1C	ZINC000872007856	FG	On-Demand	Anodyne	CCR4	62	36
Cn1ncc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1C(F)(F)F	ZINC000872007860	EC	On-Demand	Anodyne	SFRP1	100	33
Cn1ncc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1C(F)(F)F	ZINC000872007860	EC	On-Demand	Anodyne	WNT3	56	33
Cn1ncc(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1C(F)(F)F	ZINC000872007861	EC	On-Demand	Anodyne	SFRP1	100	33
Cn1ncc(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1C(F)(F)F	ZINC000872007861	EC	On-Demand	Anodyne	WNT3	56	33
CCOC(=O)c1nc(NS(=O)(=O)c2cc(F)ccc2C)sc1C	ZINC000872007862	FF	On-Demand	Anodyne	DHODH	15	40
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CC1	ZINC000872007887	JD	On-Demand	Anodyne	SLC6A9	48	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CC1	ZINC000872007887	JD	On-Demand	Anodyne	PKM	40	36
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CC1	ZINC000872007887	JD	On-Demand	Anodyne	TGM2	34	46
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CC1	ZINC000872007887	JD	On-Demand	Anodyne	F13A1	40	47
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CC1	ZINC000872007887	JD	On-Demand	Anodyne	GPR119	51	43
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccccc1S(=O)(=O)C(F)F	ZINC000872007900	GD	On-Demand	Anodyne	SFRP1	82	32
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccccc1S(=O)(=O)C(F)F	ZINC000872007900	GD	On-Demand	Anodyne	WNT3	45	32
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccccc1S(=O)(=O)C(F)F	ZINC000872007901	GD	On-Demand	Anodyne	SFRP1	82	32
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccccc1S(=O)(=O)C(F)F	ZINC000872007901	GD	On-Demand	Anodyne	WNT3	45	32
CCOC(=O)c1nc(NS(=O)(=O)Cc2ccccc2)sc1C	ZINC000872007907	EF	On-Demand	Anodyne	DHODH	16	41
O=C(c1ccc(NS(=O)(=O)C2=Cc3ccccc3CC2)nc1)N1CCOCC1	ZINC000872007921	GE	On-Demand	Anodyne	BDKRB1	16	40
COc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1F	ZINC000872007943	EG	On-Demand	Anodyne	EDNRB	16	40
COc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1F	ZINC000872007943	EG	On-Demand	Anodyne	EDNRA	46	42
COc1cccc(S(=O)(=O)Nc2noc(C(C)(C)C)c2C)c1F	ZINC000872007943	EG	On-Demand	Anodyne	CCR4	24	40
CCC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1	ZINC000872008075	FE	On-Demand	Anodyne	CCR8	48	34
CCC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1	ZINC000872008075	FE	On-Demand	Anodyne	SFRP1	57	33
CCC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1	ZINC000872008077	FE	On-Demand	Anodyne	CCR8	48	34
CCC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1	ZINC000872008077	FE	On-Demand	Anodyne	SFRP1	57	33
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(N(C)C)c2)sc1C	ZINC000872008080	FE	On-Demand	Anodyne	CA4	26	42
C#CCCCS(=O)(=O)Nc1ccc(C(=O)N2CCOCC2)cn1	ZINC000872008109	EC	On-Demand	Mild	BDKRB1	16	41
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(F)c2)sc1C	ZINC000872008159	FF	On-Demand	Anodyne	CA2	23	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(F)c2)sc1C	ZINC000872008159	FF	On-Demand	Anodyne	CA1	19	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)c(F)c2)sc1C	ZINC000872008159	FF	On-Demand	Anodyne	CA4	36	40
O=C(Nc1cccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1)C(F)(F)F	ZINC000872008170	GD	On-Demand	Anodyne	SFRP1	127	37
O=C(Nc1cccc(S(=O)(=O)N[C@@H]2CCn3cncc3C2)c1)C(F)(F)F	ZINC000872008170	GD	On-Demand	Anodyne	WNT3	84	35
O=C(Nc1cccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1)C(F)(F)F	ZINC000872008171	GD	On-Demand	Anodyne	SFRP1	127	37
O=C(Nc1cccc(S(=O)(=O)N[C@H]2CCn3cncc3C2)c1)C(F)(F)F	ZINC000872008171	GD	On-Demand	Anodyne	WNT3	84	35
CCOC(=O)c1nc(NS(=O)(=O)c2cc(C)ccc2OC)sc1C	ZINC000872008220	FF	On-Demand	Anodyne	ALPL	16	45
CCCOc1ccc(S(=O)(=O)N(C)[C@@H](C#N)C2(SC)CC2)cc1	ZINC000872008237	FF	On-Demand	Mild	MMP13	18	40
CCCOc1ccc(S(=O)(=O)N(C)[C@H](C#N)C2(SC)CC2)cc1	ZINC000872008238	FF	On-Demand	Mild	MMP13	18	40
C[C@@H]1Cc2cccc(F)c2N(S(C)(=O)=O)C1	ZINC000872008272	BD	On-Demand	Anodyne	AADAT	15	43
C[C@H]1Cc2cccc(F)c2N(S(C)(=O)=O)C1	ZINC000872008273	BD	On-Demand	Anodyne	AADAT	15	43
CCOC(=O)c1nc(NS(=O)(=O)c2ccccc2C(F)(F)F)sc1C	ZINC000872008371	GG	On-Demand	Anodyne	DHODH	15	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(Cl)c(OC)c2)sc1C	ZINC000872008400	GG	On-Demand	Anodyne	FFAR4	20	49
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(OC)cc2C)sc1C	ZINC000872008411	FF	On-Demand	Anodyne	DHODH	16	40
O=S(=O)(N[C@H]1CCn2cncc2C1)c1ccc2c3c(cccc13)CC2	ZINC000872008414	FE	On-Demand	Anodyne	CCR8	86	36
O=S(=O)(N[C@@H]1CCn2cncc2C1)c1ccc2c3c(cccc13)CC2	ZINC000872008418	FE	On-Demand	Anodyne	CCR8	86	36
CCOC(=O)c1nc(NS(=O)(=O)c2cc(Cl)ccc2OC)sc1C	ZINC000872008425	GG	On-Demand	Anodyne	CPT1A	83	42
CCOC(=O)c1nc(NS(=O)(=O)c2cc(Cl)ccc2OC)sc1C	ZINC000872008425	GG	On-Demand	Anodyne	CPT2	46	35
CCOC(=O)c1nc(NS(=O)(=O)c2cc(Cl)ccc2OC)sc1C	ZINC000872008425	GG	On-Demand	Anodyne	CPT1B	86	40
CCOC(=O)c1nc(NS(=O)(=O)c2cc(Cl)ccc2OC)sc1C	ZINC000872008425	GG	On-Demand	Anodyne	ALPL	19	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(C)c(F)c2)sc1C	ZINC000872008452	FF	On-Demand	Anodyne	CA2	20	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(C)c(F)c2)sc1C	ZINC000872008452	FF	On-Demand	Anodyne	DHODH	16	45
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(C)c(F)c2)sc1C	ZINC000872008452	FF	On-Demand	Anodyne	CA1	19	42
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(C)c(F)c2)sc1C	ZINC000872008452	FF	On-Demand	Anodyne	CA4	41	42
C#CCCCS(=O)(=O)Nc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872008485	FE	On-Demand	Mild	NPY2R	54	34
Cc1cc(C)cc(CS(=O)(=O)Nc2ccc(C(=O)N3CCOCC3)cn2)c1	ZINC000872008516	GE	On-Demand	Anodyne	BDKRB1	18	44
CCOC(=O)c1nc(NS(=O)(=O)c2ccccc2C)sc1C	ZINC000872008558	EF	On-Demand	Anodyne	DHODH	17	40
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CCOC)cc2)sc1C	ZINC000872008559	GF	On-Demand	Anodyne	CA2	22	48
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CCOC)cc2)sc1C	ZINC000872008559	GF	On-Demand	Anodyne	CA1	27	48
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(CCOC)cc2)sc1C	ZINC000872008559	GF	On-Demand	Anodyne	CA4	34	48
CCOC(=O)c1nc(NS(=O)(=O)c2cc(OC)ccc2Cl)sc1C	ZINC000872008595	GG	On-Demand	Anodyne	SGK1	18	41
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(OC)c2)sc1C	ZINC000872008604	FE	On-Demand	Anodyne	DHODH	17	42
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(OC)c2)sc1C	ZINC000872008604	FE	On-Demand	Anodyne	CA1	18	43
CCOC(=O)c1nc(NS(=O)(=O)c2cccc(OC)c2)sc1C	ZINC000872008604	FE	On-Demand	Anodyne	CA4	29	43
CCOC(=O)c1nc(NS(=O)(=O)c2c(F)cc(OC)cc2F)sc1C	ZINC000872008633	GF	On-Demand	Anodyne	DHODH	15	40
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccnc2)C1	ZINC000872008649	DF	On-Demand	Anodyne	CYP11B1	15	41
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccnc2)C1	ZINC000872008649	DF	On-Demand	Anodyne	CYP11B2	33	41
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccnc2)C1	ZINC000872008650	DF	On-Demand	Anodyne	CYP11B1	15	41
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccnc2)C1	ZINC000872008650	DF	On-Demand	Anodyne	CYP11B2	33	41
CCOc1n[nH]c(NS(=O)(=O)c2cccc(C(F)F)c2)n1	ZINC000872008714	DD	On-Demand	Anodyne	MTNN	76	34
COCCc1ccc(S(=O)(=O)Nc2c(C)sc(C)c2C(=O)OC)cc1	ZINC000872008749	GG	On-Demand	Anodyne	FFAR4	26	40
CCOc1n[nH]c(NS(=O)(=O)c2c(C)cccc2Cl)n1	ZINC000872008791	DD	On-Demand	Anodyne	EIF2AK1	41	32
COC(=O)c1c(C)sc(C)c1NS(=O)(=O)c1cccc(C(=O)N(C)C)c1	ZINC000872008793	GF	On-Demand	Anodyne	CA4	15	43
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2ccc(C#N)nc2)C1	ZINC000872008922	EE	On-Demand	Mild	GCKR	76	33
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2ccc(C#N)nc2)C1	ZINC000872008924	EE	On-Demand	Mild	GCKR	76	33
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	MMP13	44	43
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	APP	49	41
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	ADAM17	23	43
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	MMP2	16	45
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	MMP3	46	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	MMP9	20	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	TGM2	17	48
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	MMP1	40	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	F13A1	24	48
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008947	JD	On-Demand	Anodyne	GPR119	54	43
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	MMP13	44	43
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	APP	49	41
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	ADAM17	23	43
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	MMP2	16	45
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	MMP3	46	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	MMP9	20	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	TGM2	17	48
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	MMP1	40	49
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	F13A1	24	48
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872008948	JD	On-Demand	Anodyne	GPR119	54	43
CCOc1n[nH]c(NS(=O)(=O)c2cccc(CC)c2)n1	ZINC000872008968	CD	On-Demand	Anodyne	MTNN	68	40
CCOc1n[nH]c(NS(=O)(=O)c2cc(C)c(F)cc2Cl)n1	ZINC000872008969	EE	On-Demand	Anodyne	SGK1	52	34
COc1ccc(C)cc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872009009	EG	On-Demand	Anodyne	EDNRA	25	49
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccccc2OCC(=O)Nc2ccccc2F)CC1	ZINC000872009010	JH	On-Demand	Anodyne	GPR119	33	41
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccc(C(=O)N(C)C)c2)C1	ZINC000872009019	GF	On-Demand	Anodyne	AKR1C3	54	51
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cccc(C(=O)N(C)C)c2)C1	ZINC000872009020	GF	On-Demand	Anodyne	AKR1C3	54	51
COCCNC(=O)c1cccc(S(=O)(=O)N(C)[C@@H](C#N)C2(SC)CC2)c1	ZINC000872009033	GD	On-Demand	Mild	DRD4	40	30
COCCNC(=O)c1cccc(S(=O)(=O)N(C)[C@H](C#N)C2(SC)CC2)c1	ZINC000872009034	GD	On-Demand	Mild	DRD4	40	30
COc1cc(F)ccc1S(=O)(=O)Nc1noc(C(C)(C)C)c1C	ZINC000872009114	EG	On-Demand	Anodyne	EDNRA	17	40
COC(=O)c1c(C)sc(C)c1NS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000872009133	GG	On-Demand	Anodyne	LIMK2	29	40
CN(C(=O)CSc1ccccc1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C1CCCCC1	ZINC000872009160	JI	On-Demand	Anodyne	AMY2	45	31
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cnn(CC(F)(F)F)c2)C1	ZINC000872009201	GF	On-Demand	Anodyne	GCKR	55	30
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2cnn(CC(F)(F)F)c2)C1	ZINC000872009202	GF	On-Demand	Anodyne	GCKR	55	30
C[C@@H]1Cc2cccc(F)c2N(S(=O)(=O)c2ccc(S(C)(=O)=O)nc2)C1	ZINC000872009226	GE	On-Demand	Anodyne	GCKR	71	31
C[C@H]1Cc2cccc(F)c2N(S(=O)(=O)c2ccc(S(C)(=O)=O)nc2)C1	ZINC000872009227	GE	On-Demand	Anodyne	GCKR	71	31
CC(C)(C)OC(=O)N1CCN(C(=O)CSCc2ccc(Br)cc2)CC1	ZINC000872009230	IH	On-Demand	Anodyne	KDM1A	15	41
O=C(c1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)nc1)N1CCOCC1	ZINC000872009239	GE	On-Demand	Anodyne	BDKRB1	19	44
O=C(c1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)nc1)N1CCOCC1	ZINC000872009239	GE	On-Demand	Anodyne	SFRP1	30	41
COCCOc1ccc(S(=O)(=O)N(C)[C@@H](C#N)C2(SC)CC2)cc1	ZINC000872009285	FE	On-Demand	Mild	MMP13	18	42
COCCOc1ccc(S(=O)(=O)N(C)[C@@H](C#N)C2(SC)CC2)cc1	ZINC000872009285	FE	On-Demand	Mild	MMP9	15	42
COCCOc1ccc(S(=O)(=O)N(C)[C@H](C#N)C2(SC)CC2)cc1	ZINC000872009287	FE	On-Demand	Mild	MMP13	18	42
COCCOc1ccc(S(=O)(=O)N(C)[C@H](C#N)C2(SC)CC2)cc1	ZINC000872009287	FE	On-Demand	Mild	MMP9	15	42
COC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)Cc3cccc(F)c32)cn1	ZINC000872009395	FE	On-Demand	Anodyne	GCKR	45	31
COC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)Cc3cccc(F)c32)cn1	ZINC000872009396	FE	On-Demand	Anodyne	GCKR	45	31
CCOc1n[nH]c(NS(=O)(=O)c2cc(C)ccc2Cl)n1	ZINC000872009588	DD	On-Demand	Anodyne	SGK1	61	39
CCOc1n[nH]c(NS(=O)(=O)c2ccc(Cl)c(C)c2)n1	ZINC000872009691	DD	On-Demand	Anodyne	MTNN	43	37
CCCOc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872009910	EH	On-Demand	Anodyne	ALPL	18	43
CCOc1ccc(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)cc1C(C)C	ZINC000872009932	GH	On-Demand	Anodyne	CA4	47	35
CCOc1ccc(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)cc1C(C)C	ZINC000872009933	GH	On-Demand	Anodyne	CA4	47	35
CC(C)(C)OC(=O)N1CCN(C(=O)CNc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000872010027	JE	On-Demand	Bother	GPR119	49	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000872010027	JE	On-Demand	Bother	SFRP1	44	43
COC(=O)c1c(C)sc(C)c1NS(=O)(=O)c1ccc(OC)c(OC)c1	ZINC000872010062	GF	On-Demand	Anodyne	FFAR4	31	44
CCOc1n[nH]c(NS(=O)(=O)c2cccc(C)c2Cl)n1	ZINC000872010064	DD	On-Demand	Anodyne	SGK1	26	42
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)cc1	ZINC000872010077	GG	On-Demand	Anodyne	CA1	32	40
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)cc1	ZINC000872010077	GG	On-Demand	Anodyne	CA4	58	41
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)cc1	ZINC000872010078	GG	On-Demand	Anodyne	CA1	32	40
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)cc1	ZINC000872010078	GG	On-Demand	Anodyne	CA4	58	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cc2ccccc2o1	ZINC000872010095	FF	On-Demand	Anodyne	CA4	47	34
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cc2ccccc2o1	ZINC000872010096	FF	On-Demand	Anodyne	CA4	47	34
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010111	GG	On-Demand	Anodyne	CA2	30	42
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010111	GG	On-Demand	Anodyne	CA1	28	42
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010111	GG	On-Demand	Anodyne	CA4	50	42
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010112	GG	On-Demand	Anodyne	CA2	30	42
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010112	GG	On-Demand	Anodyne	CA1	28	42
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(F)c(C(F)F)c1	ZINC000872010112	GG	On-Demand	Anodyne	CA4	50	42
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010126	GF	On-Demand	Anodyne	CA2	23	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010126	GF	On-Demand	Anodyne	CA1	17	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010126	GF	On-Demand	Anodyne	CA4	25	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010126	GF	On-Demand	Anodyne	A6YCJ1_9METZ	21	40
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010127	GF	On-Demand	Anodyne	CA2	23	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010127	GF	On-Demand	Anodyne	CA1	17	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010127	GF	On-Demand	Anodyne	CA4	25	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cnc(Cl)c(Cl)c1	ZINC000872010127	GF	On-Demand	Anodyne	A6YCJ1_9METZ	21	40
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cccc(C(F)F)c1	ZINC000872010152	FG	On-Demand	Anodyne	CA4	45	37
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cccc(C(F)F)c1	ZINC000872010153	FG	On-Demand	Anodyne	CA4	45	37
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872010167	GH	On-Demand	Anodyne	CA4	21	42
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1cnc2ccccc2c1	ZINC000872010209	FF	On-Demand	Anodyne	CA4	41	32
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1cnc2ccccc2c1	ZINC000872010210	FF	On-Demand	Anodyne	CA4	41	32
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872010257	JE	On-Demand	Anodyne	RBP4	64	34
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872010257	JE	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872010257	JE	On-Demand	Anodyne	SFRP1	126	49
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872010257	JE	On-Demand	Anodyne	WNT3	88	43
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010259	FF	On-Demand	Anodyne	CA1	30	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010259	FF	On-Demand	Anodyne	CA4	52	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010259	FF	On-Demand	Anodyne	NCE103	17	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010259	FF	On-Demand	Anodyne	A6YCJ1_9METZ	16	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010260	FF	On-Demand	Anodyne	CA1	30	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010260	FF	On-Demand	Anodyne	CA4	52	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010260	FF	On-Demand	Anodyne	NCE103	17	41
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CC2)cc1	ZINC000872010260	FF	On-Demand	Anodyne	A6YCJ1_9METZ	16	41
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(CCCl)cc1	ZINC000872010271	FF	On-Demand	Reactive	CA4	53	38
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(CCCl)cc1	ZINC000872010272	FF	On-Demand	Reactive	CA4	53	38
COCCOc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872010322	FF	On-Demand	Anodyne	ALPL	19	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cncc(C(F)F)c2)c1	ZINC000872010327	FF	On-Demand	Anodyne	LIMK2	29	40
CC(C)c1cccc(S(=O)(=O)Nc2cncc(C(F)F)c2)c1	ZINC000872010330	EH	On-Demand	Anodyne	MTNN	64	33
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010341	GH	On-Demand	Anodyne	CA1	27	40
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010341	GH	On-Demand	Anodyne	CA4	47	40
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010341	GH	On-Demand	Anodyne	NCE103	17	40
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010341	GH	On-Demand	Anodyne	A6YCJ1_9METZ	16	40
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010342	GH	On-Demand	Anodyne	CA1	27	40
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010342	GH	On-Demand	Anodyne	CA4	47	40
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010342	GH	On-Demand	Anodyne	NCE103	17	40
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(OC2CCCC2)cc1	ZINC000872010342	GH	On-Demand	Anodyne	A6YCJ1_9METZ	16	40
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)c1	ZINC000872010404	GG	On-Demand	Anodyne	CA2	23	41
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)c1	ZINC000872010404	GG	On-Demand	Anodyne	CA1	23	41
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)c1	ZINC000872010404	GG	On-Demand	Anodyne	CA4	46	41
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)c1	ZINC000872010405	GG	On-Demand	Anodyne	CA2	23	41
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)c1	ZINC000872010405	GG	On-Demand	Anodyne	CA1	23	41
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nnc([C@@H]3CCCO3)s2)c1	ZINC000872010405	GG	On-Demand	Anodyne	CA4	46	41
CCCc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872010417	EH	On-Demand	Anodyne	ADRB3	79	42
CCCc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872010417	EH	On-Demand	Anodyne	FFAR4	23	52
CCOc1n[nH]c(NS(=O)(=O)c2ccc(F)c(C)c2)n1	ZINC000872010421	DD	On-Demand	Anodyne	LEF	34	41
CCOc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1C	ZINC000872010426	EH	On-Demand	Anodyne	ALPL	22	42
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cncc(C(F)F)c3)ccc21	ZINC000872010449	GG	On-Demand	Anodyne	CYP11B2	21	40
COCCc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1	ZINC000872010455	EG	On-Demand	Anodyne	ADRB3	73	40
CCOc1n[nH]c(NS(=O)(=O)c2ccc(C)c(Cl)c2)n1	ZINC000872010518	DD	On-Demand	Anodyne	MTNN	46	32
CCOc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1OCC	ZINC000872010521	FH	On-Demand	Anodyne	ALPL	19	43
O=S(=O)(Nc1nnc([C@H]2CCCO2)s1)c1ccc(Cl)nc1	ZINC000872010531	EE	On-Demand	Anodyne	CA4	42	37
O=S(=O)(Nc1nnc([C@@H]2CCCO2)s1)c1ccc(Cl)nc1	ZINC000872010532	EE	On-Demand	Anodyne	CA4	42	37
CCOc1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)c(C)c1	ZINC000872010534	EH	On-Demand	Anodyne	ALPL	22	43
O=C(c1ccc(S(=O)(=O)Nc2cncc(C(F)F)c2)cc1)N1CCOCC1	ZINC000872010562	GE	On-Demand	Anodyne	BTK	20	40
N#Cc1ncccc1NS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000872010578	EG	On-Demand	Mild	PRTN3	49	31
O=C1CCCc2cc(S(=O)(=O)Nc3cncc(C(F)F)c3)ccc2N1	ZINC000872010610	FG	On-Demand	Anodyne	PKM	41	53
CN(C)c1ccc(F)cc1NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000872010645	GF	On-Demand	Anodyne	MAPK11	32	41
CN(C)c1ccc(F)cc1NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000872010645	GF	On-Demand	Anodyne	MAPK14	43	41
CC(C)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010687	EI	On-Demand	Anodyne	MTNN	65	35
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc4c(n3)CCCC4)ccc21	ZINC000872010688	FF	On-Demand	Anodyne	HSD17B3	42	35
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc3c(n2)CCCC3)cc1	ZINC000872010697	FE	On-Demand	Anodyne	PTGS2	15	41
Cc1ccc2c(n1)N(S(=O)(=O)c1cnn(C)c1C(F)(F)F)CCC2	ZINC000872010709	FE	On-Demand	Anodyne	BRS3	18	41
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc4c(n3)CCCC4)ccc21	ZINC000872010711	GG	On-Demand	Anodyne	HSD17B3	42	35
Cc1ccc2c(n1)N(S(=O)(=O)c1cc3c4c(c1)CCN4C(=O)CC3)CCC2	ZINC000872010722	GE	On-Demand	Anodyne	CYP11B1	40	42
Cc1ccc2c(n1)N(S(=O)(=O)c1cc3c4c(c1)CCN4C(=O)CC3)CCC2	ZINC000872010722	GE	On-Demand	Anodyne	CYP11B2	46	41
COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(n2)CCCC3)c1	ZINC000872010732	GE	On-Demand	Anodyne	DRD4	42	32
O=S(=O)(Nc1ccc2c(n1)CCCC2)c1ccc2c(c1)OCCO2	ZINC000872010748	EF	On-Demand	Anodyne	PKM	34	41
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010749	GG	On-Demand	Anodyne	CYP11B1	15	43
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010749	GG	On-Demand	Anodyne	CYP11B2	31	43
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010749	GG	On-Demand	Anodyne	SFRP1	67	34
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010749	GG	On-Demand	Anodyne	WNT3	67	34
CN(C)c1ccc(F)cc1NS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	ZINC000872010756	GE	On-Demand	Anodyne	MOGAT2	41	35
Cc1ccc2c(n1)N(S(=O)(=O)c1cc(C(F)(F)F)nn1C)CCC2	ZINC000872010798	FE	On-Demand	Anodyne	BRS3	16	40
O=C1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc2N1	ZINC000872010807	GG	On-Demand	Anodyne	PKM	35	47
O=C1CCCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc2N1	ZINC000872010807	GG	On-Demand	Anodyne	PTK2B	19	45
CN(C)c1ccc(S(=O)(=O)Nc2cc(F)ccc2N(C)C)cn1	ZINC000872010833	EE	On-Demand	Anodyne	PIK3CA	22	46
CN(C)c1ccc(S(=O)(=O)Nc2cc(F)ccc2N(C)C)cn1	ZINC000872010833	EE	On-Demand	Anodyne	PIK3C3	47	33
CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc21	ZINC000872010848	GG	On-Demand	Anodyne	SFRP1	67	34
CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc21	ZINC000872010848	GG	On-Demand	Anodyne	WNT3	67	34
Cc1cc(C(F)(F)F)cc(C)c1NS(=O)(=O)c1c(C)nn(C)c1Cl	ZINC000872010854	GH	On-Demand	Anodyne	NMT1	43	43
COC(=O)c1oc(S(=O)(=O)N2CCCc3ccc(C)nc32)cc1C	ZINC000872010867	FE	On-Demand	Anodyne	LPL	44	36
CC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(n2)CCCC3)c1	ZINC000872010876	EF	On-Demand	Anodyne	AKR1C3	49	33
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	MAPK11	28	40
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	MAPK14	40	40
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	MAPK13	58	34
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	CCR2	45	41
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	SFRP1	128	40
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)c1	ZINC000872010878	GF	On-Demand	Anodyne	WNT3	87	40
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2cc(F)ccc2N(C)C)s1	ZINC000872010894	FE	On-Demand	Anodyne	PIK3CA	15	41
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2cc(F)ccc2N(C)C)s1	ZINC000872010894	FE	On-Demand	Anodyne	PIK3CG	16	41
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2cc(F)ccc2N(C)C)s1	ZINC000872010894	FE	On-Demand	Anodyne	RORA	17	51
CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc21	ZINC000872010929	GF	On-Demand	Anodyne	CYP11B2	16	41
CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc21	ZINC000872010929	GF	On-Demand	Anodyne	SFRP1	67	34
CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc21	ZINC000872010929	GF	On-Demand	Anodyne	WNT3	67	34
CN(C)c1ccc(F)cc1NS(=O)(=O)c1cc2c3c(c1)CCN3C(=O)CC2	ZINC000872010930	GF	On-Demand	Anodyne	CYP11B1	29	43
CN(C)c1ccc(F)cc1NS(=O)(=O)c1cc2c3c(c1)CCN3C(=O)CC2	ZINC000872010930	GF	On-Demand	Anodyne	CYP11B2	29	43
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010974	GF	On-Demand	Anodyne	CYP11B1	15	48
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010974	GF	On-Demand	Anodyne	CYP11B2	33	48
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010974	GF	On-Demand	Anodyne	SFRP1	67	34
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)ccc21	ZINC000872010974	GF	On-Demand	Anodyne	WNT3	67	34
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)cc1	ZINC000872010984	GI	On-Demand	Anodyne	PRTN3	54	34
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)cc1	ZINC000872010984	GI	On-Demand	Anodyne	SFRP1	53	35
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)cc1	ZINC000872010984	GI	On-Demand	Anodyne	WNT3	46	35
COCCNC(=O)c1cccc(S(=O)(=O)Nc2cc(F)ccc2N(C)C)c1	ZINC000872011009	GE	On-Demand	Anodyne	DRD4	41	32
O=C1Cc2cc(S(=O)(=O)Nc3cnccc3C(F)(F)F)cc3c2N1CCC3	ZINC000872011027	GF	On-Demand	Anodyne	CYP11B2	36	43
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2ccc3c(n2)CCCC3)c1	ZINC000872011054	FF	On-Demand	Anodyne	AKR1C3	43	32
Cc1nn(C)c2ncc(S(=O)(=O)Nc3cc(F)ccc3N(C)C)cc12	ZINC000872011060	FE	On-Demand	Anodyne	PIK3CA	15	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cc(F)ccc2N(C)C)c1	ZINC000872011075	GF	On-Demand	Anodyne	LIMK2	26	43
COCCOc1ccc(S(=O)(=O)Nc2cnccc2C(F)(F)F)cc1	ZINC000872011097	GF	On-Demand	Anodyne	PRTN3	55	33
Cc1cc(C)c(S(=O)(=O)Nc2cnccc2C(F)(F)F)c(C)c1	ZINC000872011100	EH	On-Demand	Anodyne	NR3C1	15	41
CN(C)c1ccc(F)cc1NS(=O)(=O)c1ncn(C)c1Cl	ZINC000872011128	EE	On-Demand	Anodyne	PIK3CA	20	41
CN(C)c1ccc(F)cc1NS(=O)(=O)c1ncn(C)c1Cl	ZINC000872011128	EE	On-Demand	Anodyne	PIK3C3	44	32
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	ZINC000872011178	GD	On-Demand	Anodyne	CYP11B2	27	43
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	ZINC000872011178	GD	On-Demand	Anodyne	AKR1C3	50	36
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1C	ZINC000872011187	GH	On-Demand	Anodyne	KCNQ2	59	32
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1C	ZINC000872011187	GH	On-Demand	Anodyne	HTR6	21	46
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1C	ZINC000872011187	GH	On-Demand	Anodyne	PKM	26	43
CCn1ncc(-c2nc(-c3ccc(OC)c(OC)c3)no2)c1Br	ZINC000872011188	GG	On-Demand	Anodyne	LUCI_PHOPE	31	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(F)c(F)c1)CCC2	ZINC000872011191	DF	On-Demand	Anodyne	BRS3	16	40
COC(=O)c1nscc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011194	GF	On-Demand	Anodyne	PKM	22	43
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(C(F)F)cc1)CCC2	ZINC000872011203	EG	On-Demand	Anodyne	BRS3	25	42
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(C(F)(F)F)nc1)CCC2	ZINC000872011214	FF	On-Demand	Anodyne	BRS3	40	46
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(C)c(N4CCCC4)c3)ccc21	ZINC000872011217	GG	On-Demand	Anodyne	PKM	33	44
CC(=O)Nc1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c(F)c1	ZINC000872011228	FF	On-Demand	Anodyne	CPT1A	25	44
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(F)c1)CCC2	ZINC000872011233	DF	On-Demand	Anodyne	CYP11B2	28	51
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(F)c1)CCC2	ZINC000872011233	DF	On-Demand	Anodyne	AKR1C3	53	42
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000872011236	FD	On-Demand	Anodyne	BRS3	26	43
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000872011236	FD	On-Demand	Anodyne	CYP11B2	20	40
COc1ccccc1-c1noc(-c2cnn(C(C)C)c2Br)n1	ZINC000872011237	FH	On-Demand	Anodyne	LUCI_PHOPE	41	59
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011241	GE	On-Demand	Anodyne	CPT1A	63	49
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011241	GE	On-Demand	Anodyne	CPT2	50	43
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011241	GE	On-Demand	Anodyne	CPT1B	61	47
COc1ccc(-c2noc([C@H](O)[C@@H](C)c3ccccc3F)n2)cc1OC	ZINC000872011243	FH	On-Demand	Anodyne	LUCI_PHOPE	29	40
COc1ccc(-c2noc([C@@H](O)[C@H](C)c3ccccc3F)n2)cc1OC	ZINC000872011244	FH	On-Demand	Anodyne	LUCI_PHOPE	29	40
COc1ccc(-c2noc([C@@H](O)[C@@H](C)c3ccccc3F)n2)cc1OC	ZINC000872011245	FH	On-Demand	Anodyne	LUCI_PHOPE	29	40
COc1ccc(-c2noc([C@H](O)[C@H](C)c3ccccc3F)n2)cc1OC	ZINC000872011246	FH	On-Demand	Anodyne	LUCI_PHOPE	29	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1)CCC2	ZINC000872011257	GE	On-Demand	Anodyne	TRPV1	102	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc3c(c1)OCCO3)CCC2	ZINC000872011259	EE	On-Demand	Anodyne	PKM	44	49
Cc1ccc2c(n1)N(S(=O)(=O)c1cncc(F)c1)CCC2	ZINC000872011262	DE	On-Demand	Anodyne	CYP11B2	27	41
CNC(=O)c1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)cn1C	ZINC000872011265	GE	On-Demand	Anodyne	PKM	18	42
COc1cncc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)c1	ZINC000872011283	EF	On-Demand	Anodyne	HTR6	19	45
COc1cncc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)c1	ZINC000872011283	EF	On-Demand	Anodyne	GHSR	15	40
COc1cncc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)c1	ZINC000872011283	EF	On-Demand	Anodyne	PKM	15	42
CC(=O)N1CCc2ccc(S(=O)(=O)N3CCCc4ccc(C)nc43)cc2CC1	ZINC000872011302	GE	On-Demand	Anodyne	AKR1C3	48	38
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(F)cc1)CCC2	ZINC000872011305	DF	On-Demand	Anodyne	BRS3	51	49
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(F)cc1)CCC2	ZINC000872011305	DF	On-Demand	Anodyne	CYP11B2	22	46
CC(=O)Nc1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)cc1	ZINC000872011308	EE	On-Demand	Anodyne	TGM2	55	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)cc1	ZINC000872011308	EE	On-Demand	Anodyne	F13A1	74	42
Cc1ccc2c(n1)N(S(=O)(=O)c1cccnc1C(F)(F)F)CCC2	ZINC000872011313	FF	On-Demand	Anodyne	BRS3	26	42
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc3c(c1)OCO3)CCC2	ZINC000872011321	EE	On-Demand	Anodyne	PKM	37	41
CC(=O)c1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)cc1	ZINC000872011325	EF	On-Demand	Anodyne	BRS3	21	40
COc1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011364	DF	On-Demand	Anodyne	CYP11B1	19	56
COc1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011364	DF	On-Demand	Anodyne	CYP11B2	38	58
COc1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011364	DF	On-Demand	Anodyne	AKR1C3	52	47
Cc1ccc2c(n1)N(S(=O)(=O)c1cccnc1)CCC2	ZINC000872011365	CD	On-Demand	Anodyne	CYP11B1	19	50
Cc1ccc2c(n1)N(S(=O)(=O)c1cccnc1)CCC2	ZINC000872011365	CD	On-Demand	Anodyne	CYP11B2	40	50
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(=O)N(C)C)c1)CCC2	ZINC000872011372	FE	On-Demand	Anodyne	AKR1C3	68	54
COC(=O)c1cncc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011390	ED	On-Demand	Anodyne	AKR1C3	38	43
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(N(C)C)c1)CCC2	ZINC000872011393	EF	On-Demand	Anodyne	CYP11B2	25	41
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(N(C)C)c1)CCC2	ZINC000872011393	EF	On-Demand	Anodyne	AKR1C3	50	36
CCn1nccc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011400	EF	On-Demand	Anodyne	PKM	16	42
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CO)cc2)CC1	ZINC000872011409	DD	On-Demand	Anodyne	GPR119	49	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CO)cc2)CC1	ZINC000872011409	DD	On-Demand	Anodyne	KDM1A	15	40
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CO)cc2)CC1	ZINC000872011409	DD	On-Demand	Anodyne	L3MBTL3	42	37
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(S(C)(=O)=O)c1)CCC2	ZINC000872011413	FD	On-Demand	Anodyne	CYP11B2	27	43
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(S(C)(=O)=O)c1)CCC2	ZINC000872011413	FD	On-Demand	Anodyne	AKR1C3	54	38
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1)CCC2	ZINC000872011414	GD	On-Demand	Anodyne	BRS3	26	43
CC(C)n1ncc(-c2nc(CC(=O)NC3CCCCC3)no2)c1Br	ZINC000872011418	GG	On-Demand	Anodyne	BMP1	57	35
Cc1ccc2c(n1)N(S(=O)(=O)c1ccccc1)CCC2	ZINC000872011428	CF	On-Demand	Anodyne	BRS3	21	41
Cc1ccc2c(n1)N(S(=O)(=O)c1ccccc1)CCC2	ZINC000872011428	CF	On-Demand	Anodyne	CYP11B2	25	45
Cc1ccc2c(n1)N(S(=O)(=O)c1ccccc1)CCC2	ZINC000872011428	CF	On-Demand	Anodyne	AKR1C3	55	36
CC(=O)N1CCc2ccc(S(=O)(=O)Nc3ccc(C)c(N4CCCC4)c3)cc21	ZINC000872011433	GG	On-Demand	Anodyne	HTR6	19	45
CC(=O)N1CCc2ccc(S(=O)(=O)Nc3ccc(C)c(N4CCCC4)c3)cc21	ZINC000872011433	GG	On-Demand	Anodyne	PKM	31	44
Cc1ccc2c(n1)N(S(=O)(=O)CCc1ccccc1[N+](=O)[O-])CCC2	ZINC000872011436	FF	On-Demand	Bother	COLA	83	33
Cc1cc(C(N)=O)cc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011439	ED	On-Demand	Anodyne	AKR1C3	46	38
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011444	GD	On-Demand	Anodyne	CYP11B2	25	41
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011444	GD	On-Demand	Anodyne	AKR1C3	51	36
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1F	ZINC000872011446	GG	On-Demand	Anodyne	KCNQ2	48	35
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1F	ZINC000872011446	GG	On-Demand	Anodyne	HTR6	19	43
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)ccc1F	ZINC000872011446	GG	On-Demand	Anodyne	PKM	26	40
COc1cncc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011452	DD	On-Demand	Anodyne	CYP11B1	19	46
COc1cncc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011452	DD	On-Demand	Anodyne	CYP11B2	38	46
Cc1ccc2c(n1)N(S(=O)(=O)c1cc3c(cc1F)NC(=O)CC3)CCC2	ZINC000872011457	GF	On-Demand	Anodyne	PKM	38	47
COC(=O)c1c(F)cccc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011474	GG	On-Demand	Anodyne	PKM	30	43
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C#N)c1)CCC2	ZINC000872011477	DE	On-Demand	Mild	CYP11B2	27	54
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C#N)c1)CCC2	ZINC000872011477	DE	On-Demand	Mild	AKR1C3	48	44
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(C#N)cc1C)CCC2	ZINC000872011482	EF	On-Demand	Mild	CYP11B2	21	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872011488	JE	On-Demand	Anodyne	CACNA1B	60	39
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872011488	JE	On-Demand	Anodyne	CCR2	82	41
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872011488	JE	On-Demand	Anodyne	GPR119	44	39
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872011488	JE	On-Demand	Anodyne	SFRP1	128	49
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872011488	JE	On-Demand	Anodyne	WNT3	88	43
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(CC#N)c1)CCC2	ZINC000872011508	EF	On-Demand	Mild	CYP11B2	25	44
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(CC#N)c1)CCC2	ZINC000872011508	EF	On-Demand	Mild	AKR1C3	42	36
COc1ccccc1-c1noc(-c2c(C)noc2C(C)C)n1	ZINC000872011510	CH	On-Demand	Anodyne	LUCI_PHOPE	41	58
CC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011514	EF	On-Demand	Anodyne	CYP11B2	25	42
CC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011514	EF	On-Demand	Anodyne	AKR1C3	74	47
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)CCC2	ZINC000872011524	EE	On-Demand	Bother	BRS3	18	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)CCC2	ZINC000872011524	EE	On-Demand	Bother	CYP11B2	19	40
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	HTR1A	24	43
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	DRD2	24	40
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	HTR7	15	40
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	HTR6	23	49
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	GHSR	15	44
COc1cccc(OC)c1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011525	GG	On-Demand	Anodyne	PKM	29	46
Cc1ccc2c(n1)N(S(=O)(=O)c1cncc(C#N)c1)CCC2	ZINC000872011526	DD	On-Demand	Mild	CYP11B2	25	44
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011535	FE	On-Demand	Mild	CPT1A	17	45
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011535	FE	On-Demand	Mild	AKR1C3	61	40
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(F)F)c1)CCC2	ZINC000872011540	EG	On-Demand	Anodyne	CYP11B2	25	40
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(F)F)c1)CCC2	ZINC000872011540	EG	On-Demand	Anodyne	AKR1C3	48	35
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000872011543	JF	On-Demand	Anodyne	MC4R	25	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000872011543	JF	On-Demand	Anodyne	F13A1	23	41
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000872011543	JF	On-Demand	Anodyne	GPR119	40	38
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000872011543	JF	On-Demand	Anodyne	SFRP1	37	41
CC(=O)Nc1nc(C)c(S(=O)(=O)N2CCCc3ccc(C)nc32)s1	ZINC000872011546	FE	On-Demand	Anodyne	PIK3CG	17	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(C#N)cc1)CCC2	ZINC000872011557	DE	On-Demand	Mild	BRS3	19	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(C#N)cc1)CCC2	ZINC000872011557	DE	On-Demand	Mild	CYP11B2	20	49
COc1ccc(C)cc1S(=O)(=O)N1CCCc2ccc(C)nc21	ZINC000872011558	EF	On-Demand	Anodyne	CPT1A	29	49
COc1ccc(C)cc1S(=O)(=O)N1CCCc2ccc(C)nc21	ZINC000872011558	EF	On-Demand	Anodyne	CPT1B	21	49
Cc1ccc2c(n1)N(S(=O)(=O)Cc1ccccc1[N+](=O)[O-])CCC2	ZINC000872011561	EF	On-Demand	Bother	COLA	108	35
COc1ccccc1-c1noc(-c2c(Cl)n[nH]c2C2CC2)n1	ZINC000872011562	DH	On-Demand	Anodyne	LUCI_PHOPE	37	51
COCCNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011563	GD	On-Demand	Anodyne	DRD4	46	36
COCCNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011563	GD	On-Demand	Anodyne	CPT1A	18	43
COCCNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011563	GD	On-Demand	Anodyne	AKR1C3	64	43
Cc1ccc2c(n1)N(S(=O)(=O)c1c(F)cccc1F)CCC2	ZINC000872011567	DF	On-Demand	Anodyne	PKM	20	43
COCCn1cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)cn1	ZINC000872011568	FE	On-Demand	Anodyne	HTR6	17	46
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(=O)NC3CC3)c1)CCC2	ZINC000872011577	FE	On-Demand	Anodyne	CPT1A	18	45
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(=O)NC3CC3)c1)CCC2	ZINC000872011577	FE	On-Demand	Anodyne	MAPK13	71	34
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(C(=O)NC3CC3)c1)CCC2	ZINC000872011577	FE	On-Demand	Anodyne	AKR1C3	67	44
COc1ccc(-c2noc(-c3c(C)noc3C(C)C)n2)cc1OC	ZINC000872011579	EH	On-Demand	Anodyne	S1PR1	18	40
CCN(C)C(=O)c1cccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011593	FF	On-Demand	Anodyne	AKR1C3	62	44
COC(=O)c1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c(OC)c1	ZINC000872011597	GE	On-Demand	Anodyne	CPT1A	40	43
COC(=O)c1ccc(S(=O)(=O)N2CCCc3ccc(C)nc32)c(OC)c1	ZINC000872011597	GE	On-Demand	Anodyne	CPT1B	29	41
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(-c3nnnn3C)c1)CCC2	ZINC000872011601	FD	On-Demand	Anodyne	CYP11B2	28	46
CC(C)(C)OC(=O)N1CCN(C(=O)COc2cccc3cccnc23)CC1	ZINC000872011602	FF	On-Demand	Anodyne	GPR119	45	44
Cc1ccc2c(n1)N(S(=O)(=O)c1cncc(Cl)c1)CCC2	ZINC000872011610	DF	On-Demand	Anodyne	CYP11B2	25	41
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1)CCC2	ZINC000872011612	GE	On-Demand	Anodyne	BRS3	22	40
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc(-n3cnnn3)c1)CCC2	ZINC000872011613	FD	On-Demand	Anodyne	AKR1C3	46	35
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(F)c(F)c2F)CC1	ZINC000872011614	ID	On-Demand	Anodyne	F13A1	17	44
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(F)c(F)c2F)CC1	ZINC000872011614	ID	On-Demand	Anodyne	GPR119	50	48
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc3c(c1)NC(=O)CO3)CCC2	ZINC000872011619	FD	On-Demand	Anodyne	HTR1D	15	40
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc3c(c1)NC(=O)CO3)CCC2	ZINC000872011619	FD	On-Demand	Anodyne	HTR1B	20	40
COc1ccsc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011622	FG	On-Demand	Anodyne	HTR6	20	48
COc1ccsc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011622	FG	On-Demand	Anodyne	GHSR	15	46
COc1ccsc1S(=O)(=O)Nc1ccc(C)c(N2CCCC2)c1	ZINC000872011622	FG	On-Demand	Anodyne	PKM	17	44
COc1cccc(CS(=O)(=O)N2CCCc3ccc(C)nc32)c1	ZINC000872011625	EF	On-Demand	Anodyne	CYP11B2	18	46
Cc1ccc2c(n1)N(S(=O)(=O)c1cc3c4c(c1)CCC(=O)N4CCC3)CCC2	ZINC000872011636	GF	On-Demand	Anodyne	CYP11B1	37	44
Cc1ccc2c(n1)N(S(=O)(=O)c1cc3c4c(c1)CCC(=O)N4CCC3)CCC2	ZINC000872011636	GF	On-Demand	Anodyne	CYP11B2	45	44
CC(=O)N1CCc2cc(S(=O)(=O)N3CCCc4ccc(C)nc43)ccc21	ZINC000872011643	FE	On-Demand	Anodyne	CYP11B1	15	43
CC(=O)N1CCc2cc(S(=O)(=O)N3CCCc4ccc(C)nc43)ccc21	ZINC000872011643	FE	On-Demand	Anodyne	CYP11B2	32	43
Cc1cc(C(N)=O)cc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)c1	ZINC000872011652	FF	On-Demand	Anodyne	PKM	15	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	F2	31	48
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	F10	17	44
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	HTR7	21	43
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	MMP13	27	54
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	TRY2_BOVIN	98	46
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	MMP2	18	54
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	MMP9	15	43
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	TGM2	29	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	ST14	18	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	NR1H2	21	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	F13A1	43	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	GPR119	52	41
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	SFRP1	104	46
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000872011654	IE	On-Demand	Anodyne	WNT3	68	40
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C/c2cnc3ccccc3n2)CC1	ZINC000872011665	FF	On-Demand	Anodyne	ITGAL	53	35
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C/c2cnc3ccccc3n2)CC1	ZINC000872011665	FF	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2cnc3ccccc3n2)CC1	ZINC000872011666	FF	On-Demand	Anodyne	ITGAL	53	35
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2cnc3ccccc3n2)CC1	ZINC000872011666	FF	On-Demand	Anodyne	GPR119	36	42
COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)c(N3CCCC3)c2)cn1	ZINC000872011676	GF	On-Demand	Anodyne	HTR6	20	45
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc([N+](=O)[O-])c1)CCC2	ZINC000872011681	EE	On-Demand	Bother	CYP11B2	27	42
Cc1ccc2c(n1)N(S(=O)(=O)c1cccc([N+](=O)[O-])c1)CCC2	ZINC000872011681	EE	On-Demand	Bother	AKR1C3	47	45
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(Br)cc2Cl)CC1	ZINC000872011689	JE	On-Demand	Anodyne	TGM1	15	47
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(Br)cc2Cl)CC1	ZINC000872011689	JE	On-Demand	Anodyne	F13A1	24	47
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(Br)cc2Cl)CC1	ZINC000872011689	JE	On-Demand	Anodyne	GPR119	40	39
Cc1ccc2c(n1)N(S(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1)CCC2	ZINC000872011694	GE	On-Demand	Anodyne	BRS3	25	40
CC(=O)N1CCCc2cc(S(=O)(=O)N3CCCc4ccc(C)nc43)ccc21	ZINC000872011701	GF	On-Demand	Anodyne	CYP11B1	15	40
CC(=O)N1CCCc2cc(S(=O)(=O)N3CCCc4ccc(C)nc43)ccc21	ZINC000872011701	GF	On-Demand	Anodyne	CYP11B2	31	40
O=C1CC[C@H](c2nc(-c3cccc(CN4CCCCC4)c3)no2)O1	ZINC000872011727	EG	On-Demand	Anodyne	GRM5	19	41
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872011754	ID	On-Demand	Anodyne	HTR7	17	44
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872011754	ID	On-Demand	Anodyne	TGM2	15	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872011754	ID	On-Demand	Anodyne	F13A1	23	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872011754	ID	On-Demand	Anodyne	GPR119	49	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872011754	ID	On-Demand	Anodyne	SFRP1	44	42
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011760	FG	On-Demand	Anodyne	CPT1A	74	47
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011760	FG	On-Demand	Anodyne	GRM5	16	47
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011760	FG	On-Demand	Anodyne	SMO	29	40
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011761	FG	On-Demand	Anodyne	CPT1A	74	47
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011761	FG	On-Demand	Anodyne	GRM5	16	47
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1	ZINC000872011761	FG	On-Demand	Anodyne	SMO	29	40
COC(=O)CC[C@@H]1CC[C@H](c2nc(-c3ccc(N4CCCCC4)nc3)no2)O1	ZINC000872011765	GG	On-Demand	Anodyne	ETHR	46	33
CN(C)S(=O)(=O)c1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1Br	ZINC000872011785	JE	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872011861	JD	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872011861	JD	On-Demand	Anodyne	SFRP1	36	40
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3ccc(N4CCCCC4)nc3)no2)C1	ZINC000872011894	FH	On-Demand	Anodyne	CPT1A	41	42
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3ccc(N4CCCCC4)nc3)no2)C1	ZINC000872011894	FH	On-Demand	Anodyne	GRM5	15	42
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3ccc(N4CCCCC4)nc3)no2)C1	ZINC000872011894	FH	On-Demand	Anodyne	DGAT1	16	44
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3ccc(N4CCCCC4)nc3)no2)C1	ZINC000872011894	FH	On-Demand	Anodyne	ETHR	47	34
COC(=O)[C@@H]1CO[C@H](CCc2nc(-c3ccc(Oc4ccccc4)nc3)no2)C1	ZINC000872011950	GG	On-Demand	Anodyne	CPT1A	53	38
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)CC1	ZINC000872011979	HE	On-Demand	Anodyne	TGM1	15	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)CC1	ZINC000872011979	HE	On-Demand	Anodyne	F13A1	18	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)CC1	ZINC000872011979	HE	On-Demand	Anodyne	GPR119	51	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)CC1	ZINC000872011979	HE	On-Demand	Anodyne	L3MBTL3	41	33
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000872011986	GH	On-Demand	Anodyne	ETHR	24	41
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3cccnc3Oc3ccccc3)no2)C1	ZINC000872012002	GI	On-Demand	Anodyne	CPT1A	54	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872012030	JD	On-Demand	Anodyne	BMP1	20	41
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872012030	JD	On-Demand	Anodyne	GPR119	43	40
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872012030	JD	On-Demand	Anodyne	SFRP1	53	42
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000872012030	JD	On-Demand	Anodyne	WNT3	48	36
Cn1cnc2cc(S(=O)(=O)NCC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000872012033	IC	On-Demand	Anodyne	GPR119	52	40
Cn1cnc2cc(S(=O)(=O)NCC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000872012033	IC	On-Demand	Anodyne	SFRP1	45	41
CC(C)(C)OC(=O)NC1(c2noc(-c3cnn(CC4CC4)c3)n2)CCCC1	ZINC000872012046	FH	On-Demand	Anodyne	ALOX5AP	16	40
C[C@H]1CC(=O)N[C@@H](c2nc(-c3ccc(Oc4ccccc4)nc3)no2)C1	ZINC000872012108	FH	On-Demand	Anodyne	CPT1A	46	42
COC(=O)[C@@H]1CO[C@H](CCc2nc(-c3cccc(CN4CCCCC4)c3)no2)C1	ZINC000872012131	GG	On-Demand	Anodyne	HRH2	41	37
CCO[C@H](c1nc(-c2cccc(C(=O)OC)c2)no1)C1CCOCC1	ZINC000872012192	EG	On-Demand	Anodyne	BMP1	22	42
CCO[C@@H](c1nc(-c2cccc(C(=O)OC)c2)no1)C1CCOCC1	ZINC000872012193	EG	On-Demand	Anodyne	BMP1	22	42
CC(C)(C)OC(=O)N1CCOC[C@H]1c1noc(-c2ccnc(-n3cccc3)c2)n1	ZINC000872012280	GG	On-Demand	Anodyne	CPT1A	29	41
CC(C)(C)OC(=O)N1CCOC[C@@H]1c1noc(-c2ccnc(-n3cccc3)c2)n1	ZINC000872012281	GG	On-Demand	Anodyne	CPT1A	29	41
COC(=O)[C@@H]1CO[C@H](CCc2nc(-c3ccc(N4CCCCC4)cc3)no2)C1	ZINC000872012381	GG	On-Demand	Anodyne	SPHK1	34	41
C[C@H]1CC(=O)N[C@@H](c2nc(-c3ccc(OCc4ccccc4)cc3)no2)C1	ZINC000872012421	FH	On-Demand	Anodyne	CPT1A	47	44
C[C@H]1CC(=O)N[C@@H](c2nc(-c3ccc(COc4ccccc4)cc3)no2)C1	ZINC000872012442	FH	On-Demand	Anodyne	CPT1A	59	44
CN(C)S(=O)(=O)c1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000872012446	IE	On-Demand	Anodyne	F13A1	17	43
CN(C)S(=O)(=O)c1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000872012446	IE	On-Demand	Anodyne	GPR119	43	38
C[C@H]1CC(=O)N[C@@H](c2nc(-c3cccc(CN4CCCCC4)c3)no2)C1	ZINC000872012449	FG	On-Demand	Anodyne	CPT1A	40	40
C[C@H]1CC(=O)N[C@@H](c2nc(-c3cccc(CN4CCCCC4)c3)no2)C1	ZINC000872012449	FG	On-Demand	Anodyne	GRM5	19	42
COC(=O)CC[C@@H]1CC[C@H](c2nc(-c3ccc(Oc4ccccc4)nc3)no2)O1	ZINC000872012469	GI	On-Demand	Anodyne	CPT1A	47	41
COc1ccc(-c2noc(-c3c(Cl)n[nH]c3C3CC3)n2)cc1	ZINC000872012473	DH	On-Demand	Anodyne	LUCI_PHOPE	23	45
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872012578	HD	On-Demand	Anodyne	SLC6A9	44	42
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872012578	HD	On-Demand	Anodyne	F13A1	16	42
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872012578	HD	On-Demand	Anodyne	GPR119	54	46
C[C@H]1CC(=O)N[C@@H](c2nc(-c3cccc(OCc4cccnc4)c3)no2)C1	ZINC000872012603	FG	On-Demand	Anodyne	CPT1A	33	40
C[C@H]1CC(=O)N[C@@H](c2nc(-c3cccc(OCc4cccnc4)c3)no2)C1	ZINC000872012603	FG	On-Demand	Anodyne	GRM5	16	40
CCOC1CC2(C1)C[C@@H]2c1nc(-c2cccc(C(=O)OC)c2)no1	ZINC000872012606	EG	On-Demand	Anodyne	GRM5	18	40
O=c1ccccn1Cc1noc(-c2ccc(C3CCOCC3)cc2)n1	ZINC000872012619	EF	On-Demand	Anodyne	S1PR4	23	40
O=c1ccccn1Cc1noc(-c2ccc(C3CCOCC3)cc2)n1	ZINC000872012619	EF	On-Demand	Anodyne	S1PR5	29	40
O=C1CCCCN(Cc2nc(-c3ccc(COc4ccccc4)cc3)no2)C1=O	ZINC000872012624	GG	On-Demand	Anodyne	CPT1A	57	41
O=C1CCCCN(Cc2nc(-c3ccc(Oc4ccccc4)nc3)no2)C1=O	ZINC000872012639	GG	On-Demand	Anodyne	CPT1A	42	39
CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872012647	JE	On-Demand	Anodyne	SLC6A9	44	53
CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872012647	JE	On-Demand	Anodyne	GPR119	43	42
CN1C(=O)C[C@H](c2nc(C3CCCCCC3)no2)[C@H]1c1cccc(F)c1	ZINC000872012671	FI	On-Demand	Anodyne	HSD17B2	24	40
NC(=O)[C@@H]1CC[C@H](CCc2nc(-c3ccc(N4CCCCC4)cc3)no2)O1	ZINC000872012680	FF	On-Demand	Anodyne	SPHK1	37	42
COC(=O)c1cccc(-c2noc(-c3cn4c(n3)C[C@H](OC)CC4)n2)c1	ZINC000872012685	FE	On-Demand	Anodyne	CPT1A	43	38
COC(=O)c1cccc(-c2noc(-c3cn4c(n3)C[C@@H](OC)CC4)n2)c1	ZINC000872012686	FE	On-Demand	Anodyne	CPT1A	43	38
C[C@H]1CC(=O)N[C@@H](c2nc(-c3ccc(OCc4cccnc4)cc3)no2)C1	ZINC000872012748	FG	On-Demand	Anodyne	CPT1A	36	40
COC(=O)CC[C@@H]1CC[C@H](c2nc(-c3c(Cl)cccc3Cl)no2)O1	ZINC000872012776	FI	On-Demand	Anodyne	ETHR	42	32
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2ccc(N3CCCCC3)cc2)no1	ZINC000872012867	GH	On-Demand	Anodyne	ETHR	39	40
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2cccc(CN3CCOCC3)c2)no1	ZINC000872012886	GF	On-Demand	Anodyne	PIK3CA	18	42
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2cccc(CN3CCOCC3)c2)no1	ZINC000872012886	GF	On-Demand	Anodyne	MTOR	21	42
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2cccc(CN3CCOCC3)c2)no1	ZINC000872012886	GF	On-Demand	Anodyne	ETHR	24	41
COC(=O)c1cccc(-c2noc(-c3c(C)noc3C(C)C)n2)c1	ZINC000872012895	EH	On-Demand	Anodyne	NR1H4	44	38
CCO[C@H](c1nc(-c2cccc(C(=O)OC)c2)no1)[C@H]1CCOC1	ZINC000872012956	EF	On-Demand	Anodyne	BMP1	20	41
CCO[C@H](c1nc(-c2cccc(C(=O)OC)c2)no1)[C@@H]1CCOC1	ZINC000872012957	EF	On-Demand	Anodyne	BMP1	20	41
CCO[C@@H](c1nc(-c2cccc(C(=O)OC)c2)no1)[C@H]1CCOC1	ZINC000872012958	EF	On-Demand	Anodyne	BMP1	20	41
CCO[C@@H](c1nc(-c2cccc(C(=O)OC)c2)no1)[C@@H]1CCOC1	ZINC000872012959	EF	On-Demand	Anodyne	BMP1	20	41
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3cccc(CN4CCOCC4)c3)no2)C1	ZINC000872012960	GG	On-Demand	Anodyne	GRM5	19	45
O=c1c(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)cccn1C1CC1	ZINC000872012961	GF	On-Demand	Anodyne	PIK3CA	15	42
O=c1c(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)cccn1C1CC1	ZINC000872012961	GF	On-Demand	Anodyne	MTOR	17	42
COC(=O)c1cccc(-c2noc([C@@H]3CCC(=O)N3C(C)C)n2)c1	ZINC000872012962	EF	On-Demand	Anodyne	CPT1A	36	43
COC(=O)c1cccc(-c2noc([C@@H]3CCC(=O)N3C(C)C)n2)c1	ZINC000872012962	EF	On-Demand	Anodyne	GRM5	21	45
COC(=O)c1cccc(-c2noc([C@@H]3OCCO[C@@H]3C(F)(F)F)n2)c1	ZINC000872012983	FF	On-Demand	Anodyne	GRM5	19	42
COC(=O)c1cccc(-c2noc([C@@H]3OCCO[C@@H]3C(F)(F)F)n2)c1	ZINC000872012983	FF	On-Demand	Anodyne	ETHR	40	42
CC(C)(C)OC(=O)NC1(c2noc(-c3cnn(CC4CC4)c3)n2)CCC1	ZINC000872012990	FG	On-Demand	Anodyne	ALOX5AP	16	41
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3cccc(C(=O)OC)c3)no2)C1	ZINC000872013044	EF	On-Demand	Anodyne	CPT1A	35	41
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3cccc(C(=O)OC)c3)no2)C1	ZINC000872013044	EF	On-Demand	Anodyne	GRM5	20	46
COC(=O)c1cccc(-c2noc([C@H]3CCC(=O)O3)n2)c1	ZINC000872013065	CD	On-Demand	Anodyne	CPT1A	29	40
COC(=O)c1cccc(-c2noc([C@H]3CCC(=O)O3)n2)c1	ZINC000872013065	CD	On-Demand	Anodyne	GRM5	20	42
c1cc(CN2CCOCC2)cc(-c2noc(Cn3ncc4cccnc43)n2)c1	ZINC000872013066	GE	On-Demand	Anodyne	PIK3CA	22	41
c1cc(CN2CCOCC2)cc(-c2noc(Cn3ncc4cccnc43)n2)c1	ZINC000872013066	GE	On-Demand	Anodyne	MTOR	21	41
COC(=O)c1cccc(-c2noc([C@@H]3COC(=O)N3C)n2)c1	ZINC000872013109	DD	On-Demand	Anodyne	CPT1A	37	42
COC(=O)c1cccc(-c2noc([C@@H]3COC(=O)N3C)n2)c1	ZINC000872013109	DD	On-Demand	Anodyne	GRM5	22	45
COC(=O)c1cccc(-c2noc([C@H]3COC(=O)N3C)n2)c1	ZINC000872013110	DD	On-Demand	Anodyne	CPT1A	37	42
COC(=O)c1cccc(-c2noc([C@H]3COC(=O)N3C)n2)c1	ZINC000872013110	DD	On-Demand	Anodyne	GRM5	22	45
COC(=O)c1cccc(-c2noc([C@@H]3CNC(=O)C[C@H]3C(F)(F)F)n2)c1	ZINC000872013193	FE	On-Demand	Anodyne	GRM5	18	41
COC(=O)c1cccc(-c2noc([C@@H]3CNC(=O)C[C@@H]3C(F)(F)F)n2)c1	ZINC000872013194	FE	On-Demand	Anodyne	GRM5	18	41
COC(=O)c1cccc(-c2noc([C@H]3CNC(=O)C[C@@H]3C(F)(F)F)n2)c1	ZINC000872013195	FE	On-Demand	Anodyne	GRM5	18	41
COC(=O)c1cccc(-c2noc([C@H]3CNC(=O)C[C@H]3C(F)(F)F)n2)c1	ZINC000872013196	FE	On-Demand	Anodyne	GRM5	18	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	MMP13	38	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	ADAM17	26	49
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	PREP	29	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	MMP3	34	50
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	MMP9	21	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	TGM2	18	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	MMP7	45	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	MMP1	42	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	F13A1	24	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	GPR119	52	50
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	SFRP1	62	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013223	JF	On-Demand	Anodyne	WNT3	69	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	MMP13	38	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	ADAM17	26	49
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	PREP	29	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	MMP3	34	50
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	MMP9	21	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	TGM2	18	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	MMP7	45	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	MMP1	42	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	F13A1	24	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	GPR119	52	50
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	SFRP1	62	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000872013224	JF	On-Demand	Anodyne	WNT3	69	42
CC(C)(C)OC(=O)N1CCO[C@](C)(c2nc(COc3cccc(F)c3)no2)C1	ZINC000872013343	GG	On-Demand	Anodyne	GPR119	18	40
CC(C)(C)OC(=O)N1CCO[C@@](C)(c2nc(COc3cccc(F)c3)no2)C1	ZINC000872013344	GG	On-Demand	Anodyne	GPR119	18	40
Fc1cccc(OCc2noc([C@@H]3OCCO[C@@H]3C(F)(F)F)n2)c1	ZINC000872013440	EF	On-Demand	Anodyne	CHRNA10	26	40
CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000872013481	HI	On-Demand	Anodyne	CNR1	26	51
CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000872013481	HI	On-Demand	Anodyne	FABI	48	35
CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000872013481	HI	On-Demand	Anodyne	CNR2	28	51
CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000872013481	HI	On-Demand	Anodyne	TPSAB1	25	45
CC(C)(C)OC(=O)N1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000872013481	HI	On-Demand	Anodyne	F2RL3	17	41
CCn1cc(-c2nc(CNC(=O)OC(C)(C)C)no2)c(C2CC2)n1	ZINC000872013504	EF	On-Demand	Anodyne	PANC	49	32
O=C1CC[C@H](c2noc(Cc3ccc(OCc4ccncc4)cc3)n2)CN1	ZINC000872013611	FF	On-Demand	Anodyne	TPSAB1	54	35
O=C1CC[C@@H](c2noc(Cc3ccc(OCc4ccncc4)cc3)n2)CN1	ZINC000872013612	FF	On-Demand	Anodyne	TPSAB1	54	35
C[C@H]1CC(=O)N[C@@H](c2nc(COc3cccc(F)c3)no2)C1	ZINC000872013697	DE	On-Demand	Anodyne	CHRNA10	27	42
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2ccc(Cl)s2)CC1	ZINC000872013725	FG	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)N1CCN(C(=O)/C=C/c2ccc(Cl)s2)CC1	ZINC000872013726	FG	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)NCc1noc(Cc2ccc(O)c(Cl)c2)n1	ZINC000872013753	EG	On-Demand	Anodyne	TPSAB1	41	34
CC(C)(C)OC(=O)NCc1noc(Cc2ccc(O)c(Cl)c2)n1	ZINC000872013753	EG	On-Demand	Anodyne	NCE103	15	41
CCn1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000872013780	FG	On-Demand	Anodyne	CNR1	26	53
CCn1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000872013780	FG	On-Demand	Anodyne	CNR2	28	41
CCn1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000872013780	FG	On-Demand	Anodyne	TPSAB1	24	52
CC(C)(C)OC(=O)N1CCC[C@@H]1c1noc(-c2scnc2C(F)F)n1	ZINC000872013796	FI	On-Demand	Anodyne	CPT1A	33	42
CC(C)(C)OC(=O)N1CCC[C@H]1c1noc(-c2scnc2C(F)F)n1	ZINC000872013797	FI	On-Demand	Anodyne	CPT1A	33	42
O=C1CC[C@H](c2nc(COc3cccc(F)c3)no2)O1	ZINC000872013806	CE	On-Demand	Anodyne	CHRNA10	27	43
CC(C)(C)OC(=O)N1CCC[C@H]1c1noc(-c2c(Cl)n[nH]c2C2CC2)n1	ZINC000872013834	GI	On-Demand	Anodyne	CPT1A	32	41
CC(C)(C)OC(=O)N1CCC[C@@H]1c1noc(-c2c(Cl)n[nH]c2C2CC2)n1	ZINC000872013835	GI	On-Demand	Anodyne	CPT1A	32	41
C[C@@H](Cc1nc(-c2ccn(C)n2)no1)NC(=O)OC(C)(C)C	ZINC000872013920	DD	On-Demand	Anodyne	FPR1	40	34
COc1cccc(C2=NO[C@H](c3nc(-c4ccn(C)n4)no3)C2)c1	ZINC000872013922	EE	On-Demand	Anodyne	LUCI_PHOPY	25	44
COc1cccc(C2=NO[C@@H](c3nc(-c4ccn(C)n4)no3)C2)c1	ZINC000872013923	EE	On-Demand	Anodyne	LUCI_PHOPY	25	44
CN1C(=O)C[C@H](c2nc(-c3ccn(C)n3)no2)[C@H]1c1cccc(F)c1	ZINC000872013959	EE	On-Demand	Anodyne	HSD17B2	25	40
CCOC(=O)N1CCC(c2nc(-c3ccn(C)n3)no2)CC1	ZINC000872014002	DD	On-Demand	Anodyne	SMO	45	49
CCOC(=O)N1CCC(c2nc(-c3ccn(C)n3)no2)CC1	ZINC000872014002	DD	On-Demand	Anodyne	ETHR	72	43
Cn1c(-c2nc([C@@H]3CCCN3C(=O)OC(C)(C)C)no2)cc(=O)c2ccccc21	ZINC000872014040	GH	On-Demand	Anodyne	CPT1A	69	46
Cn1c(-c2nc([C@H]3CCCN3C(=O)OC(C)(C)C)no2)cc(=O)c2ccccc21	ZINC000872014041	GH	On-Demand	Anodyne	CPT1A	69	46
C[C@H]1CCn2cc(-c3nc(CNC(=O)OC(C)(C)C)no3)nc2C1	ZINC000872014045	EF	On-Demand	Anodyne	PANC	40	31
C[C@@H]1CCn2cc(-c3nc(CNC(=O)OC(C)(C)C)no3)nc2C1	ZINC000872014046	EF	On-Demand	Anodyne	PANC	40	31
CC(C)(C)OC(=O)NC(C)(C)c1noc(-c2cnn(CC3CC3)c2)n1	ZINC000872014052	EG	On-Demand	Anodyne	ALOX5AP	19	46
CC(C)(C)OC(=O)NC(C)(C)c1noc(-c2cnn(CC3CC3)c2)n1	ZINC000872014052	EG	On-Demand	Anodyne	PANC	44	31
CC(C)(C)OC(=O)N1CCN(C(=O)C2=Cc3cc(Br)ccc3OC2)CC1	ZINC000872014083	HG	On-Demand	Anodyne	GPR119	25	40
Cn1cc(-c2ccc(-c3nc([C@@H]4CCC(=O)NC4)no3)cc2)cn1	ZINC000872014091	DE	On-Demand	Anodyne	ALOX5AP	23	45
Cn1cc(-c2ccc(-c3nc([C@H]4CCC(=O)NC4)no3)cc2)cn1	ZINC000872014092	DE	On-Demand	Anodyne	ALOX5AP	23	45
CN(C)C(=O)C1CCC(c2nc(-c3ccn(C)n3)no2)CC1	ZINC000872014116	DD	On-Demand	Anodyne	ETHR	49	35
CC(C)(C)OC(=O)NC(C)(C)c1noc(Cc2cn3cc(F)ccc3n2)n1	ZINC000872014176	GG	On-Demand	Anodyne	MAP3K5	30	41
C#CCN1CCC(c2nc(-c3ccn(C)n3)no2)CC1	ZINC000872014199	CD	On-Demand	Mild	ETHR	48	34
CN(C)CC[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2ccn(C)n2)no1	ZINC000872014221	FD	On-Demand	Anodyne	UTS2	42	32
CN(C)CC[C@H](NC(=O)OC(C)(C)C)c1nc(-c2ccn(C)n2)no1	ZINC000872014225	FD	On-Demand	Anodyne	UTS2	42	32
CC(C)(C)OC(=O)NCc1noc(-c2cnn(CC3CC3)c2)n1	ZINC000872014269	DE	On-Demand	Anodyne	ALOX5AP	16	40
CC(C)(C)OC(=O)NCc1noc(-c2cnn(CC3CC3)c2)n1	ZINC000872014269	DE	On-Demand	Anodyne	PANC	50	33
COC(=O)CC[C@@H]1CC[C@H](c2nc(-c3ccn(C)n3)no2)O1	ZINC000872014277	DD	On-Demand	Anodyne	ETHR	46	31
C[C@@H]1[C@@H](c2nc(-c3ccn(C)n3)no2)CCCN1C(=O)OC(C)(C)C	ZINC000872014340	EF	On-Demand	Anodyne	CPT1A	38	41
C[C@H]1[C@H](c2nc(-c3ccn(C)n3)no2)CCCN1C(=O)OC(C)(C)C	ZINC000872014341	EF	On-Demand	Anodyne	CPT1A	38	41
C[C@H]1[C@@H](c2nc(-c3ccn(C)n3)no2)CCCN1C(=O)OC(C)(C)C	ZINC000872014342	EF	On-Demand	Anodyne	CPT1A	38	41
CCOC(=O)[C@@H]1CC[C@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014435	CD	On-Demand	Anodyne	ETHR	41	32
CC1CCN(c2ccc(NC(=O)CCc3nc(-c4ccn(C)n4)no3)cc2)CC1	ZINC000872014570	GG	On-Demand	Anodyne	HCAR2	30	40
CCOC(=O)N1CCC[C@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014602	DD	On-Demand	Anodyne	SMO	40	40
CCOC(=O)N1CCC[C@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014602	DD	On-Demand	Anodyne	ETHR	58	38
CCOC(=O)N1CCC[C@@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014603	DD	On-Demand	Anodyne	SMO	40	40
CCOC(=O)N1CCC[C@@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014603	DD	On-Demand	Anodyne	ETHR	58	38
CO[C@@H]1C[C@@H](c2nc(-c3ccn(C)n3)no2)N(C(=O)OCc2ccccc2)C1	ZINC000872014637	GF	On-Demand	Anodyne	CPT1A	43	39
CN1CC[C@H](c2nc(-c3ccn(C)n3)no2)CC1=O	ZINC000872014691	CC	On-Demand	Anodyne	GRM5	17	40
CN1CC[C@H](c2nc(-c3ccn(C)n3)no2)CC1=O	ZINC000872014691	CC	On-Demand	Anodyne	ETHR	48	34
CCOC(=O)C1=NN(c2ccccc2)[C@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014820	FE	On-Demand	Anodyne	CPT1A	40	43
CCOC(=O)C1=NN(c2ccccc2)[C@@H](c2nc(-c3ccn(C)n3)no2)C1	ZINC000872014821	FE	On-Demand	Anodyne	CPT1A	40	43
CSc1ccc(C)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872014913	FG	On-Demand	Anodyne	GPR119	44	51
CC[C@@H](NC(C)=O)c1nc([C@H]2CCC(=O)N(CC3CCC3)C2)no1	ZINC000872015074	EE	On-Demand	Anodyne	BMP1	40	38
CC[C@@H](NC(C)=O)c1nc([C@@H]2CCC(=O)N(CC3CCC3)C2)no1	ZINC000872015075	EE	On-Demand	Anodyne	BMP1	40	38
CC[C@@H](NC(C)=O)c1nc([C@@H]2CCC(=O)N(CC3CCCC3)C2)no1	ZINC000872015173	EF	On-Demand	Anodyne	BMP1	61	39
CC[C@@H](NC(C)=O)c1nc([C@H]2CCC(=O)N(CC3CCCC3)C2)no1	ZINC000872015174	EF	On-Demand	Anodyne	BMP1	61	39
Cn1cc(-c2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2)cn1	ZINC000872015177	GH	On-Demand	Anodyne	ALOX5AP	21	42
Cn1cc(-c2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2)cn1	ZINC000872015178	GH	On-Demand	Anodyne	ALOX5AP	21	42
CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000872015297	GE	On-Demand	Anodyne	HTR1D	15	40
CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000872015297	GE	On-Demand	Anodyne	HTR1B	18	40
CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000872015297	GE	On-Demand	Anodyne	GPR119	38	42
CCOc1ccc(-n2ncc(C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)c2C)nn1	ZINC000872015298	HE	On-Demand	Anodyne	GPR119	32	49
COC(=O)c1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000872015300	FE	On-Demand	Anodyne	GPR119	37	40
COc1ccc2c(C)c(CCc3nc(-c4ccn(C)n4)no3)c(=O)oc2c1	ZINC000872015336	FF	On-Demand	Anodyne	MAOB	32	46
CCSc1ccccc1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872015404	FG	On-Demand	Anodyne	GPR119	38	41
O=C(N1CCC[C@@H]1c1nc(C2CCC2)no1)C(F)(F)F	ZINC000872015497	CF	On-Demand	Anodyne	CPT1A	38	41
O=C(N1CCC[C@@H]1c1nc(C2CCC2)no1)C(F)(F)F	ZINC000872015497	CF	On-Demand	Anodyne	ETHR	33	48
O=C(N1CCC[C@H]1c1nc(C2CCC2)no1)C(F)(F)F	ZINC000872015498	CF	On-Demand	Anodyne	CPT1A	38	41
O=C(N1CCC[C@H]1c1nc(C2CCC2)no1)C(F)(F)F	ZINC000872015498	CF	On-Demand	Anodyne	ETHR	33	48
CC(C)(C)OC(=O)N1CCN(C(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)CC1	ZINC000872015509	JG	On-Demand	Anodyne	AKR1C3	61	42
CC(C)(C)OC(=O)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1	ZINC000872015589	EG	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC000872015601	FG	On-Demand	Anodyne	HRH3	18	42
CC(C)(C)OC(=O)N1CCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC000872015601	FG	On-Demand	Anodyne	PLA2G4B	50	32
CC(C)(C)OC(=O)N1CCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC000872015601	FG	On-Demand	Anodyne	GPR119	48	44
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	KLK3	75	36
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CTSB	61	40
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	PAPA1_CARPA	71	37
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CYSP_TRYCR	54	39
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CTSK	40	40
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CTSL	42	41
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CAPNS1	68	38
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CTSS	16	40
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CAPN1	80	41
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	CAPN2	131	41
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	TPSAB1	46	37
C[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccn(C)n2)no1	ZINC000872015643	EE	On-Demand	Anodyne	NPR	62	33
Brc1ccsc1-c1noc(-c2ccc(N3CCOCC3)nc2)n1	ZINC000872015866	GG	On-Demand	Anodyne	ADK	38	41
O=C(N1CCC[C@@H]1c1nc(-c2sccc2Br)no1)C(F)(F)F	ZINC000872015868	GH	On-Demand	Anodyne	CPT1A	44	41
O=C(N1CCC[C@@H]1c1nc(-c2sccc2Br)no1)C(F)(F)F	ZINC000872015868	GH	On-Demand	Anodyne	ETHR	59	40
O=C(N1CCC[C@H]1c1nc(-c2sccc2Br)no1)C(F)(F)F	ZINC000872015869	GH	On-Demand	Anodyne	CPT1A	44	41
O=C(N1CCC[C@H]1c1nc(-c2sccc2Br)no1)C(F)(F)F	ZINC000872015869	GH	On-Demand	Anodyne	ETHR	59	40
C#CCN1CCC(c2nc(-c3c(O)nc(=O)n(C)c3C)no2)CC1	ZINC000872015876	EC	On-Demand	Mild	ETHR	52	34
CN(C)C(=O)C1CCC(c2nc(-c3sccc3Br)no2)CC1	ZINC000872015909	GH	On-Demand	Anodyne	ETHR	52	39
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(-c2sccc2Br)no1	ZINC000872015923	GH	On-Demand	Anodyne	ETHR	49	37
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1	ZINC000872015938	DI	On-Demand	Bother	F2RL3	50	37
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1	ZINC000872015940	DI	On-Demand	Bother	F2RL3	50	37
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000872015990	EH	On-Demand	Bother	F2RL3	46	33
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)c1ccccc1	ZINC000872015991	EH	On-Demand	Bother	F2RL3	46	33
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000872015992	EH	On-Demand	Bother	F2RL3	46	33
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000872015993	EH	On-Demand	Bother	F2RL3	46	33
O=C(N1CCC[C@@H]1c1nc(-c2ccsc2C(F)(F)F)no1)C(F)(F)F	ZINC000872016008	GI	On-Demand	Anodyne	CPT1A	40	40
O=C(N1CCC[C@@H]1c1nc(-c2ccsc2C(F)(F)F)no1)C(F)(F)F	ZINC000872016008	GI	On-Demand	Anodyne	ETHR	63	40
O=C(N1CCC[C@H]1c1nc(-c2ccsc2C(F)(F)F)no1)C(F)(F)F	ZINC000872016011	GI	On-Demand	Anodyne	CPT1A	40	40
O=C(N1CCC[C@H]1c1nc(-c2ccsc2C(F)(F)F)no1)C(F)(F)F	ZINC000872016011	GI	On-Demand	Anodyne	ETHR	63	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCn1ccnc1	ZINC000872016023	DG	On-Demand	Bother	TBXAS1	31	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCn1ccnc1	ZINC000872016023	DG	On-Demand	Bother	HMOX2	44	31
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCn1ccnc1	ZINC000872016023	DG	On-Demand	Bother	QPCT	32	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCn1ccnc1	ZINC000872016025	DG	On-Demand	Bother	TBXAS1	31	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCn1ccnc1	ZINC000872016025	DG	On-Demand	Bother	HMOX2	44	31
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCn1ccnc1	ZINC000872016025	DG	On-Demand	Bother	QPCT	32	40
C[C@@H](NCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016026	CF	On-Demand	Bother	TBXAS1	38	42
C[C@@H](NCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016026	CF	On-Demand	Bother	HMOX2	45	33
C[C@@H](NCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016026	CF	On-Demand	Bother	QPCT	32	42
COc1ccc(N2CCN(C(=O)Cc3sc(C)nc3-c3ccc(C)cc3)CC2)cc1	ZINC000872016049	HI	On-Demand	Clean	CCKAR	28	44
COc1cc2c(cc1OC)[C@@H](NCCCN1CCOCC1)CCCC2	ZINC000872016053	EF	On-Demand	Anodyne	SLC18A2	46	36
c1ccc(CN2C[C@H]3CC[C@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016068	DF	On-Demand	Anodyne	CYP11B1	18	43
c1ccc(CN2C[C@H]3CC[C@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016068	DF	On-Demand	Anodyne	TBXAS1	29	43
c1ccc(CN2C[C@H]3CC[C@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016068	DF	On-Demand	Anodyne	HMOX2	44	32
c1ccc(CN2C[C@H]3CC[C@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016068	DF	On-Demand	Anodyne	QPCT	28	41
c1ccc(CN2C[C@H]3CC[C@@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016069	DF	On-Demand	Anodyne	CYP11B1	18	43
c1ccc(CN2C[C@H]3CC[C@@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016069	DF	On-Demand	Anodyne	TBXAS1	29	43
c1ccc(CN2C[C@H]3CC[C@@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016069	DF	On-Demand	Anodyne	HMOX2	44	32
c1ccc(CN2C[C@H]3CC[C@@H](NCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872016069	DF	On-Demand	Anodyne	QPCT	28	41
C[C@@H](NCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872016072	CE	On-Demand	Anodyne	TBXAS1	45	42
C[C@@H](NCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872016072	CE	On-Demand	Anodyne	HMOX2	48	34
C[C@@H](NCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872016072	CE	On-Demand	Anodyne	QPCT	41	41
C[C@@H](NCCc1ccccc1)c1cccc(O)c1F	ZINC000872016114	CG	On-Demand	Anodyne	CPA1	17	40
COc1cc2c(cc1OC)[C@@H](NCc1ccccn1)CCCC2	ZINC000872016129	DH	On-Demand	Anodyne	HCRTR1	17	49
FC(F)(F)c1sccc1-c1noc(C2CCN(c3cnccn3)CC2)n1	ZINC000872016132	GH	On-Demand	Anodyne	ETHR	65	41
c1ccc(CN2C[C@H]3CC[C@@H](NC[C@H]4CCCO4)[C@H]3C2)cc1	ZINC000872016159	DF	On-Demand	Anodyne	TNK2	45	37
c1ccc(CN2C[C@H]3CC[C@H](NC[C@@H]4CCCO4)[C@H]3C2)cc1	ZINC000872016162	DF	On-Demand	Anodyne	TNK2	45	37
c1ccc(CN2C[C@H]3CC[C@@H](NC[C@@H]4CCCO4)[C@H]3C2)cc1	ZINC000872016164	DF	On-Demand	Anodyne	TNK2	45	37
c1ccc(CN2C[C@H]3CC[C@H](NC[C@H]4CCCO4)[C@H]3C2)cc1	ZINC000872016165	DF	On-Demand	Anodyne	TNK2	45	37
O=C1C[C@@H](c2nc(-c3sccc3Br)no2)CN1C1CCCC1	ZINC000872016191	GH	On-Demand	Anodyne	GRM5	18	43
O=C1C[C@H](c2nc(-c3sccc3Br)no2)CN1C1CCCC1	ZINC000872016193	GH	On-Demand	Anodyne	GRM5	18	43
COc1ccc(N2CCN(C(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1	ZINC000872016198	GD	On-Demand	Clean	NPBWR1	47	33
CC[C@H](CCC(F)(F)F)NC[C@@H](O)c1ccccc1	ZINC000872016272	CG	On-Demand	Anodyne	ADRB3	17	41
CC[C@H](CCC(F)(F)F)NC[C@H](O)c1ccccc1	ZINC000872016273	CG	On-Demand	Anodyne	ADRB3	17	41
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)c1ccccc1	ZINC000872016274	CG	On-Demand	Anodyne	ADRB3	17	41
CC[C@@H](CCC(F)(F)F)NC[C@H](O)c1ccccc1	ZINC000872016275	CG	On-Demand	Anodyne	ADRB3	17	41
C[C@@H](NC[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016319	DG	On-Demand	Bother	COLA	99	33
C[C@H](NC[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016320	DG	On-Demand	Bother	COLA	99	33
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1	ZINC000872016335	HD	On-Demand	Clean	DRD4	46	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1	ZINC000872016335	HD	On-Demand	Clean	HTR7	16	42
COC(=O)CC[C@@H]1CC[C@H](c2nc(-c3sccc3Br)no2)O1	ZINC000872016376	GH	On-Demand	Anodyne	ETHR	48	34
C[C@@H](NCCCn1ccnc1)c1cccc(O)c1F	ZINC000872016487	CE	On-Demand	Anodyne	TBXAS1	46	46
C[C@@H](NCCCn1ccnc1)c1cccc(O)c1F	ZINC000872016487	CE	On-Demand	Anodyne	QPCT	42	42
Brc1cccc([C@@H](NCCCn2ccnc2)[C@H]2CCOC2)c1	ZINC000872016493	FG	On-Demand	Anodyne	HMOX2	18	42
Brc1cccc([C@@H](NCCCn2ccnc2)[C@@H]2CCOC2)c1	ZINC000872016494	FG	On-Demand	Anodyne	HMOX2	18	42
Brc1cccc([C@H](NCCCn2ccnc2)[C@H]2CCOC2)c1	ZINC000872016495	FG	On-Demand	Anodyne	HMOX2	18	42
Brc1cccc([C@H](NCCCn2ccnc2)[C@@H]2CCOC2)c1	ZINC000872016496	FG	On-Demand	Anodyne	HMOX2	18	42
C[C@@H](NC[C@@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016500	CF	On-Demand	Anodyne	ADRB2	25	45
C[C@@H](NC[C@@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016500	CF	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](NC[C@@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016500	CF	On-Demand	Anodyne	ADRB3	28	40
C[C@@H](NC[C@@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016500	CF	On-Demand	Anodyne	AOC3	15	43
C[C@H](NC[C@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016501	CF	On-Demand	Anodyne	ADRB2	25	45
C[C@H](NC[C@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016501	CF	On-Demand	Anodyne	ADRB1	17	40
C[C@H](NC[C@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016501	CF	On-Demand	Anodyne	ADRB3	28	40
C[C@H](NC[C@H](O)c1ccccc1)c1cccc(O)c1F	ZINC000872016501	CF	On-Demand	Anodyne	AOC3	15	43
CC[C@H](CCC(F)(F)F)NCc1ccc(OC)c(OC)c1	ZINC000872016517	DH	On-Demand	Anodyne	MT-ND1	19	41
CC[C@@H](CCC(F)(F)F)NCc1ccc(OC)c(OC)c1	ZINC000872016518	DH	On-Demand	Anodyne	MT-ND1	19	41
CC[C@H](CCC(F)(F)F)NCCCn1ccnc1	ZINC000872016562	CF	On-Demand	Anodyne	TBXAS1	21	44
CC[C@@H](CCC(F)(F)F)NCCCn1ccnc1	ZINC000872016563	CF	On-Demand	Anodyne	TBXAS1	21	44
CN1CC[C@H](c2nc(-c3sccc3Br)no2)CC1=O	ZINC000872016566	EF	On-Demand	Anodyne	ETHR	59	40
O=S1(=O)CCC(c2nc(-c3ccsc3C(F)(F)F)no2)CC1	ZINC000872016637	FG	On-Demand	Anodyne	ETHR	64	41
CC[C@@H](NCCCn1ccnc1)C(C)(C)CC	ZINC000872016682	BG	On-Demand	Anodyne	TBXAS1	27	46
C[C@@H](NCCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016684	BD	On-Demand	Bother	COLA	80	33
COc1cc2c(cc1OC)[C@@H](NCCCn1ccnc1)CCCC2	ZINC000872016690	EG	On-Demand	Anodyne	QPCT	52	45
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	CHRM2	19	40
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	DRD2	27	47
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	DRD4	65	44
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	ACHE	46	44
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	DRD3	18	43
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	SLC6A3	17	41
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	KCNH2	18	42
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	CHRM3	21	40
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	SIGMAR1	71	52
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	SSTR5	59	39
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	CCR1	28	40
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	CCR3	26	43
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016692	EH	On-Demand	Anodyne	MCHR1	42	43
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	CHRM2	19	40
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	DRD2	27	47
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	DRD4	65	44
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	ACHE	46	44
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	DRD3	18	43
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	SLC6A3	17	41
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	KCNH2	18	42
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	CHRM3	21	40
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	SIGMAR1	71	52
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	SSTR5	59	39
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	CCR1	28	40
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	CCR3	26	43
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872016693	EH	On-Demand	Anodyne	MCHR1	42	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCN1CCOCC1	ZINC000872016694	EF	On-Demand	Bother	KCNJ1	24	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCN1CCOCC1	ZINC000872016695	EF	On-Demand	Bother	KCNJ1	24	40
C[C@@H](NCC(C)(C)CN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016702	CF	On-Demand	Bother	COLA	53	32
C[C@H](NCC(C)(C)CN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016703	CF	On-Demand	Bother	COLA	53	32
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)O)CCCC2	ZINC000872016705	CE	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)O)CCCC2	ZINC000872016706	CE	On-Demand	Anodyne	SLC18A2	50	37
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	DRD2	19	43
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	DRD4	48	44
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	ACHE	48	47
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	SIGMAR1	73	46
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	SSTR5	51	37
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	MCHR1	20	40
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000872016708	EI	On-Demand	Anodyne	CACNA1G	29	42
COc1cc2c(cc1OC)[C@@H](NCCCO)CCCC2	ZINC000872016754	CE	On-Demand	Anodyne	SLC18A2	50	38
CCC[C@H](CC1CCCC1)c1nc(CCS(C)(=O)=O)no1	ZINC000872016824	DG	On-Demand	Anodyne	BMP1	59	44
CCC[C@@H](CC1CCCC1)c1nc(CCS(C)(=O)=O)no1	ZINC000872016825	DG	On-Demand	Anodyne	BMP1	59	44
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	DRD2	24	44
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	DRD4	53	45
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	ACHE	44	46
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	SLC6A3	16	44
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	SIGMAR1	74	52
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	SSTR5	43	35
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	CCR3	26	42
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	MCHR1	29	42
C[C@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016908	EH	On-Demand	Anodyne	CACNA1G	31	41
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	DRD2	24	44
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	DRD4	53	45
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	ACHE	44	46
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	SLC6A3	16	44
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	SIGMAR1	74	52
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	SSTR5	43	35
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	CCR3	26	42
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	MCHR1	29	42
C[C@@H](NC1CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872016909	EH	On-Demand	Anodyne	CACNA1G	31	41
COc1cc2c(cc1OC)[C@@H](NCc1cccnc1)CCCC2	ZINC000872016918	DH	On-Demand	Anodyne	HCRTR1	18	51
C[C@H](NCC(C)(C)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016920	CF	On-Demand	Bother	COLA	105	35
C[C@@H](NCC(C)(C)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872016921	CF	On-Demand	Bother	COLA	105	35
COCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872016950	CF	On-Demand	Anodyne	SLC18A2	46	34
COCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872016951	CF	On-Demand	Anodyne	SLC18A2	46	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)[C@@H]1CCCOC1	ZINC000872016960	EG	On-Demand	Anodyne	MME	40	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)[C@@H]1CCCOC1	ZINC000872016960	EG	On-Demand	Anodyne	TIMP3	65	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(CC)CC)[C@@H]1CCCOC1	ZINC000872016961	EG	On-Demand	Anodyne	MME	40	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(CC)CC)[C@@H]1CCCOC1	ZINC000872016961	EG	On-Demand	Anodyne	TIMP3	65	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(CC)CC)[C@H]1CCCOC1	ZINC000872016962	EG	On-Demand	Anodyne	MME	40	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(CC)CC)[C@H]1CCCOC1	ZINC000872016962	EG	On-Demand	Anodyne	TIMP3	65	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)[C@H]1CCCOC1	ZINC000872016963	EG	On-Demand	Anodyne	MME	40	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)[C@H]1CCCOC1	ZINC000872016963	EG	On-Demand	Anodyne	TIMP3	65	35
FC(F)(F)c1sccc1-c1noc(C2CCSCC2)n1	ZINC000872017022	DI	On-Demand	Anodyne	ETHR	59	41
CCC[C@@H](CC1CCCCC1)c1nc(CCS(C)(=O)=O)no1	ZINC000872017023	EH	On-Demand	Anodyne	BMP1	75	45
CCC[C@H](CC1CCCCC1)c1nc(CCS(C)(=O)=O)no1	ZINC000872017024	EH	On-Demand	Anodyne	BMP1	75	45
COc1cc2c(cc1OC)[C@@H](NCCc1ccccn1)CCCC2	ZINC000872017050	EH	On-Demand	Anodyne	HCRTR1	15	44
c1ccc(CN2C[C@H]3CC[C@H](NCc4cccnc4)[C@H]3C2)cc1	ZINC000872017112	DG	On-Demand	Anodyne	CHRNA7	33	46
c1ccc(CN2C[C@H]3CC[C@@H](NCc4cccnc4)[C@H]3C2)cc1	ZINC000872017113	DG	On-Demand	Anodyne	CHRNA7	33	46
C[C@@H](NCCCN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017158	CE	On-Demand	Bother	COLA	70	32
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	HTR1A	18	46
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	DRD4	49	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	HTR7	33	48
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	BMP1	15	40
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	TRY2_BOVIN	69	37
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872017243	ID	On-Demand	Clean	AKR1C3	20	48
COCCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872017286	CG	On-Demand	Anodyne	SLC18A2	46	36
COCCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872017287	CG	On-Demand	Anodyne	SLC18A2	46	36
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872017327	CI	On-Demand	Bother	COLA	64	32
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872017328	CI	On-Demand	Bother	COLA	64	32
c1ccc2c(c1)CCCC[C@@H](NCCCn1ccnc1)C2	ZINC000872017336	CG	On-Demand	Anodyne	TBXAS1	30	40
c1ccc2c(c1)CCCC[C@@H](NCCCn1ccnc1)C2	ZINC000872017336	CG	On-Demand	Anodyne	QPCT	41	42
c1ccc2c(c1)CCCC[C@H](NCCCn1ccnc1)C2	ZINC000872017337	CG	On-Demand	Anodyne	TBXAS1	30	40
c1ccc2c(c1)CCCC[C@H](NCCCn1ccnc1)C2	ZINC000872017337	CG	On-Demand	Anodyne	QPCT	41	42
C[C@@H](NCCc1ccccn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017348	CG	On-Demand	Bother	COLA	77	34
COc1cc2c(cc1OC)[C@@H](NCCn1ccnc1)CCCC2	ZINC000872017370	DF	On-Demand	Anodyne	QPCT	28	42
CC[C@@H](NCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872017378	CF	On-Demand	Anodyne	ADRA1D	20	41
CC[C@@H](NCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872017378	CF	On-Demand	Anodyne	ADRA1A	16	41
CC[C@@H](NCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872017378	CF	On-Demand	Anodyne	ADRA1B	19	41
CC[C@@H](NCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872017379	CF	On-Demand	Anodyne	ADRA1D	20	41
CC[C@@H](NCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872017379	CF	On-Demand	Anodyne	ADRA1A	16	41
CC[C@@H](NCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872017379	CF	On-Demand	Anodyne	ADRA1B	19	41
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1cccnc1	ZINC000872017433	DH	On-Demand	Anodyne	CHRNA7	19	42
C[C@@H](NC1CCN(C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017434	DG	On-Demand	Bother	ADRA1D	19	43
C[C@H](NC1CCN(C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017439	DG	On-Demand	Bother	ADRA1D	19	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCNC(=O)C(C)C	ZINC000872017442	EF	On-Demand	Bother	COLA	21	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCNC(=O)C(C)C	ZINC000872017444	EF	On-Demand	Bother	COLA	21	41
CC(=O)NCCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017476	CD	On-Demand	Bother	COLA	91	33
CC(=O)NCCCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017477	CD	On-Demand	Bother	COLA	91	33
C[C@@H](NCCCN1CCCCC1)c1cccc(O)c1F	ZINC000872017494	CG	On-Demand	Anodyne	HNMT	79	37
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCN1CCN(C)CC1	ZINC000872017512	FF	On-Demand	Bother	KCNJ1	28	42
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCN1CCN(C)CC1	ZINC000872017513	FF	On-Demand	Bother	KCNJ1	28	42
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	DRD4	51	45
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	P2RY12	189	46
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	TRY2_BOVIN	55	36
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	CTSL	32	46
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	CCKBR	23	40
COc1ccc(N2CCN(C(=O)[C@@H](CCSC)NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000872017536	IG	On-Demand	Clean	CTSS	22	47
C[C@@H](NC[C@@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017573	EH	On-Demand	Bother	COLA	44	35
C[C@H](NC[C@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017574	EH	On-Demand	Bother	COLA	44	35
COc1cc2c(cc1OC)[C@@H](NCCO)CCCC2	ZINC000872017612	CE	On-Demand	Anodyne	SLC18A2	47	34
C[C@@H](NC[C@@H](c1ccco1)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017615	DG	On-Demand	Bother	COLA	58	33
C[C@H](NC[C@H](c1ccco1)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017616	DG	On-Demand	Bother	COLA	58	33
C[C@@H](NC[C@@H](O)c1ccccc1)c1cc(O)ccc1F	ZINC000872017621	CF	On-Demand	Anodyne	ADRB2	24	50
C[C@H](NC[C@H](O)c1ccccc1)c1cc(O)ccc1F	ZINC000872017624	CF	On-Demand	Anodyne	ADRB2	24	50
CC[C@@H](NCC(=O)Nc1ccc(F)c(F)c1)[C@@H]1CCCOC1	ZINC000872017656	DF	On-Demand	Anodyne	NPY2R	24	40
CC[C@@H](NCC(=O)Nc1ccc(F)c(F)c1)[C@H]1CCCOC1	ZINC000872017660	DF	On-Demand	Anodyne	NPY2R	24	40
CC[C@@H](NC1CCN(C(C)=O)CC1)C(C)(C)CC	ZINC000872017663	CF	On-Demand	Anodyne	EPHX2	15	45
COc1cc2c(cc1OC)[C@@H](NCCCNC(C)=O)CCCC2	ZINC000872017672	DF	On-Demand	Anodyne	NQO2	25	59
COc1cc2c(cc1OC)[C@@H](NCCCNC(C)=O)CCCC2	ZINC000872017672	DF	On-Demand	Anodyne	MTNR1A	34	44
COc1cc2c(cc1OC)[C@@H](NCCCNC(C)=O)CCCC2	ZINC000872017672	DF	On-Demand	Anodyne	MTNR1B	44	44
COc1cc2c(cc1OC)[C@@H](NC1CCN(C3CC3)CC1)CCCC2	ZINC000872017688	EH	On-Demand	Anodyne	SLC18A2	47	33
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)c1cc(O)ccc1F	ZINC000872017692	DH	On-Demand	Anodyne	ADRB2	18	47
C[C@@H](NC[C@@H](O)c1ccc(Cl)cc1)c1cc(O)ccc1F	ZINC000872017693	DH	On-Demand	Anodyne	ADRB2	18	47
CC(=O)NCCCN[C@H](C)c1cc(O)ccc1F	ZINC000872017710	CD	On-Demand	Anodyne	GRIA1	46	34
CC(=O)NCCCN[C@@H](C)c1cc(O)ccc1F	ZINC000872017711	CD	On-Demand	Anodyne	GRIA1	46	34
CC[C@@H](CCC(F)(F)F)NCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872017763	DG	On-Demand	Anodyne	ERG2	18	45
CC[C@@H](CCC(F)(F)F)NCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872017763	DG	On-Demand	Anodyne	Q2TU57_MAIZE	19	45
COc1ccc(OC)c([C@H](C)N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872017768	EI	On-Demand	Bother	TAAR1	19	40
COc1ccc(OC)c([C@H](C)N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872017769	EI	On-Demand	Bother	TAAR1	19	40
O=C1CCCN1CCCN[C@@H]1CCCCc2ccccc2C1	ZINC000872017785	DF	On-Demand	Anodyne	TYRO3	21	58
O=C1CCCN1CCCN[C@H]1CCCCc2ccccc2C1	ZINC000872017786	DF	On-Demand	Anodyne	TYRO3	21	58
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C(N)=O)cc1)CCCC2	ZINC000872017812	FG	On-Demand	Anodyne	HCRTR1	15	42
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C(N)=O)cc1)CCCC2	ZINC000872017812	FG	On-Demand	Anodyne	MTNR1B	16	40
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccco1	ZINC000872017890	CF	On-Demand	Anodyne	KISS1R	46	39
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccco1	ZINC000872017891	CF	On-Demand	Anodyne	KISS1R	46	39
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)c1ccco1)CCCC2	ZINC000872017929	FG	On-Demand	Anodyne	ADRA1B	17	40
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)c1ccco1)CCCC2	ZINC000872017929	FG	On-Demand	Anodyne	NQO2	18	41
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)c1ccco1)CCCC2	ZINC000872017929	FG	On-Demand	Anodyne	MTNR1B	20	42
COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(C)=O)cc1)CCCC2	ZINC000872017931	FI	On-Demand	Anodyne	TSHR	48	32
COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(C)=O)cc1)CCCC2	ZINC000872017931	FI	On-Demand	Anodyne	MTNR1B	22	41
Cc1cc(CN[C@H](C)c2cccc(O)c2F)ccc1F	ZINC000872017939	CH	On-Demand	Anodyne	LEF	42	37
Cc1cc(CN[C@@H](C)c2cccc(O)c2F)ccc1F	ZINC000872017940	CH	On-Demand	Anodyne	LEF	42	37
C[C@@H](NCCNC(=O)c1ccco1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017950	DE	On-Demand	Bother	COLA	46	32
C[C@@H](NCCNC(=O)c1ccco1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872017950	DE	On-Demand	Bother	KISS1R	43	34
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc(O)c1F	ZINC000872017966	EG	On-Demand	Anodyne	DRD4	25	48
c1ccc(CN2C[C@H]3CC[C@@H](NCCn4ccnc4)[C@H]3C2)cc1	ZINC000872017997	DE	On-Demand	Anodyne	CYP11B1	22	45
c1ccc(CN2C[C@H]3CC[C@@H](NCCn4ccnc4)[C@H]3C2)cc1	ZINC000872017997	DE	On-Demand	Anodyne	TBXAS1	19	45
c1ccc(CN2C[C@H]3CC[C@H](NCCn4ccnc4)[C@H]3C2)cc1	ZINC000872017998	DE	On-Demand	Anodyne	CYP11B1	22	45
c1ccc(CN2C[C@H]3CC[C@H](NCCn4ccnc4)[C@H]3C2)cc1	ZINC000872017998	DE	On-Demand	Anodyne	TBXAS1	19	45
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C1CC1)CCCC2	ZINC000872017999	EF	On-Demand	Anodyne	SLC18A2	41	33
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C1CC1)CCCC2	ZINC000872017999	EF	On-Demand	Anodyne	NQO2	20	47
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C1CC1)CCCC2	ZINC000872017999	EF	On-Demand	Anodyne	MTNR1A	30	42
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C1CC1)CCCC2	ZINC000872017999	EF	On-Demand	Anodyne	MTNR1B	39	42
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCC1=O)CCCC2	ZINC000872018013	EG	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCC1=O)CCCC2	ZINC000872018013	EG	On-Demand	Anodyne	TYRO3	18	45
COc1cc2c(cc1OC)[C@@H](NCCOCCO)CCCC2	ZINC000872018047	DE	On-Demand	Anodyne	SLC18A2	45	32
Cc1nn(-c2ccccc2)c(C)c1CN[C@H](C)c1cc(O)ccc1F	ZINC000872018053	EI	On-Demand	Anodyne	P2RX7	17	49
Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C)c1cc(O)ccc1F	ZINC000872018054	EI	On-Demand	Anodyne	P2RX7	17	49
CC[C@@H](CCC(F)(F)F)NC1CCN(C(C)=O)CC1	ZINC000872018104	CF	On-Demand	Anodyne	EPHX2	19	40
CC(=O)Nc1cccc([C@@H](C)N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872018147	EI	On-Demand	Bother	TAAR1	24	42
CC(=O)Nc1cccc([C@H](C)N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872018148	EI	On-Demand	Bother	TAAR1	24	42
CC(=O)Nc1cccc([C@H](C)N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872018149	EI	On-Demand	Bother	TAAR1	24	42
CC(=O)Nc1cccc([C@@H](C)N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872018150	EI	On-Demand	Bother	TAAR1	24	42
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(C)=O)CC1)CCCC2	ZINC000872018158	EG	On-Demand	Anodyne	MTNR1B	17	40
CC(=O)NCCCN[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872018163	DE	On-Demand	Anodyne	LEF	42	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCCC1	ZINC000872018223	DG	On-Demand	Bother	KCNJ1	27	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCCC1	ZINC000872018224	DG	On-Demand	Bother	KCNJ1	27	41
C[C@@H](NCCn1ccnc1)c1cc(O)ccc1F	ZINC000872018232	BE	On-Demand	Anodyne	TBXAS1	44	38
C[C@@H](NCCn1ccnc1)c1cc(O)ccc1F	ZINC000872018232	BE	On-Demand	Anodyne	HMOX2	44	31
CC(=O)NCCCN[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872018264	DE	On-Demand	Anodyne	LEF	42	32
COc1cc2c(cc1OC)[C@@H](NC1CCN(C)CC1)CCCC2	ZINC000872018325	DG	On-Demand	Anodyne	SLC18A2	46	33
C[C@@H](NCCOc1ccccc1)c1cccc(O)c1F	ZINC000872018398	CG	On-Demand	Anodyne	HTR7	15	44
CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872018412	GE	On-Demand	Anodyne	NAMPT	34	41
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872018413	GE	On-Demand	Anodyne	NAMPT	34	41
CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872018414	GE	On-Demand	Anodyne	NAMPT	34	41
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872018415	GE	On-Demand	Anodyne	NAMPT	34	41
C[C@@H](NCC1(N(C)C)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872018521	DG	On-Demand	Bother	COLA	43	32
C[C@@H](NCCCN1CCCCC1)c1cc(O)ccc1F	ZINC000872018554	CG	On-Demand	Anodyne	HNMT	87	39
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018586	EE	On-Demand	Anodyne	DRD4	33	40
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018586	EE	On-Demand	Anodyne	ACHE	25	41
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018586	EE	On-Demand	Anodyne	SIGMAR1	36	52
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018586	EE	On-Demand	Anodyne	CACNA1G	34	43
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018587	EE	On-Demand	Anodyne	DRD4	33	40
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018587	EE	On-Demand	Anodyne	ACHE	25	41
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018587	EE	On-Demand	Anodyne	SIGMAR1	36	52
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872018587	EE	On-Demand	Anodyne	CACNA1G	34	43
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C(C)C)CCCC2	ZINC000872018592	EF	On-Demand	Anodyne	SLC18A2	51	36
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C(C)C)CCCC2	ZINC000872018592	EF	On-Demand	Anodyne	NQO2	19	46
COc1cc2c(cc1OC)[C@@H](NCCNC(=O)C(C)C)CCCC2	ZINC000872018592	EF	On-Demand	Anodyne	MTNR1B	22	40
C[C@@H](NCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872018624	BD	On-Demand	Bother	COLA	97	34
COCc1ccccc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872018682	EI	On-Demand	Bother	CACNA1D	46	32
COCc1ccccc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872018682	EI	On-Demand	Bother	F2RL3	46	38
COCc1ccccc1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872018683	EI	On-Demand	Bother	CACNA1D	46	32
COCc1ccccc1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872018683	EI	On-Demand	Bother	F2RL3	46	38
O=C1CCCN1CCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872018780	EE	On-Demand	Anodyne	ACHE	23	53
O=C1CCCN1CCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872018780	EE	On-Demand	Anodyne	TYRO3	17	40
O=C1CCCN1CCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872018781	EE	On-Demand	Anodyne	ACHE	23	53
O=C1CCCN1CCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872018781	EE	On-Demand	Anodyne	TYRO3	17	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCOCCO	ZINC000872018804	DD	On-Demand	Bother	F2RL3	43	31
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCOCCO	ZINC000872018805	DD	On-Demand	Bother	F2RL3	43	31
C[C@@H](NCCNC(=O)C1CC1)c1cccc(O)c1F	ZINC000872018846	CD	On-Demand	Anodyne	MTNR1A	22	42
C[C@@H](NCCNC(=O)C1CC1)c1cccc(O)c1F	ZINC000872018846	CD	On-Demand	Anodyne	MTNR1B	19	42
NC(=O)c1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872018856	EF	On-Demand	Anodyne	SIGMAR1	26	40
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@H]1CCCOC1	ZINC000872018965	GG	On-Demand	Anodyne	NAMPT	40	39
CC[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@H]1CCCOC1	ZINC000872018966	GG	On-Demand	Anodyne	NAMPT	40	39
CC[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872018967	GG	On-Demand	Anodyne	NAMPT	40	39
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872018968	GG	On-Demand	Anodyne	NAMPT	40	39
O=C(NCCN[C@H]1CCCCc2ccccc2C1)C1CC1	ZINC000872018971	CE	On-Demand	Anodyne	MTNR1A	24	44
O=C(NCCN[C@H]1CCCCc2ccccc2C1)C1CC1	ZINC000872018971	CE	On-Demand	Anodyne	MTNR1B	23	44
O=C(NCCN[C@@H]1CCCCc2ccccc2C1)C1CC1	ZINC000872018972	CE	On-Demand	Anodyne	MTNR1A	24	44
O=C(NCCN[C@@H]1CCCCc2ccccc2C1)C1CC1	ZINC000872018972	CE	On-Demand	Anodyne	MTNR1B	23	44
CC[C@@H](CCC(F)(F)F)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872018985	GF	On-Demand	Anodyne	NAMPT	30	43
CC[C@H](CCC(F)(F)F)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872018986	GF	On-Demand	Anodyne	NAMPT	30	43
C[C@@H](NCCn1ccnc1)c1cccc(O)c1F	ZINC000872018988	BE	On-Demand	Anodyne	TBXAS1	40	40
CC[C@@H](NCCn1ccnc1)C(C)(C)CC	ZINC000872019011	BF	On-Demand	Anodyne	TBXAS1	20	41
Cc1ccccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019023	CH	On-Demand	Bother	COLA	110	36
Cc1ccccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019024	CH	On-Demand	Bother	COLA	110	36
C[C@@H](NCCc1cccs1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019048	CH	On-Demand	Bother	COLA	66	37
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)c1cccc(O)c1F	ZINC000872019076	DH	On-Demand	Anodyne	ADRB2	15	40
C[C@@H](NC[C@@H](O)c1ccc(Cl)cc1)c1cccc(O)c1F	ZINC000872019077	DH	On-Demand	Anodyne	ADRB2	15	40
CC(=O)NCCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872019081	DE	On-Demand	Anodyne	ACHE	19	41
CC(=O)NCCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872019082	DE	On-Demand	Anodyne	ACHE	19	41
COCc1ccccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019144	DH	On-Demand	Bother	COLA	111	35
COCc1ccccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019145	DH	On-Demand	Bother	COLA	111	35
C[C@@H](NCCNC(=O)c1ccco1)c1cccc(O)c1F	ZINC000872019153	CE	On-Demand	Anodyne	KISS1R	62	37
O[C@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000872019194	EG	On-Demand	Anodyne	SLC6A3	20	42
O[C@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000872019194	EG	On-Demand	Anodyne	SIGMAR1	23	40
O[C@@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000872019195	EG	On-Demand	Anodyne	SLC6A3	20	42
O[C@@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000872019195	EG	On-Demand	Anodyne	SIGMAR1	23	40
CC[C@@H](NCCN1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872019240	EF	On-Demand	Anodyne	SIGMAR1	48	39
CC[C@@H](NCCN1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872019241	EF	On-Demand	Anodyne	SIGMAR1	48	39
O=S(=O)(c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1)N1CCCCC1	ZINC000872019244	GG	On-Demand	Anodyne	NAMPT	43	42
O=S(=O)(c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCCCC1	ZINC000872019245	GG	On-Demand	Anodyne	NAMPT	43	42
c1ccc(CN2C[C@H]3CC[C@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019254	DF	On-Demand	Anodyne	ACHE	21	41
c1ccc(CN2C[C@H]3CC[C@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019254	DF	On-Demand	Anodyne	HRH3	21	44
c1ccc(CN2C[C@H]3CC[C@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019254	DF	On-Demand	Anodyne	SIGMAR1	57	40
c1ccc(CN2C[C@H]3CC[C@@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019255	DF	On-Demand	Anodyne	ACHE	21	41
c1ccc(CN2C[C@H]3CC[C@@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019255	DF	On-Demand	Anodyne	HRH3	21	44
c1ccc(CN2C[C@H]3CC[C@@H](NCCN4CCCC4)[C@H]3C2)cc1	ZINC000872019255	DF	On-Demand	Anodyne	SIGMAR1	57	40
COc1cc2c(cc1OC)[C@@H](NCC(=O)NC(C)C)CCCC2	ZINC000872019289	DF	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NCC(=O)NC(C)C)CCCC2	ZINC000872019289	DF	On-Demand	Anodyne	MTNR1B	17	42
C[C@@H](NCCNC(=O)c1ccco1)c1cc(O)ccc1F	ZINC000872019341	CE	On-Demand	Anodyne	KISS1R	44	35
CC[C@H](CCC(F)(F)F)NCCOc1ccccc1OC	ZINC000872019380	DH	On-Demand	Anodyne	ADRA1D	16	44
CC[C@H](CCC(F)(F)F)NCCOc1ccccc1OC	ZINC000872019380	DH	On-Demand	Anodyne	ADRA1B	16	44
CC[C@@H](CCC(F)(F)F)NCCOc1ccccc1OC	ZINC000872019381	DH	On-Demand	Anodyne	ADRA1D	16	44
CC[C@@H](CCC(F)(F)F)NCCOc1ccccc1OC	ZINC000872019381	DH	On-Demand	Anodyne	ADRA1B	16	44
CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872019382	EF	On-Demand	Anodyne	DRD4	40	42
CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872019382	EF	On-Demand	Anodyne	ACHE	25	43
CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872019382	EF	On-Demand	Anodyne	SIGMAR1	44	42
CC[C@@H](NCc1cccc(C(F)(F)F)c1)[C@H]1CCCOC1	ZINC000872019397	DI	On-Demand	Anodyne	CCR2	19	40
CC[C@H](NCc1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000872019398	DI	On-Demand	Anodyne	CCR2	19	40
CC[C@@H](NCc1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000872019399	DI	On-Demand	Anodyne	CCR2	19	40
CC[C@H](NCc1cccc(C(F)(F)F)c1)[C@H]1CCCOC1	ZINC000872019400	DI	On-Demand	Anodyne	CCR2	19	40
c1ccc2c(c1)CCCC[C@H](NCCn1ccnc1)C2	ZINC000872019401	CF	On-Demand	Anodyne	TBXAS1	20	41
c1ccc2c(c1)CCCC[C@H](NCCn1ccnc1)C2	ZINC000872019401	CF	On-Demand	Anodyne	HMOX1	42	32
c1ccc2c(c1)CCCC[C@@H](NCCn1ccnc1)C2	ZINC000872019402	CF	On-Demand	Anodyne	TBXAS1	20	41
c1ccc2c(c1)CCCC[C@@H](NCCn1ccnc1)C2	ZINC000872019402	CF	On-Demand	Anodyne	HMOX1	42	32
C[C@@H](NCCN1CCCC1)c1cc(O)ccc1F	ZINC000872019432	CE	On-Demand	Anodyne	ESR1	43	35
C[C@@H](NCCN1CCCC1)c1cc(O)ccc1F	ZINC000872019432	CE	On-Demand	Anodyne	HNMT	47	32
CCN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019446	EH	On-Demand	Anodyne	SLC18A2	46	33
CCN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019447	EH	On-Demand	Anodyne	SLC18A2	46	33
C[C@@H](NCCNC(=O)C1CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019499	CD	On-Demand	Bother	COLA	70	33
CCNC(=O)CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872019553	DD	On-Demand	Anodyne	ACHE	21	40
CCNC(=O)CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872019553	DD	On-Demand	Anodyne	SIGMAR1	30	41
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	HTR1A	22	51
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	DRD2	17	46
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	HTR7	15	41
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	SIGMAR1	18	46
COc1cc2c(cc1OC)[C@@H](NCCCN1CCN(C)CC1)CCCC2	ZINC000872019605	FF	On-Demand	Anodyne	EHMT2	44	33
C[C@@H](NCCCN1CCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019611	DG	On-Demand	Bother	HNMT	56	34
C[C@@H](N[C@@H](CN(C)C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019646	EH	On-Demand	Bother	COLA	77	32
C[C@@H](N[C@H](CN(C)C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019647	EH	On-Demand	Bother	COLA	77	32
CCOc1ccc([C@@H](C)N[C@H](C)c2cccc(O)c2F)cc1	ZINC000872019713	DI	On-Demand	Anodyne	ACACB	16	43
CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872019714	DI	On-Demand	Anodyne	ACACB	16	43
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccco1	ZINC000872019759	FF	On-Demand	Anodyne	ACHE	19	43
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccco1	ZINC000872019759	FF	On-Demand	Anodyne	SIGMAR1	26	43
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccco1	ZINC000872019760	FF	On-Demand	Anodyne	ACHE	19	43
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccco1	ZINC000872019760	FF	On-Demand	Anodyne	SIGMAR1	26	43
CC[C@H](NCc1ccccc1Cn1ccnc1)[C@@H]1CCCOC1	ZINC000872019780	DG	On-Demand	Anodyne	CYP11B1	36	42
CC[C@H](NCc1ccccc1Cn1ccnc1)[C@@H]1CCCOC1	ZINC000872019780	DG	On-Demand	Anodyne	CYP11B2	21	42
CC[C@H](NCc1ccccc1Cn1ccnc1)[C@H]1CCCOC1	ZINC000872019781	DG	On-Demand	Anodyne	CYP11B1	36	42
CC[C@H](NCc1ccccc1Cn1ccnc1)[C@H]1CCCOC1	ZINC000872019781	DG	On-Demand	Anodyne	CYP11B2	21	42
CC[C@@H](NCc1ccccc1Cn1ccnc1)[C@H]1CCCOC1	ZINC000872019782	DG	On-Demand	Anodyne	CYP11B1	36	42
CC[C@@H](NCc1ccccc1Cn1ccnc1)[C@H]1CCCOC1	ZINC000872019782	DG	On-Demand	Anodyne	CYP11B2	21	42
CC[C@@H](NCc1ccccc1Cn1ccnc1)[C@@H]1CCCOC1	ZINC000872019783	DG	On-Demand	Anodyne	CYP11B1	36	42
CC[C@@H](NCc1ccccc1Cn1ccnc1)[C@@H]1CCCOC1	ZINC000872019783	DG	On-Demand	Anodyne	CYP11B2	21	42
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)C2CC2)CC1	ZINC000872019859	DG	On-Demand	Anodyne	EPHX2	22	41
CC[C@H](NCc1cccnc1N1CCOCC1)C(C)(C)CC	ZINC000872019862	DG	On-Demand	Anodyne	SCN10A	15	41
CC[C@@H](NCc1cccnc1N1CCOCC1)C(C)(C)CC	ZINC000872019863	DG	On-Demand	Anodyne	SCN10A	15	41
CNC(=O)CN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019878	GE	On-Demand	Anodyne	SLC18A2	47	33
CNC(=O)CN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019878	GE	On-Demand	Anodyne	MTNR1B	15	41
CNC(=O)CN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019879	GE	On-Demand	Anodyne	SLC18A2	47	33
CNC(=O)CN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872019879	GE	On-Demand	Anodyne	MTNR1B	15	41
C[C@@H](NC[C@@H](O)c1ccco1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019963	CF	On-Demand	Bother	COLA	62	33
C[C@H](NC[C@H](O)c1ccco1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872019964	CF	On-Demand	Bother	COLA	62	33
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019967	DF	On-Demand	Anodyne	ADRB2	57	62
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019967	DF	On-Demand	Anodyne	ADRB1	64	49
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019967	DF	On-Demand	Anodyne	ADRB3	37	46
C[C@H](NC[C@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019970	DF	On-Demand	Anodyne	ADRB2	57	62
C[C@H](NC[C@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019970	DF	On-Demand	Anodyne	ADRB1	64	49
C[C@H](NC[C@H](O)COc1ccccc1)c1cccc(O)c1F	ZINC000872019970	DF	On-Demand	Anodyne	ADRB3	37	46
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	DRD4	46	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	HTR2A	16	47
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	F10	25	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	HTR7	32	59
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	BMP1	37	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP13	68	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	TRY2_BOVIN	47	35
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	CCKAR	15	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	CCR1	30	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	ADAM17	21	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP2	39	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP3	50	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP8	36	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP14	18	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP9	57	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP12	27	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP7	40	38
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000872019982	JF	On-Demand	Clean	MMP1	57	45
CC[C@@H](CCC(F)(F)F)NCCCN1CCN(c2ncccn2)CC1	ZINC000872020016	FF	On-Demand	Anodyne	HTR1A	17	43
CCOC(=O)N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872020022	DF	On-Demand	Anodyne	GPR119	29	42
CCOC(=O)N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872020023	DF	On-Demand	Anodyne	GPR119	29	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA2	118	51
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA6	27	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA1	104	51
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA7	75	47
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA13	42	47
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA5B	57	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA4	81	51
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA5A	59	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA14	51	47
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA12	72	47
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA9	84	49
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CAH_METTE	23	40
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CYNT	38	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	NCE103	21	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	CA15	15	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	MTCA1	21	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	P96878_MYCTU	30	44
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cccc(O)c1F	ZINC000872020039	EE	On-Demand	Anodyne	A6YCJ1_9METZ	25	44
c1ccc(N2CCN(CCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020056	EF	On-Demand	Anodyne	HTR1A	30	44
c1ccc(N2CCN(CCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020056	EF	On-Demand	Anodyne	DRD2	20	41
c1ccc(N2CCN(CCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020056	EF	On-Demand	Anodyne	HTR2A	17	41
c1ccc(N2CCN(CCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020056	EF	On-Demand	Anodyne	DRD3	22	41
c1ccc(N2CCN(CCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020056	EF	On-Demand	Anodyne	HTR7	25	40
c1ccc(N2CCN(CCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020057	EF	On-Demand	Anodyne	HTR1A	30	44
c1ccc(N2CCN(CCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020057	EF	On-Demand	Anodyne	DRD2	20	41
c1ccc(N2CCN(CCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020057	EF	On-Demand	Anodyne	HTR2A	17	41
c1ccc(N2CCN(CCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020057	EF	On-Demand	Anodyne	DRD3	22	41
c1ccc(N2CCN(CCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872020057	EF	On-Demand	Anodyne	HTR7	25	40
CC[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)[C@@H]1CCCOC1	ZINC000872020067	DF	On-Demand	Anodyne	L3MBTL3	43	32
CC[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1CCCOC1	ZINC000872020068	DF	On-Demand	Anodyne	L3MBTL3	43	32
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(=O)C3CC3)CC1)CCCC2	ZINC000872020070	FG	On-Demand	Anodyne	MTNR1B	17	45
C[C@@H](NCCN1CCCCC1)c1cc(O)ccc1F	ZINC000872020087	CF	On-Demand	Anodyne	ESR1	55	37
C[C@@H](NCCN1CCCCC1)c1cc(O)ccc1F	ZINC000872020087	CF	On-Demand	Anodyne	HNMT	59	34
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA2	109	50
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA6	25	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA1	94	50
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA7	66	45
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA13	31	45
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA5B	50	41
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA4	77	49
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA5A	52	41
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA14	50	45
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA12	64	45
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA9	78	49
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CAH_METTE	23	41
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CYNT	31	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	NCE103	19	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	CA15	19	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	MTCA1	17	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	P96878_MYCTU	26	42
C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1cc(O)ccc1F	ZINC000872020117	EE	On-Demand	Anodyne	A6YCJ1_9METZ	26	42
C[C@H](NC[C@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020132	DF	On-Demand	Anodyne	ADRB2	52	58
C[C@H](NC[C@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020132	DF	On-Demand	Anodyne	ADRB1	64	49
C[C@H](NC[C@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020132	DF	On-Demand	Anodyne	ADRB3	42	49
C[C@H](NC[C@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020132	DF	On-Demand	Anodyne	PDS	44	34
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020134	DF	On-Demand	Anodyne	ADRB2	52	58
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020134	DF	On-Demand	Anodyne	ADRB1	64	49
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020134	DF	On-Demand	Anodyne	ADRB3	42	49
C[C@@H](NC[C@@H](O)COc1ccccc1)c1cc(O)ccc1F	ZINC000872020134	DF	On-Demand	Anodyne	PDS	44	34
C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872020135	FG	On-Demand	Anodyne	DRD4	20	48
C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872020136	FG	On-Demand	Anodyne	DRD4	20	48
COc1ccc([C@@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872020188	DF	On-Demand	Anodyne	ADRB2	27	44
COc1ccc([C@@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872020188	DF	On-Demand	Anodyne	ADRB3	25	42
COc1ccc([C@@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872020190	DF	On-Demand	Anodyne	ADRB2	27	44
COc1ccc([C@@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872020190	DF	On-Demand	Anodyne	ADRB3	25	42
CCOC(=O)N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872020213	DF	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872020213	DF	On-Demand	Anodyne	GPR119	20	41
CCOC(=O)N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872020214	DF	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872020214	DF	On-Demand	Anodyne	GPR119	20	41
C[C@@H](NCC1CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020221	BF	On-Demand	Bother	PRKCQ	22	41
O=C(c1ccco1)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020223	GG	On-Demand	Anodyne	DRD4	24	40
O=C(c1ccco1)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020223	GG	On-Demand	Anodyne	SIGMAR1	26	41
O=C(c1ccco1)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020224	GG	On-Demand	Anodyne	DRD4	24	40
O=C(c1ccco1)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020224	GG	On-Demand	Anodyne	SIGMAR1	26	41
CN(C)C(=O)c1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872020229	GG	On-Demand	Anodyne	ACHE	18	40
CN(C)C(=O)c1cccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872020230	GG	On-Demand	Anodyne	ACHE	18	40
C[C@@H](NC[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020231	EF	On-Demand	Bother	ADRB2	39	53
C[C@@H](NC[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020231	EF	On-Demand	Bother	ADRB1	47	44
C[C@@H](NC[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020231	EF	On-Demand	Bother	ADRB3	27	44
C[C@@H](NC[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020231	EF	On-Demand	Bother	COLA	55	33
C[C@H](NC[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020234	EF	On-Demand	Bother	ADRB2	39	53
C[C@H](NC[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020234	EF	On-Demand	Bother	ADRB1	47	44
C[C@H](NC[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020234	EF	On-Demand	Bother	ADRB3	27	44
C[C@H](NC[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020234	EF	On-Demand	Bother	COLA	55	33
COc1cc2c(cc1OC)[C@@H](NCc1ccc(-n3ccnc3)nc1)CCCC2	ZINC000872020245	GH	On-Demand	Anodyne	NOS2	29	42
O=C(C1CC1)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020282	FF	On-Demand	Anodyne	DRD4	33	44
O=C(C1CC1)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020282	FF	On-Demand	Anodyne	SIGMAR1	36	44
O=C(C1CC1)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020283	FF	On-Demand	Anodyne	DRD4	33	44
O=C(C1CC1)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020283	FF	On-Demand	Anodyne	SIGMAR1	36	44
CNC(=O)CN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872020296	EE	On-Demand	Anodyne	DRD4	30	42
CNC(=O)CN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872020296	EE	On-Demand	Anodyne	BIRC2	42	36
CNC(=O)CN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872020297	EE	On-Demand	Anodyne	DRD4	30	42
CNC(=O)CN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872020297	EE	On-Demand	Anodyne	BIRC2	42	36
CC[C@@H](CCC(F)(F)F)NCc1ccccc1Cn1cncn1	ZINC000872020316	EH	On-Demand	Anodyne	HIS3	40	34
CC[C@H](CCC(F)(F)F)NCc1ccccc1Cn1cncn1	ZINC000872020317	EH	On-Demand	Anodyne	HIS3	40	34
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CCN(C3CC3)C1)CCCC2	ZINC000872020336	EH	On-Demand	Anodyne	SLC18A2	50	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CCN(C3CC3)C1)CCCC2	ZINC000872020339	EH	On-Demand	Anodyne	SLC18A2	50	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)N1CCOCC1)CCCC2	ZINC000872020376	EF	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)N1CCOCC1)CCCC2	ZINC000872020379	EF	On-Demand	Anodyne	SLC18A2	49	35
C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020389	FG	On-Demand	Anodyne	DRD4	22	48
C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020389	FG	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020389	FG	On-Demand	Anodyne	NPY5R	17	40
C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020390	FG	On-Demand	Anodyne	DRD4	22	48
C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020390	FG	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872020390	FG	On-Demand	Anodyne	NPY5R	17	40
CC[C@H](NCc1cccc(C(=O)N(C)C)c1)C(C)(C)CC	ZINC000872020407	CH	On-Demand	Anodyne	PDS	50	33
CC[C@@H](NCc1cccc(C(=O)N(C)C)c1)C(C)(C)CC	ZINC000872020408	CH	On-Demand	Anodyne	PDS	50	33
C[C@H](NC[C@H](O)c1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872020417	CG	On-Demand	Anodyne	ADRB2	15	47
C[C@@H](NC[C@@H](O)c1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872020418	CG	On-Demand	Anodyne	ADRB2	15	47
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA2	92	52
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA6	21	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA1	80	52
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA7	60	52
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA13	24	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA5B	30	40
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA4	59	50
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA5A	31	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA14	43	52
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA12	57	47
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA9	68	48
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CAH_METTE	24	42
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CYNT	45	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	NCE103	19	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	CA15	15	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	P96878_MYCTU	21	43
CC[C@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020559	EF	On-Demand	Anodyne	A6YCJ1_9METZ	25	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA2	92	52
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA6	21	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA1	80	52
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA7	60	52
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA13	24	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA5B	30	40
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA4	59	50
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA5A	31	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA14	43	52
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA12	57	47
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA9	68	48
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CAH_METTE	24	42
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CYNT	45	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	NCE103	19	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	CA15	15	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	P96878_MYCTU	21	43
CC[C@@H](CCC(F)(F)F)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000872020561	EF	On-Demand	Anodyne	A6YCJ1_9METZ	25	43
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)[C@H]1CCCOC1	ZINC000872020563	GF	On-Demand	Anodyne	TGM2	40	36
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)[C@@H]1CCCOC1	ZINC000872020569	GF	On-Demand	Anodyne	TGM2	40	36
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000872020597	EH	On-Demand	Anodyne	ETHR	46	34
O=C(Nc1cccc(CN[C@H]2CCOC3(CCCC3)C2)c1)C1CCC1	ZINC000872020624	EI	On-Demand	Anodyne	NMT1	21	41
O=C(Nc1cccc(CN[C@@H]2CCOC3(CCCC3)C2)c1)C1CCC1	ZINC000872020625	EI	On-Demand	Anodyne	NMT1	21	41
O[C@H](CN[C@H]1CCCCc2ccccc2C1)c1ccco1	ZINC000872020630	CG	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CN[C@@H]1CCCCc2ccccc2C1)c1ccco1	ZINC000872020631	CG	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CN[C@H]1CCCCc2ccccc2C1)c1ccco1	ZINC000872020632	CG	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CN[C@@H]1CCCCc2ccccc2C1)c1ccco1	ZINC000872020633	CG	On-Demand	Anodyne	ADRB3	18	40
C[C@H](N[C@H](C)c1ccc2c(c1)OCO2)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020704	EH	On-Demand	Bother	KCNQ2	20	41
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000872020705	EH	On-Demand	Bother	KCNQ2	20	41
COc1cc2c(cc1OC)[C@@H](NCCC(=O)NC(C)C)CCCC2	ZINC000872020706	EF	On-Demand	Anodyne	SLC18A2	47	34
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000872020707	EH	On-Demand	Bother	KCNQ2	20	41
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	HTR1A	41	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	DRD2	33	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	DRD4	38	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	HTR2A	35	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	DRD3	32	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	HRP1_PLAFA	45	32
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	HTR7	54	41
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872020739	FE	On-Demand	Anodyne	P2RX3	17	40
CC[C@@H](CC1CCCCC1)NC1CCN(C(=O)C2CC2)CC1	ZINC000872020759	DH	On-Demand	Anodyne	EPHX2	15	43
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(=O)c3ccco3)CC1)CCCC2	ZINC000872020779	GH	On-Demand	Anodyne	ADRA1B	18	44
CNC(=O)CN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020795	FD	On-Demand	Anodyne	DRD4	55	44
CNC(=O)CN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020795	FD	On-Demand	Anodyne	SIGMAR1	37	47
CNC(=O)CN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020795	FD	On-Demand	Anodyne	MCHR1	16	44
CNC(=O)CN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020798	FD	On-Demand	Anodyne	DRD4	55	44
CNC(=O)CN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020798	FD	On-Demand	Anodyne	SIGMAR1	37	47
CNC(=O)CN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872020798	FD	On-Demand	Anodyne	MCHR1	16	44
COc1cc2c(cc1OC)[C@@H](NCc1cccc(C(=O)N(C)C)c1)CCCC2	ZINC000872020848	GH	On-Demand	Anodyne	HCRTR1	17	41
COc1cc2c(cc1OC)[C@@H](NCc1cccc(C(=O)N(C)C)c1)CCCC2	ZINC000872020848	GH	On-Demand	Anodyne	MTNR1B	23	40
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA2	54	46
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA1	52	46
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA7	33	44
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA5B	34	44
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA4	34	44
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA5A	34	44
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA12	38	46
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	CA9	46	46
NS(=O)(=O)c1ccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020862	GE	On-Demand	Anodyne	NCE103	18	42
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA2	54	46
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA1	52	46
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA7	33	44
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA5B	34	44
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA4	34	44
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA5A	34	44
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA12	38	46
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	CA9	46	46
NS(=O)(=O)c1ccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872020863	GE	On-Demand	Anodyne	NCE103	18	42
C[C@@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020960	DF	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020960	DF	On-Demand	Anodyne	SFRP1	58	32
C[C@@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020960	DF	On-Demand	Anodyne	WNT3	60	32
C[C@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020961	DF	On-Demand	Anodyne	EPHX2	16	40
C[C@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020961	DF	On-Demand	Anodyne	SFRP1	58	32
C[C@H](NC1CCN(C(=O)C2CC2)CC1)c1cc(O)ccc1F	ZINC000872020961	DF	On-Demand	Anodyne	WNT3	60	32
COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(N)=O)cc1)CCCC2	ZINC000872020989	FH	On-Demand	Anodyne	HCRTR1	15	41
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021035	DG	On-Demand	Anodyne	ADRB2	49	58
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021035	DG	On-Demand	Anodyne	ADRB1	51	46
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021035	DG	On-Demand	Anodyne	ADRB3	29	46
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021035	DG	On-Demand	Anodyne	PDS	60	36
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021036	DG	On-Demand	Anodyne	ADRB2	49	58
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021036	DG	On-Demand	Anodyne	ADRB1	51	46
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021036	DG	On-Demand	Anodyne	ADRB3	29	46
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021036	DG	On-Demand	Anodyne	PDS	60	36
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021037	DG	On-Demand	Anodyne	ADRB2	49	58
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021037	DG	On-Demand	Anodyne	ADRB1	51	46
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021037	DG	On-Demand	Anodyne	ADRB3	29	46
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccccc1	ZINC000872021037	DG	On-Demand	Anodyne	PDS	60	36
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021038	DG	On-Demand	Anodyne	ADRB2	49	58
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021038	DG	On-Demand	Anodyne	ADRB1	51	46
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021038	DG	On-Demand	Anodyne	ADRB3	29	46
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccccc1	ZINC000872021038	DG	On-Demand	Anodyne	PDS	60	36
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA2	47	43
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA1	47	43
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA5B	29	40
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA5A	28	40
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA12	38	40
NS(=O)(=O)c1ccc(CCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021045	ED	On-Demand	Anodyne	CA9	42	43
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA2	47	43
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA1	47	43
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA5B	29	40
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA5A	28	40
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA12	38	40
NS(=O)(=O)c1ccc(CCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872021046	ED	On-Demand	Anodyne	CA9	42	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021060	GI	On-Demand	Bother	CYP19A1	27	54
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021060	GI	On-Demand	Bother	CYP11B1	36	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021060	GI	On-Demand	Bother	CYP11B2	21	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021061	GI	On-Demand	Bother	CYP19A1	27	54
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021061	GI	On-Demand	Bother	CYP11B1	36	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1Cn1ccnc1	ZINC000872021061	GI	On-Demand	Bother	CYP11B2	21	40
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(=O)C(C)C)CC1)CCCC2	ZINC000872021112	FH	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(=O)C(C)C)CC1)CCCC2	ZINC000872021112	FH	On-Demand	Anodyne	MTNR1B	15	43
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	DRD2	18	47
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	DRD4	21	46
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	HTR2A	16	46
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	OPRM1	19	46
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	SIGMAR1	53	50
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	CACNA1G	20	40
C[C@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021135	EH	On-Demand	Anodyne	BIRC2	33	42
CC[C@@H](CCC(F)(F)F)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872021136	FH	On-Demand	Anodyne	DRD4	21	45
CC[C@@H](CCC(F)(F)F)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872021136	FH	On-Demand	Anodyne	CCR8	44	33
CC[C@@H](CCC(F)(F)F)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872021136	FH	On-Demand	Anodyne	SFRP1	60	36
CC[C@@H](CCC(F)(F)F)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872021136	FH	On-Demand	Anodyne	WNT3	41	34
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	DRD2	18	47
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	DRD4	21	46
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	HTR2A	16	46
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	OPRM1	19	46
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	SIGMAR1	53	50
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	CACNA1G	20	40
C[C@@H](NC1CCN(CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872021137	EH	On-Demand	Anodyne	BIRC2	33	42
C[C@@H](NC1CCN(C(=O)C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021166	EF	On-Demand	Bother	SFRP1	41	33
C[C@H](NC1CCN(C(=O)C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021167	EF	On-Demand	Bother	SFRP1	41	33
CC[C@@H](NC1CCN(CCc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021189	EG	On-Demand	Anodyne	SIGMAR1	36	46
CC[C@@H](NC1CCN(CCc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021189	EG	On-Demand	Anodyne	BIRC2	19	41
CC[C@@H](NC1CCN(CCc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021190	EG	On-Demand	Anodyne	SIGMAR1	36	46
CC[C@@H](NC1CCN(CCc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021190	EG	On-Demand	Anodyne	BIRC2	19	41
COc1cc2c(cc1OC)[C@@H](NCCc1cccnc1)CCCC2	ZINC000872021192	EH	On-Demand	Anodyne	PTAFR	16	40
COc1cc2c(cc1OC)[C@@H](NCCc1cccnc1)CCCC2	ZINC000872021192	EH	On-Demand	Anodyne	HCRTR1	16	45
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021220	GE	On-Demand	Bother	HTR1A	35	44
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021220	GE	On-Demand	Bother	DRD2	25	43
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021220	GE	On-Demand	Bother	DRD4	20	43
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021220	GE	On-Demand	Bother	HTR2A	32	43
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021220	GE	On-Demand	Bother	DRD3	22	43
C[C@@H](NCCc1cccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872021228	CG	On-Demand	Bother	NR1D1	23	40
c1ccc(Cn2ccnc2)c(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872021238	EH	On-Demand	Anodyne	CYP11B1	36	41
c1ccc(Cn2ccnc2)c(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872021238	EH	On-Demand	Anodyne	CYP11B2	21	41
c1ccc(Cn2ccnc2)c(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872021238	EH	On-Demand	Anodyne	HMOX1	40	37
c1ccc(Cn2ccnc2)c(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872021239	EH	On-Demand	Anodyne	CYP11B1	36	41
c1ccc(Cn2ccnc2)c(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872021239	EH	On-Demand	Anodyne	CYP11B2	21	41
c1ccc(Cn2ccnc2)c(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872021239	EH	On-Demand	Anodyne	HMOX1	40	37
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCN(C(C)=O)CC1	ZINC000872021319	FE	On-Demand	Bother	KCNJ1	28	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCN(C(C)=O)CC1	ZINC000872021320	FE	On-Demand	Bother	KCNJ1	28	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CN1CCOCC1	ZINC000872021368	EF	On-Demand	Bother	KCNJ1	19	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CN1CCOCC1	ZINC000872021369	EF	On-Demand	Bother	KCNJ1	19	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CN1CCOCC1	ZINC000872021370	EF	On-Demand	Bother	KCNJ1	19	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CN1CCOCC1	ZINC000872021371	EF	On-Demand	Bother	KCNJ1	19	43
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA2	106	54
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA6	23	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA1	93	54
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA7	68	54
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA13	34	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA5B	34	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA4	64	49
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA5A	38	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA14	52	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA12	70	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA9	82	54
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CAH_METTE	25	44
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CYNT	49	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	NCE103	22	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	CA15	16	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	MTCA1	31	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	P96878_MYCTU	41	48
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)C(C)(C)CC	ZINC000872021394	DF	On-Demand	Anodyne	A6YCJ1_9METZ	27	48
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021458	EF	On-Demand	Anodyne	HTR1A	49	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021458	EF	On-Demand	Anodyne	DRD2	25	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021458	EF	On-Demand	Anodyne	HTR2A	36	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021458	EF	On-Demand	Anodyne	DRD3	30	42
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872021458	EF	On-Demand	Anodyne	HTR7	65	40
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021459	EF	On-Demand	Anodyne	HTR1A	49	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021459	EF	On-Demand	Anodyne	DRD2	25	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021459	EF	On-Demand	Anodyne	HTR2A	36	43
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021459	EF	On-Demand	Anodyne	DRD3	30	42
CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872021459	EF	On-Demand	Anodyne	HTR7	65	40
NC(=O)Nc1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021466	FG	On-Demand	Anodyne	DRD4	16	41
NC(=O)Nc1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021466	FG	On-Demand	Anodyne	SIGMAR1	22	42
NC(=O)Nc1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021466	FG	On-Demand	Anodyne	NOD2	40	34
NC(=O)Nc1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021478	FG	On-Demand	Anodyne	DRD4	16	41
NC(=O)Nc1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021478	FG	On-Demand	Anodyne	SIGMAR1	22	42
NC(=O)Nc1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872021478	FG	On-Demand	Anodyne	NOD2	40	34
COc1ccc([C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872021538	DF	On-Demand	Anodyne	ADRB2	26	49
COc1ccc([C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872021538	DF	On-Demand	Anodyne	ADRB3	20	42
COc1ccc([C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872021539	DF	On-Demand	Anodyne	ADRB2	26	49
COc1ccc([C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872021539	DF	On-Demand	Anodyne	ADRB3	20	42
CC[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@H]1CCCOC1	ZINC000872021584	EH	On-Demand	Anodyne	EPHX2	39	40
CC[C@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@@H]1CCCOC1	ZINC000872021585	EH	On-Demand	Anodyne	EPHX2	39	40
CC[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@@H]1CCCOC1	ZINC000872021586	EH	On-Demand	Anodyne	EPHX2	39	40
CC[C@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@H]1CCCOC1	ZINC000872021587	EH	On-Demand	Anodyne	EPHX2	39	40
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	HTR1A	31	49
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	DRD2	30	45
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	DRD4	15	45
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	HTR7	18	42
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	SIGMAR1	19	45
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	EBP	36	40
COc1cc2c(cc1OC)[C@@H](NCCCCN1CCN(C)CC1)CCCC2	ZINC000872021660	GG	On-Demand	Anodyne	EHMT2	43	33
c1ccc(C2(CN[C@H]3CCOC4(CCCC4)C3)CCOCC2)cc1	ZINC000872021674	EH	On-Demand	Anodyne	ICMT	77	39
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA2	54	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA1	54	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA7	41	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA4	28	41
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA12	40	39
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872021676	ED	On-Demand	Anodyne	CA9	49	41
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA2	54	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA1	54	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA7	41	45
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA4	28	41
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA12	40	39
CC[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872021677	ED	On-Demand	Anodyne	CA9	49	41
CC[C@@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021682	EI	On-Demand	Anodyne	CYP19A1	27	46
CC[C@@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021682	EI	On-Demand	Anodyne	CYP11B1	54	48
CC[C@@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021682	EI	On-Demand	Anodyne	TBXAS1	15	46
CC[C@@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021682	EI	On-Demand	Anodyne	CYP11B2	27	48
CC[C@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021683	EI	On-Demand	Anodyne	CYP19A1	27	46
CC[C@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021683	EI	On-Demand	Anodyne	CYP11B1	54	48
CC[C@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021683	EI	On-Demand	Anodyne	TBXAS1	15	46
CC[C@H](CCC(F)(F)F)NCc1ccccc1Cn1ccnc1	ZINC000872021683	EI	On-Demand	Anodyne	CYP11B2	27	48
O=C(c1ccco1)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872021705	FH	On-Demand	Anodyne	L3MBTL3	42	38
O=C(c1ccco1)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872021706	FH	On-Demand	Anodyne	L3MBTL3	42	38
c1ccc(CN2C[C@H]3CC[C@H](NCCc4cccnc4)[C@H]3C2)cc1	ZINC000872021813	DG	On-Demand	Anodyne	CHRNA7	35	44
c1ccc(CN2C[C@H]3CC[C@@H](NCCc4cccnc4)[C@H]3C2)cc1	ZINC000872021814	DG	On-Demand	Anodyne	CHRNA7	35	44
CC[C@@H](CC1CCCCC1)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000872021832	EI	On-Demand	Anodyne	L3MBTL3	50	35
CC[C@@H](CCC(F)(F)F)NCc1cccnc1N1CCOCC1	ZINC000872021839	EG	On-Demand	Anodyne	SCN10A	15	41
CC[C@H](CCC(F)(F)F)NCc1cccnc1N1CCOCC1	ZINC000872021840	EG	On-Demand	Anodyne	SCN10A	15	41
c1ccc(C2(CN[C@@H]3CCOC4(CCCC4)C3)CCOCC2)cc1	ZINC000872021849	EH	On-Demand	Anodyne	ICMT	77	39
CC[C@@H](NC1CCN(C(=O)C(C)C)CC1)C(C)(C)CC	ZINC000872021858	CG	On-Demand	Anodyne	EPHX2	15	47
c1cnc(N2CCOCC2)c(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872021883	EE	On-Demand	Anodyne	SCN10A	15	40
c1cnc(N2CCOCC2)c(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872021886	EE	On-Demand	Anodyne	SCN10A	15	40
C[C@@H](NCC1(c2ccccc2)CCOCC1)c1cc(O)ccc1F	ZINC000872021909	EH	On-Demand	Anodyne	ICMT	79	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCCN1CCN(C)CC1	ZINC000872021932	FF	On-Demand	Bother	KCNJ1	28	41
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCCN1CCN(C)CC1	ZINC000872021933	FF	On-Demand	Bother	KCNJ1	28	41
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872022005	EF	On-Demand	Anodyne	HTR1A	32	40
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872022005	EF	On-Demand	Anodyne	DRD2	22	44
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872022005	EF	On-Demand	Anodyne	DRD3	25	40
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872022008	EF	On-Demand	Anodyne	HTR1A	32	40
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872022008	EF	On-Demand	Anodyne	DRD2	22	44
CC[C@@H](NCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872022008	EF	On-Demand	Anodyne	DRD3	25	40
O=C(CN1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1)Nc1ccccc1	ZINC000872022059	FG	On-Demand	Anodyne	DRD4	15	43
O=C(CN1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1)Nc1ccccc1	ZINC000872022060	FG	On-Demand	Anodyne	DRD4	15	43
O=C(c1ccoc1)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872022079	GG	On-Demand	Anodyne	DRD4	20	41
O=C(c1ccoc1)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872022080	GG	On-Demand	Anodyne	DRD4	20	41
COc1ncccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022089	DF	On-Demand	Bother	COLA	60	36
COc1ncccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022090	DF	On-Demand	Bother	COLA	60	36
O=C(c1ccoc1)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872022127	FH	On-Demand	Anodyne	L3MBTL3	52	33
O=C(c1ccoc1)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872022128	FH	On-Demand	Anodyne	L3MBTL3	52	33
COc1cc2c(cc1OC)[C@@H](NCc1cccnc1-n1ccnc1)CCCC2	ZINC000872022141	GH	On-Demand	Anodyne	NOS2	30	40
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)C(C)C)CC1	ZINC000872022144	DG	On-Demand	Anodyne	EPHX2	19	44
C[C@H](N[C@H](C)Cn1ccnc1)c1cc(O)ccc1F	ZINC000872022156	CE	On-Demand	Anodyne	HMOX1	15	40
C[C@@H](Cn1ccnc1)N[C@@H](C)c1cc(O)ccc1F	ZINC000872022157	CE	On-Demand	Anodyne	HMOX1	15	40
C[C@@H](Cn1ccnc1)N[C@H](C)c1cc(O)ccc1F	ZINC000872022158	CE	On-Demand	Anodyne	HMOX1	15	40
COCCOc1ncccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022214	EG	On-Demand	Bother	COLA	71	36
COCCOc1ncccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022215	EG	On-Demand	Bother	COLA	71	36
CCN(CC)C(=O)CCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022222	EG	On-Demand	Bother	COLA	93	33
CCN(CC)C(=O)CCCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022223	EG	On-Demand	Bother	COLA	93	33
COc1cc2c(cc1OC)[C@@H](NCc1cccc(C(N)=O)c1)CCCC2	ZINC000872022271	FG	On-Demand	Anodyne	HCRTR1	20	42
COc1cc2c(cc1OC)[C@@H](NCc1cccc(C(N)=O)c1)CCCC2	ZINC000872022271	FG	On-Demand	Anodyne	MTNR1B	18	42
NC(=O)c1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872022272	EF	On-Demand	Anodyne	DRD4	21	40
NC(=O)c1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872022272	EF	On-Demand	Anodyne	KCNH2	36	42
NC(=O)c1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872022272	EF	On-Demand	Anodyne	SSTR3	16	41
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	HTR1A	40	46
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	DRD2	31	46
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	DRD4	28	46
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	ADRA1D	15	41
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	HTR2A	34	46
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	HTR2C	15	43
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	ADRA1A	17	41
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	DRD3	26	46
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	HTR7	49	38
C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872022378	FE	On-Demand	Anodyne	P2RX3	17	40
c1ccc(CN2C[C@H]3CC[C@H](NCc4cccnc4N4CCOCC4)[C@H]3C2)cc1	ZINC000872022433	GF	On-Demand	Anodyne	PIK3CA	17	40
c1ccc(CN2C[C@H]3CC[C@H](NCc4cccnc4N4CCOCC4)[C@H]3C2)cc1	ZINC000872022433	GF	On-Demand	Anodyne	MTOR	20	40
c1ccc(CN2C[C@H]3CC[C@@H](NCc4cccnc4N4CCOCC4)[C@H]3C2)cc1	ZINC000872022434	GF	On-Demand	Anodyne	PIK3CA	17	40
c1ccc(CN2C[C@H]3CC[C@@H](NCc4cccnc4N4CCOCC4)[C@H]3C2)cc1	ZINC000872022434	GF	On-Demand	Anodyne	MTOR	20	40
CC[C@H](NC(=O)c1ccc(-n2cccn2)nc1)c1ccc(OC)cc1	ZINC000872022436	EG	On-Demand	Anodyne	TACR3	46	40
CC[C@H](NC(=O)c1ccc(-n2cccn2)nc1)c1ccc(OC)cc1	ZINC000872022436	EG	On-Demand	Anodyne	AMP1_PLAFQ	57	39
CC[C@H](NC(=O)c1ccc(-n2cccn2)nc1)c1ccc(OC)cc1	ZINC000872022436	EG	On-Demand	Anodyne	UTS2	49	41
C[C@@H](Cn1ccnc1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872022467	DF	On-Demand	Anodyne	CYP11B1	21	42
C[C@@H](Cn1ccnc1)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872022468	DF	On-Demand	Anodyne	CYP11B1	21	42
c1ccc(C2(CN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872022545	CH	On-Demand	Anodyne	ICMT	72	39
O=C(CCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CC1	ZINC000872022546	EF	On-Demand	Anodyne	DRD4	23	42
O=C(CCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CC1	ZINC000872022546	EF	On-Demand	Anodyne	SIGMAR1	26	48
c1ccc(C2(CN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872022547	CH	On-Demand	Anodyne	ICMT	72	39
O=C(CCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CC1	ZINC000872022548	EF	On-Demand	Anodyne	DRD4	23	42
O=C(CCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CC1	ZINC000872022548	EF	On-Demand	Anodyne	SIGMAR1	26	48
C[C@H](N[C@H](C)c1ccc2c(c1)OCO2)c1cccc(O)c1F	ZINC000872022620	DH	On-Demand	Anodyne	KCNQ2	21	42
CC[C@@H](CCC(F)(F)F)NC1CCN(CCc2ccccc2)CC1	ZINC000872022676	EI	On-Demand	Anodyne	DRD4	17	42
CC[C@@H](CCC(F)(F)F)NC1CCN(CCc2ccccc2)CC1	ZINC000872022676	EI	On-Demand	Anodyne	SIGMAR1	54	49
CC[C@@H](CCC(F)(F)F)NC1CCN(CCc2ccccc2)CC1	ZINC000872022676	EI	On-Demand	Anodyne	CACNA1G	21	43
CC[C@@H](CCC(F)(F)F)NC1CCN(CCc2ccccc2)CC1	ZINC000872022676	EI	On-Demand	Anodyne	BIRC2	29	40
O=C(C1CC1)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872022703	EG	On-Demand	Anodyne	PREP	58	42
O=C(C1CC1)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872022703	EG	On-Demand	Anodyne	SFRP1	54	34
O=C(C1CC1)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872022703	EG	On-Demand	Anodyne	WNT3	57	34
O=C(C1CC1)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872022704	EG	On-Demand	Anodyne	PREP	58	42
O=C(C1CC1)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872022704	EG	On-Demand	Anodyne	SFRP1	54	34
O=C(C1CC1)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872022704	EG	On-Demand	Anodyne	WNT3	57	34
CC[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)[C@H]1CCCOC1	ZINC000872022769	FE	On-Demand	Anodyne	L3MBTL3	47	41
CC[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)[C@@H]1CCCOC1	ZINC000872022770	FE	On-Demand	Anodyne	L3MBTL3	47	41
CC[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)[C@H]1CCCOC1	ZINC000872022771	FE	On-Demand	Anodyne	L3MBTL3	47	41
CC[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)[C@@H]1CCCOC1	ZINC000872022772	FE	On-Demand	Anodyne	L3MBTL3	47	41
COCCCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872022839	DG	On-Demand	Anodyne	SLC18A2	45	35
COCCCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872022840	DG	On-Demand	Anodyne	SLC18A2	45	35
Brc1cccc([C@H](NCCCCn2ccnc2)[C@@H]2CCOC2)c1	ZINC000872022961	GH	On-Demand	Anodyne	HMOX2	40	44
Brc1cccc([C@@H](NCCCCn2ccnc2)[C@H]2CCOC2)c1	ZINC000872022963	GH	On-Demand	Anodyne	HMOX2	40	44
Brc1cccc([C@@H](NCCCCn2ccnc2)[C@@H]2CCOC2)c1	ZINC000872022965	GH	On-Demand	Anodyne	HMOX2	40	44
Brc1cccc([C@H](NCCCCn2ccnc2)[C@H]2CCOC2)c1	ZINC000872022967	GH	On-Demand	Anodyne	HMOX2	40	44
C[C@H](N[C@H](C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023076	BD	On-Demand	Bother	COLA	89	33
COc1cc2c(cc1OC)[C@@H](NCCN1CCN(C(C)=O)CC1)CCCC2	ZINC000872023087	GE	On-Demand	Anodyne	HTR1A	23	50
COc1cc2c(cc1OC)[C@@H](NCCN1CCN(C(C)=O)CC1)CCCC2	ZINC000872023087	GE	On-Demand	Anodyne	DRD2	21	46
COc1cc2c(cc1OC)[C@@H](NCCN1CCN(C(C)=O)CC1)CCCC2	ZINC000872023087	GE	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](NCCN1CCN(C(C)=O)CC1)CCCC2	ZINC000872023087	GE	On-Demand	Anodyne	HTR7	17	41
COc1cc2c(cc1OC)[C@@H](NCCN1CCN(C(C)=O)CC1)CCCC2	ZINC000872023087	GE	On-Demand	Anodyne	MTNR1B	25	40
C[C@@H](NCCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872023111	CF	On-Demand	Anodyne	TBXAS1	57	46
C[C@@H](NCCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872023111	CF	On-Demand	Anodyne	HMOX2	50	35
C[C@@H](NCCCCn1ccnc1)c1cc(O)ccc1F	ZINC000872023111	CF	On-Demand	Anodyne	QPCT	39	41
C[C@@H](NCCCCn1ccnc1)c1cccc(O)c1F	ZINC000872023138	CF	On-Demand	Anodyne	TBXAS1	53	46
C[C@@H](NCCCCn1ccnc1)c1cccc(O)c1F	ZINC000872023138	CF	On-Demand	Anodyne	HMOX2	48	38
C[C@@H](NCCCCn1ccnc1)c1cccc(O)c1F	ZINC000872023138	CF	On-Demand	Anodyne	QPCT	39	40
CC[C@H](CCC(F)(F)F)NCCc1cccc(OC)c1	ZINC000872023163	CH	On-Demand	Anodyne	MTNR1A	19	43
CC[C@H](CCC(F)(F)F)NCCc1cccc(OC)c1	ZINC000872023163	CH	On-Demand	Anodyne	MTNR1B	18	43
CC[C@@H](CCC(F)(F)F)NCCc1cccc(OC)c1	ZINC000872023165	CH	On-Demand	Anodyne	MTNR1A	19	43
CC[C@@H](CCC(F)(F)F)NCCc1cccc(OC)c1	ZINC000872023165	CH	On-Demand	Anodyne	MTNR1B	18	43
c1ccc(CN2C[C@H]3CC[C@@H](NCCCCN4CCOCC4)[C@H]3C2)cc1	ZINC000872023196	FF	On-Demand	Anodyne	ACHE	17	42
c1ccc(CN2C[C@H]3CC[C@H](NCCCCN4CCOCC4)[C@H]3C2)cc1	ZINC000872023199	FF	On-Demand	Anodyne	ACHE	17	42
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023219	DH	On-Demand	Anodyne	ADRB2	20	52
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023219	DH	On-Demand	Anodyne	ADRB1	31	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023219	DH	On-Demand	Anodyne	ADRB3	44	47
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023220	DH	On-Demand	Anodyne	ADRB2	20	52
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023220	DH	On-Demand	Anodyne	ADRB1	31	46
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cc(O)ccc1F	ZINC000872023220	DH	On-Demand	Anodyne	ADRB3	44	47
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CO)CCCC2	ZINC000872023222	CE	On-Demand	Anodyne	SLC18A2	50	37
CC[C@@H](CCC(F)(F)F)NCCCCn1ccnc1	ZINC000872023272	CG	On-Demand	Anodyne	TBXAS1	26	47
CC[C@@H](NCCCCn1ccnc1)[C@@H]1CCCOC1	ZINC000872023291	CE	On-Demand	Anodyne	TBXAS1	16	40
CC[C@@H](NCCCCn1ccnc1)[C@H]1CCCOC1	ZINC000872023292	CE	On-Demand	Anodyne	TBXAS1	16	40
O=C(NCCN[C@H]1CCOC2(CCCC2)C1)c1ccccc1F	ZINC000872023338	DF	On-Demand	Anodyne	HCN1	42	31
O=C(NCCN[C@H]1CCOC2(CCCC2)C1)c1ccccc1F	ZINC000872023338	DF	On-Demand	Anodyne	HCN4	40	31
O=C(NCCN[C@@H]1CCOC2(CCCC2)C1)c1ccccc1F	ZINC000872023340	DF	On-Demand	Anodyne	HCN1	42	31
O=C(NCCN[C@@H]1CCOC2(CCCC2)C1)c1ccccc1F	ZINC000872023340	DF	On-Demand	Anodyne	HCN4	40	31
CC(=O)N1CCN(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872023343	FD	On-Demand	Anodyne	ACHE	31	40
CC(=O)N1CCN(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872023343	FD	On-Demand	Anodyne	SIGMAR1	47	41
CC(=O)N1CCN(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872023346	FD	On-Demand	Anodyne	ACHE	31	40
CC(=O)N1CCN(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872023346	FD	On-Demand	Anodyne	SIGMAR1	47	41
CCNC(=O)COc1ccc(CN[C@H](C)c2cc(O)ccc2F)cc1OC	ZINC000872023357	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
CCNC(=O)COc1ccc(CN[C@@H](C)c2cc(O)ccc2F)cc1OC	ZINC000872023359	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
COc1ccccc1[C@@H](O)CN[C@H](C)c1cccc(O)c1F	ZINC000872023362	DF	On-Demand	Anodyne	ADRB2	22	44
COc1ccccc1[C@@H](O)CN[C@@H](C)c1cccc(O)c1F	ZINC000872023366	DF	On-Demand	Anodyne	ADRB2	22	44
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000872023375	FI	On-Demand	Anodyne	CCR8	59	32
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000872023375	FI	On-Demand	Anodyne	SFRP1	79	38
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000872023375	FI	On-Demand	Anodyne	WNT3	48	33
CC[C@@H](CCC(F)(F)F)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000872023394	EG	On-Demand	Anodyne	HRH4	20	40
CC[C@H](CCC(F)(F)F)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000872023396	EG	On-Demand	Anodyne	HRH4	20	40
C[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc(O)ccc1F	ZINC000872023405	FF	On-Demand	Anodyne	HRH4	22	40
CC(C)(C)C(=O)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023460	EH	On-Demand	Anodyne	WNT3	48	30
CC(C)(C)C(=O)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023461	EH	On-Demand	Anodyne	WNT3	48	30
COc1cc2c(cc1OC)[C@@H](NCc1cccc(NC(C)=O)c1)CCCC2	ZINC000872023474	FI	On-Demand	Anodyne	TSHR	41	30
COc1cc2c(cc1OC)[C@@H](NCc1cccc(NC(C)=O)c1)CCCC2	ZINC000872023474	FI	On-Demand	Anodyne	HCRTR1	18	40
COc1cc2c(cc1OC)[C@@H](NCc1cccc(NC(C)=O)c1)CCCC2	ZINC000872023474	FI	On-Demand	Anodyne	MTNR1B	23	42
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	HTR1A	41	47
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	DRD2	28	42
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	DRD4	22	40
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	DRD3	29	40
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	HTR7	41	39
CC(=O)N1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872023476	EE	On-Demand	Anodyne	SIGMAR1	21	47
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	HTR1A	41	47
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	DRD2	28	42
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	DRD4	22	40
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	DRD3	29	40
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	HTR7	41	39
CC(=O)N1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872023477	EE	On-Demand	Anodyne	SIGMAR1	21	47
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCCn1ccnc1	ZINC000872023516	EH	On-Demand	Bother	TBXAS1	38	42
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCCn1ccnc1	ZINC000872023516	EH	On-Demand	Bother	HMOX2	46	32
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCCn1ccnc1	ZINC000872023517	EH	On-Demand	Bother	TBXAS1	38	42
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCCn1ccnc1	ZINC000872023517	EH	On-Demand	Bother	HMOX2	46	32
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023529	DH	On-Demand	Anodyne	ADRB2	25	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023529	DH	On-Demand	Anodyne	ADRB1	35	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023529	DH	On-Demand	Anodyne	ADRB3	46	51
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023530	DH	On-Demand	Anodyne	ADRB2	25	48
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023530	DH	On-Demand	Anodyne	ADRB1	35	48
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872023530	DH	On-Demand	Anodyne	ADRB3	46	51
C[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023537	GG	On-Demand	Bother	COLA	85	38
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000872023538	GG	On-Demand	Bother	COLA	85	38
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000872023539	GG	On-Demand	Bother	COLA	85	38
CC[C@@H](CCC(F)(F)F)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000872023570	FH	On-Demand	Clean	DPP7	28	42
CC[C@@H](CCC(F)(F)F)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	ZINC000872023571	FH	On-Demand	Clean	DPP7	28	42
CC[C@H](CCC(F)(F)F)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000872023572	FH	On-Demand	Clean	DPP7	28	42
CC[C@H](CCC(F)(F)F)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	ZINC000872023573	FH	On-Demand	Clean	DPP7	28	42
COc1ccccc1[C@@H](O)CN[C@H](C)c1cc(O)ccc1F	ZINC000872023579	DF	On-Demand	Anodyne	ADRB2	18	59
COc1ccccc1[C@@H](O)CN[C@@H](C)c1cc(O)ccc1F	ZINC000872023581	DF	On-Demand	Anodyne	ADRB2	18	59
C[C@@H](NCCCCN1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023593	EE	On-Demand	Bother	HTR1A	19	40
C[C@@H](NCCCCN1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023593	EE	On-Demand	Bother	DRD2	19	40
CC(=O)N1CCN(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872023638	ED	On-Demand	Bother	COLA	84	32
CC(=O)N1CCN(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872023639	ED	On-Demand	Bother	COLA	84	32
C[C@@H](NCC1(c2ccccc2)CCOCC1)c1cccc(O)c1F	ZINC000872023657	EH	On-Demand	Anodyne	ICMT	80	42
C[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023659	GI	On-Demand	Bother	EPHX2	41	39
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1	ZINC000872023660	GI	On-Demand	Bother	EPHX2	41	39
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1	ZINC000872023661	GI	On-Demand	Bother	EPHX2	41	39
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@H]1CCCOC1	ZINC000872023754	DF	On-Demand	Anodyne	CTSL	18	43
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@H]1CCCOC1	ZINC000872023754	DF	On-Demand	Anodyne	KCNK3	54	38
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@H]1CCCOC1	ZINC000872023754	DF	On-Demand	Anodyne	KCNK9	43	38
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@@H]1CCCOC1	ZINC000872023755	DF	On-Demand	Anodyne	CTSL	18	43
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@@H]1CCCOC1	ZINC000872023755	DF	On-Demand	Anodyne	KCNK3	54	38
CC[C@@H](NCCNC(=O)c1cccc(C)c1)[C@@H]1CCCOC1	ZINC000872023755	DF	On-Demand	Anodyne	KCNK9	43	38
COc1ccccc1[C@@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023774	EG	On-Demand	Bother	COLA	51	33
COc1ccccc1[C@@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023776	EG	On-Demand	Bother	COLA	51	33
C[C@@H](NCCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023784	DG	On-Demand	Bother	TBXAS1	43	43
C[C@@H](NCCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023784	DG	On-Demand	Bother	HMOX2	47	34
C[C@@H](NCCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023784	DG	On-Demand	Bother	QPCT	29	40
C[C@@H](NCCCN(C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023791	ED	On-Demand	Bother	COLA	79	37
C[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1cccc(O)c1F	ZINC000872023821	FI	On-Demand	Anodyne	EPHX2	49	41
C[C@@H](NCCCCN1CCCC[C@H]1C)c1cccc(O)c1F	ZINC000872023834	DH	On-Demand	Anodyne	HRH3	40	37
C[C@H]1CCCCN1CCCCN[C@H](C)c1cccc(O)c1F	ZINC000872023835	DH	On-Demand	Anodyne	HRH3	40	37
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1	ZINC000872023868	JF	On-Demand	Clean	DRD4	43	36
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1	ZINC000872023868	JF	On-Demand	Clean	MC4R	24	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1	ZINC000872023868	JF	On-Demand	Clean	CCR1	29	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1	ZINC000872023868	JF	On-Demand	Clean	LIPG	48	34
C[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1cc(O)ccc1F	ZINC000872023884	FI	On-Demand	Anodyne	EPHX2	48	43
C[C@H](N[C@H](C)c1cc(O)ccc1F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872023885	FI	On-Demand	Anodyne	EPHX2	48	43
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)C(F)(F)F)CCCC2	ZINC000872023899	EF	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)C(F)(F)F)CCCC2	ZINC000872023900	EF	On-Demand	Anodyne	SLC18A2	47	33
CC[C@@H](NCCCCn1ccnc1)C(C)(C)CC	ZINC000872023932	CG	On-Demand	Anodyne	TBXAS1	35	49
C[C@H](N[C@@H](C)c1cc(O)ccc1F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872023986	FI	On-Demand	Anodyne	EPHX2	48	43
CN1CCN(C(=O)c2ccc(CN[C@H]3CCOC4(CCCC4)C3)cc2)CC1	ZINC000872024057	FF	On-Demand	Anodyne	L3MBTL3	53	40
CN1CCN(C(=O)c2ccc(CN[C@@H]3CCOC4(CCCC4)C3)cc2)CC1	ZINC000872024058	FF	On-Demand	Anodyne	L3MBTL3	53	40
CC(C)(C)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024061	GH	On-Demand	Anodyne	DRD4	32	42
CC(C)(C)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024061	GH	On-Demand	Anodyne	SIGMAR1	30	45
CC(C)(C)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024061	GH	On-Demand	Anodyne	MLNR	40	41
CC(C)(C)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024062	GH	On-Demand	Anodyne	DRD4	32	42
CC(C)(C)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024062	GH	On-Demand	Anodyne	SIGMAR1	30	45
CC(C)(C)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872024062	GH	On-Demand	Anodyne	MLNR	40	41
Cc1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)n1	ZINC000872024097	DG	On-Demand	Anodyne	PDE8B	47	38
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024147	EH	On-Demand	Bother	ADRB1	27	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024147	EH	On-Demand	Bother	ADRB3	41	44
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024148	EH	On-Demand	Bother	ADRB1	27	44
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024148	EH	On-Demand	Bother	ADRB3	41	44
C[C@@H](NCCC(=O)NC1CCCCC1)c1cccc(O)c1F	ZINC000872024195	DG	On-Demand	Anodyne	CNR1	15	41
C[C@@H](NCCC(=O)NC1CCCCC1)c1cccc(O)c1F	ZINC000872024195	DG	On-Demand	Anodyne	CNR2	17	41
C[C@@H](NCCC(=O)NC1CCCCC1)c1cccc(O)c1F	ZINC000872024195	DG	On-Demand	Anodyne	EPHX2	15	43
CC[C@@H](CCC(F)(F)F)NCC1(c2ccccc2)CCOCC1	ZINC000872024241	EI	On-Demand	Anodyne	ICMT	78	41
CC[C@@H](NC1CCN(C(=O)c2ccccc2F)CC1)C(C)(C)CC	ZINC000872024261	EI	On-Demand	Anodyne	CCR8	63	40
CC[C@@H](NC1CCN(C(=O)c2ccccc2F)CC1)C(C)(C)CC	ZINC000872024261	EI	On-Demand	Anodyne	SFRP1	53	36
CC[C@@H](NC1CCN(C(=O)c2ccccc2F)CC1)C(C)(C)CC	ZINC000872024261	EI	On-Demand	Anodyne	WNT3	40	32
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CN1CCCC1=O)CCCC2	ZINC000872024268	EG	On-Demand	Anodyne	SLC18A2	48	38
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CN1CCCC1=O)CCCC2	ZINC000872024271	EG	On-Demand	Anodyne	SLC18A2	48	38
c1ccc(CN2C[C@H]3CC[C@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024357	EG	On-Demand	Anodyne	CYP11B1	16	42
c1ccc(CN2C[C@H]3CC[C@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024357	EG	On-Demand	Anodyne	TBXAS1	38	42
c1ccc(CN2C[C@H]3CC[C@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024357	EG	On-Demand	Anodyne	HMOX2	45	34
c1ccc(CN2C[C@H]3CC[C@@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024358	EG	On-Demand	Anodyne	CYP11B1	16	42
c1ccc(CN2C[C@H]3CC[C@@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024358	EG	On-Demand	Anodyne	TBXAS1	38	42
c1ccc(CN2C[C@H]3CC[C@@H](NCCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872024358	EG	On-Demand	Anodyne	HMOX2	45	34
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024373	DG	On-Demand	Anodyne	CTSL	21	42
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024373	DG	On-Demand	Anodyne	KCNK3	60	42
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024373	DG	On-Demand	Anodyne	KCNK9	47	41
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024374	DG	On-Demand	Anodyne	CTSL	21	42
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024374	DG	On-Demand	Anodyne	KCNK3	60	42
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(C)c1	ZINC000872024374	DG	On-Demand	Anodyne	KCNK9	47	41
COCCOc1ccccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024375	EH	On-Demand	Bother	COLA	107	36
COCCOc1ccccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024376	EH	On-Demand	Bother	COLA	107	36
C[C@@H](NCCC(=O)N1CCCCC1)c1cccc(O)c1F	ZINC000872024381	CF	On-Demand	Anodyne	DPP7	49	37
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	DRD2	17	47
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	DRD4	31	40
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	SLC6A3	17	48
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	KCNH2	16	40
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	SIGMAR1	45	50
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	SSTR5	40	36
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	CCR3	54	42
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	MLNR	53	41
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	MCHR1	35	44
C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024422	EH	On-Demand	Anodyne	CACNA1G	37	40
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	DRD2	17	47
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	DRD4	31	40
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	SLC6A3	17	48
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	KCNH2	16	40
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	SIGMAR1	45	50
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	SSTR5	40	36
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	CCR3	54	42
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	MLNR	53	41
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	MCHR1	35	44
C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1cccc(O)c1F	ZINC000872024424	EH	On-Demand	Anodyne	CACNA1G	37	40
CC[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)[C@H]1CCCOC1	ZINC000872024430	FH	On-Demand	Anodyne	KCNK3	57	41
CC[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)[C@H]1CCCOC1	ZINC000872024437	FH	On-Demand	Anodyne	KCNK3	57	41
CC[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872024439	FH	On-Demand	Anodyne	KCNK3	57	41
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	SLC6A3	15	43
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	SIGMAR1	37	45
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	SSTR5	51	36
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	CCR3	28	40
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	MLNR	51	42
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	MCHR1	23	43
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872024440	EJ	On-Demand	Anodyne	CACNA1G	42	45
CC[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872024441	FH	On-Demand	Anodyne	KCNK3	57	41
CCOc1ccccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024458	DH	On-Demand	Bother	COLA	96	35
CCOc1ccccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024460	DH	On-Demand	Bother	COLA	96	35
C[C@H](NC[C@H](O)c1ccccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024471	DG	On-Demand	Bother	COLA	99	35
C[C@@H](NC[C@@H](O)c1ccccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024472	DG	On-Demand	Bother	COLA	99	35
c1ccc2c(c1)CCCC[C@H](NCCCCn1ccnc1)C2	ZINC000872024474	CH	On-Demand	Anodyne	TBXAS1	41	39
c1ccc2c(c1)CCCC[C@H](NCCCCn1ccnc1)C2	ZINC000872024474	CH	On-Demand	Anodyne	HMOX2	40	36
c1ccc2c(c1)CCCC[C@@H](NCCCCn1ccnc1)C2	ZINC000872024476	CH	On-Demand	Anodyne	TBXAS1	41	39
c1ccc2c(c1)CCCC[C@@H](NCCCCn1ccnc1)C2	ZINC000872024476	CH	On-Demand	Anodyne	HMOX2	40	36
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872024495	EG	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872024495	EG	On-Demand	Anodyne	SSTR5	51	36
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872024503	EG	On-Demand	Anodyne	SIGMAR1	30	43
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872024503	EG	On-Demand	Anodyne	SSTR5	51	36
CC[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)[C@H]1CCCOC1	ZINC000872024508	FH	On-Demand	Anodyne	GRM4	62	43
CC[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)[C@@H]1CCCOC1	ZINC000872024511	FH	On-Demand	Anodyne	GRM4	62	43
CC[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)[C@@H]1CCCOC1	ZINC000872024513	FH	On-Demand	Anodyne	GRM4	62	43
CC[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)[C@H]1CCCOC1	ZINC000872024515	FH	On-Demand	Anodyne	GRM4	62	43
C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024541	FI	On-Demand	Bother	GRIN2B	15	44
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2	ZINC000872024542	FI	On-Demand	Bother	GRIN2B	15	44
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2	ZINC000872024543	FI	On-Demand	Bother	GRIN2B	15	44
CNC(=O)COc1cccc(CN[C@H](C)c2cccc(O)c2F)c1	ZINC000872024559	EF	On-Demand	Anodyne	PDS	71	36
CNC(=O)COc1cccc(CN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872024560	EF	On-Demand	Anodyne	PDS	71	36
COc1cc2c(cc1OC)[C@@H](NCCCCn1ccnc1)CCCC2	ZINC000872024630	EH	On-Demand	Anodyne	QPCT	38	45
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccncc2)CC1	ZINC000872024675	EH	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccncc2)CC1	ZINC000872024675	EH	On-Demand	Anodyne	SSTR5	59	35
C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872024765	GG	On-Demand	Bother	COLA	87	39
COc1cccc([C@@H](C)N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024821	DI	On-Demand	Bother	TAAR1	25	44
COc1cccc([C@H](C)N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024822	DI	On-Demand	Bother	TAAR1	25	44
COc1cccc([C@H](C)N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024823	DI	On-Demand	Bother	TAAR1	25	44
COc1cccc([C@@H](C)N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024824	DI	On-Demand	Bother	TAAR1	25	44
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(N2CCOCC2)cc1	ZINC000872024863	GI	On-Demand	Clean	KCNJ1	18	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(N2CCOCC2)cc1	ZINC000872024864	GI	On-Demand	Clean	KCNJ1	18	40
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)C(C)(C)CC	ZINC000872024917	DH	On-Demand	Anodyne	SIGMAR1	20	42
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)C(C)(C)CC	ZINC000872024917	DH	On-Demand	Anodyne	SSTR5	71	36
CCC(=O)Nc1cccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024940	EH	On-Demand	Bother	COLA	72	35
CCC(=O)Nc1cccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872024942	EH	On-Demand	Bother	COLA	72	35
O=C(Nc1cccc(CN[C@H]2CCOC3(CCCC3)C2)c1)c1ccncc1	ZINC000872024978	FH	On-Demand	Anodyne	KCNK3	48	42
O=C(Nc1cccc(CN[C@@H]2CCOC3(CCCC3)C2)c1)c1ccncc1	ZINC000872024981	FH	On-Demand	Anodyne	KCNK3	48	42
C[C@@H](NC[C@@H](O)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025030	CE	On-Demand	Bother	COLA	63	35
C[C@H](NC[C@H](O)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025039	CE	On-Demand	Bother	COLA	63	35
C[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025050	FG	On-Demand	Bother	COLA	60	35
CC[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)[C@H]1CCCOC1	ZINC000872025057	EH	On-Demand	Anodyne	SIGMAR1	26	43
CC[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)[C@H]1CCCOC1	ZINC000872025057	EH	On-Demand	Anodyne	SSTR5	42	34
CC[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)[C@@H]1CCCOC1	ZINC000872025060	EH	On-Demand	Anodyne	SIGMAR1	26	43
CC[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)[C@@H]1CCCOC1	ZINC000872025060	EH	On-Demand	Anodyne	SSTR5	42	34
CC[C@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872025102	DI	On-Demand	Anodyne	ADRB1	28	47
CC[C@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872025102	DI	On-Demand	Anodyne	ADRB3	42	47
CC[C@H](CCC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000872025103	DI	On-Demand	Anodyne	ADRB1	28	47
CC[C@H](CCC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000872025103	DI	On-Demand	Anodyne	ADRB3	42	47
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872025104	DI	On-Demand	Anodyne	ADRB1	28	47
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872025104	DI	On-Demand	Anodyne	ADRB3	42	47
CC[C@@H](CCC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000872025105	DI	On-Demand	Anodyne	ADRB1	28	47
CC[C@@H](CCC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000872025105	DI	On-Demand	Anodyne	ADRB3	42	47
CC[C@H](C)NC(=O)c1cccc(CN[C@@H](CC)[C@@H]2CCCOC2)c1	ZINC000872025182	EH	On-Demand	Anodyne	PRKD1	16	41
CC[C@H](C)NC(=O)c1cccc(CN[C@H](CC)[C@@H]2CCCOC2)c1	ZINC000872025183	EH	On-Demand	Anodyne	PRKD1	16	41
CC[C@H](C)NC(=O)c1cccc(CN[C@@H](CC)[C@H]2CCCOC2)c1	ZINC000872025184	EH	On-Demand	Anodyne	PRKD1	16	41
CC[C@H](C)NC(=O)c1cccc(CN[C@H](CC)[C@H]2CCCOC2)c1	ZINC000872025185	EH	On-Demand	Anodyne	PRKD1	16	41
C[C@H](NC1CCN(Cc2ccccn2)CC1)c1cc(O)ccc1F	ZINC000872025212	EG	On-Demand	Anodyne	SSTR5	40	36
C[C@@H](NC1CCN(Cc2ccccn2)CC1)c1cc(O)ccc1F	ZINC000872025213	EG	On-Demand	Anodyne	SSTR5	40	36
CC[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)[C@@H]1CCCOC1	ZINC000872025240	ED	On-Demand	Anodyne	PROC	46	32
CC[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)[C@H]1CCCOC1	ZINC000872025241	ED	On-Demand	Anodyne	PROC	46	32
CC[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)[C@@H]1CCCOC1	ZINC000872025242	ED	On-Demand	Anodyne	PROC	46	32
CC[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)[C@H]1CCCOC1	ZINC000872025243	ED	On-Demand	Anodyne	PROC	46	32
CCN1CC[C@H](CN[C@@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872025254	EG	On-Demand	Anodyne	SLC18A2	47	33
CCN1CC[C@H](CN[C@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872025256	EG	On-Demand	Anodyne	SLC18A2	47	33
CC[C@@H](CCC(F)(F)F)NCC(=O)N(C)Cc1ccccc1	ZINC000872025274	DG	On-Demand	Anodyne	CTSB	31	41
c1ccc2c(c1)CCCC[C@@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025302	EH	On-Demand	Anodyne	SIGMAR1	46	43
c1ccc2c(c1)CCCC[C@@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025302	EH	On-Demand	Anodyne	SSTR5	55	36
c1ccc2c(c1)CCCC[C@@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025302	EH	On-Demand	Anodyne	CXCR3	16	41
c1ccc2c(c1)CCCC[C@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025303	EH	On-Demand	Anodyne	SIGMAR1	46	43
c1ccc2c(c1)CCCC[C@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025303	EH	On-Demand	Anodyne	SSTR5	55	36
c1ccc2c(c1)CCCC[C@H](NC1CCN(Cc3ccncc3)CC1)C2	ZINC000872025303	EH	On-Demand	Anodyne	CXCR3	16	41
C[C@H](NCC(=O)N(C)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025320	EG	On-Demand	Bother	COLA	115	39
C[C@H](NCC(=O)N(C)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025320	EG	On-Demand	Bother	LIMK2	18	41
CC[C@@H](CC1CCCCC1)NCc1ccc(C(=O)NCC(N)=O)cc1	ZINC000872025342	EF	On-Demand	Anodyne	F2	15	43
CC[C@@H](CC1CCCCC1)NCc1ccc(C(=O)NCC(N)=O)cc1	ZINC000872025342	EF	On-Demand	Anodyne	PROC	66	44
C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc(O)c1F	ZINC000872025347	EH	On-Demand	Anodyne	GRIN2B	18	47
C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc(O)c1F	ZINC000872025347	EH	On-Demand	Anodyne	PKM	32	40
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1c(F)cccc1F	ZINC000872025378	DI	On-Demand	Bother	COLA	57	32
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1c(F)cccc1F	ZINC000872025379	DI	On-Demand	Bother	COLA	57	32
C[C@H](N[C@H](C)c1c(F)cccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025380	DI	On-Demand	Bother	COLA	57	32
CC[C@@H](NC1CCN(Cc2ccc(F)c(F)c2)CC1)[C@H]1CCCOC1	ZINC000872025392	FH	On-Demand	Anodyne	SSTR5	58	38
CC[C@@H](NC1CCN(Cc2ccc(F)c(F)c2)CC1)[C@@H]1CCCOC1	ZINC000872025393	FH	On-Demand	Anodyne	SSTR5	58	38
CCN1CC[C@H](CN[C@@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872025398	DG	On-Demand	Anodyne	SLC6A3	19	40
CCN1CC[C@H](CN[C@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872025399	DG	On-Demand	Anodyne	SLC6A3	19	40
COc1cc2c(cc1OC)[C@@H](NCc1ccc(Cl)nc1)CCCC2	ZINC000872025500	EI	On-Demand	Anodyne	SLC18A2	46	33
CCN1CC[C@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872025508	EF	On-Demand	Anodyne	DRD4	29	41
CCN1CC[C@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872025508	EF	On-Demand	Anodyne	ACHE	40	42
CCN1CC[C@H](CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872025510	EF	On-Demand	Anodyne	DRD4	29	41
CCN1CC[C@H](CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872025510	EF	On-Demand	Anodyne	ACHE	40	42
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025518	EG	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025518	EG	On-Demand	Anodyne	SSTR5	61	37
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025518	EG	On-Demand	Anodyne	CXCR3	22	40
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025519	EG	On-Demand	Anodyne	SIGMAR1	24	42
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025519	EG	On-Demand	Anodyne	SSTR5	61	37
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872025519	EG	On-Demand	Anodyne	CXCR3	22	40
CNC(=O)COc1cccc(CN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872025542	EF	On-Demand	Anodyne	PDS	59	35
CNC(=O)COc1cccc(CN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872025543	EF	On-Demand	Anodyne	PDS	59	35
CNC(=O)COc1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872025578	GF	On-Demand	Anodyne	SIGMAR1	18	42
CNC(=O)COc1cccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872025578	GF	On-Demand	Anodyne	PDS	41	32
NC(=O)CNC(=O)c1ccc(CN[C@H]2CCCCc3ccccc3C2)cc1	ZINC000872025587	FE	On-Demand	Anodyne	PROC	53	37
NC(=O)CNC(=O)c1ccc(CN[C@@H]2CCCCc3ccccc3C2)cc1	ZINC000872025588	FE	On-Demand	Anodyne	PROC	53	37
CC[C@@H](CCC(F)(F)F)NCCC(=O)N1CCCCC1	ZINC000872025612	CG	On-Demand	Anodyne	RIR1_HHV11	41	34
CCC(CC)C(=O)N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872025633	EH	On-Demand	Anodyne	CCR1	35	41
CCC(CC)C(=O)N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872025634	EH	On-Demand	Anodyne	CCR1	35	41
O=C(Nc1cccc(CN[C@H]2CCOC3(CCCC3)C2)c1)c1ccccn1	ZINC000872025657	FH	On-Demand	Anodyne	GRM4	62	43
O=C(Nc1cccc(CN[C@@H]2CCOC3(CCCC3)C2)c1)c1ccccn1	ZINC000872025658	FH	On-Demand	Anodyne	GRM4	62	43
C[C@H](N[C@@H](C)c1cc(O)ccc1F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000872025679	FH	On-Demand	Anodyne	TNKS	46	33
C[C@H](N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1cc(O)ccc1F	ZINC000872025680	FH	On-Demand	Anodyne	TNKS	46	33
C[C@H](N[C@H](C)c1cc(O)ccc1F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000872025681	FH	On-Demand	Anodyne	TNKS	46	33
CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872025689	GF	On-Demand	Anodyne	CASR	31	40
CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872025689	GF	On-Demand	Anodyne	EPHX2	24	43
CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872025690	GF	On-Demand	Anodyne	CASR	31	40
CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872025690	GF	On-Demand	Anodyne	EPHX2	24	43
CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872025691	GF	On-Demand	Anodyne	CASR	31	40
CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872025691	GF	On-Demand	Anodyne	EPHX2	24	43
CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872025692	GF	On-Demand	Anodyne	CASR	31	40
CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872025692	GF	On-Demand	Anodyne	EPHX2	24	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN(Cc2ccncc2)CC1	ZINC000872025717	GI	On-Demand	Bother	SIGMAR1	16	44
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CCN(Cc2ccncc2)CC1	ZINC000872025718	GI	On-Demand	Bother	SIGMAR1	16	44
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(Cl)nc1	ZINC000872025739	EI	On-Demand	Bother	NACHRBETA2	33	41
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(Cl)nc1	ZINC000872025740	EI	On-Demand	Bother	NACHRBETA2	33	41
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H]1CCCOC1	ZINC000872025764	DF	On-Demand	Anodyne	SSTR5	51	34
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H]1CCCOC1	ZINC000872025766	DF	On-Demand	Anodyne	SSTR5	51	34
CC[C@H](NCc1cccc(OCC(=O)NC)c1)C(C)(C)CC	ZINC000872025803	DG	On-Demand	Anodyne	PDS	82	36
CC[C@@H](NCc1cccc(OCC(=O)NC)c1)C(C)(C)CC	ZINC000872025804	DG	On-Demand	Anodyne	PDS	82	36
CCC(CC)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025817	GH	On-Demand	Anodyne	DRD4	27	41
CCC(CC)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025817	GH	On-Demand	Anodyne	SIGMAR1	27	41
CCC(CC)C(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025817	GH	On-Demand	Anodyne	CACNA1B	20	41
CCC(CC)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025818	GH	On-Demand	Anodyne	DRD4	27	41
CCC(CC)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025818	GH	On-Demand	Anodyne	SIGMAR1	27	41
CCC(CC)C(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872025818	GH	On-Demand	Anodyne	CACNA1B	20	41
CNC(=O)COc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)c1	ZINC000872025831	GG	On-Demand	Bother	PDS	28	41
CNC(=O)COc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)c1	ZINC000872025832	GG	On-Demand	Bother	PDS	28	41
CC[C@@H](CCC(F)(F)F)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000872025834	EG	On-Demand	Anodyne	PDS	77	38
CC[C@H](CCC(F)(F)F)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000872025835	EG	On-Demand	Anodyne	PDS	77	38
C[C@@H](NCCC(=O)N1CCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025874	DF	On-Demand	Bother	COLA	42	32
C[C@@H](NCCC(=O)N1CCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872025874	DF	On-Demand	Bother	DPP7	24	42
c1ccc(CN2C[C@H]3[C@@H](NC4CCN(Cc5ccncc5)CC4)CC[C@H]3C2)cc1	ZINC000872025876	GH	On-Demand	Anodyne	DRD4	36	44
c1ccc(CN2C[C@H]3[C@@H](NC4CCN(Cc5ccncc5)CC4)CC[C@H]3C2)cc1	ZINC000872025876	GH	On-Demand	Anodyne	ACHE	30	44
c1ccc(CN2C[C@H]3[C@@H](NC4CCN(Cc5ccncc5)CC4)CC[C@H]3C2)cc1	ZINC000872025876	GH	On-Demand	Anodyne	SIGMAR1	46	43
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872025877	GH	On-Demand	Anodyne	DRD4	36	44
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872025877	GH	On-Demand	Anodyne	ACHE	30	44
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872025877	GH	On-Demand	Anodyne	SIGMAR1	46	43
Fc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025935	EH	On-Demand	Anodyne	SIGMAR1	31	45
Fc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025935	EH	On-Demand	Anodyne	MCHR1	17	42
Fc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025935	EH	On-Demand	Anodyne	CACNA1G	22	44
Fc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025936	EH	On-Demand	Anodyne	SIGMAR1	31	45
Fc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025936	EH	On-Demand	Anodyne	MCHR1	17	42
Fc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872025936	EH	On-Demand	Anodyne	CACNA1G	22	44
CC[C@H](CCC(F)(F)F)NCc1cccc(OCC(=O)NC)c1	ZINC000872026021	EG	On-Demand	Anodyne	PDS	82	39
CC[C@@H](CCC(F)(F)F)NCc1cccc(OCC(=O)NC)c1	ZINC000872026022	EG	On-Demand	Anodyne	PDS	82	39
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C)nc1)CCCC2	ZINC000872026038	EH	On-Demand	Anodyne	SLC18A2	46	32
CC[C@H](NCc1cccc(OCCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872026070	FF	On-Demand	Anodyne	LTA4H	25	41
CC[C@H](NCc1cccc(OCCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872026070	FF	On-Demand	Anodyne	EPHX2	15	42
CC[C@H](NCc1cccc(OCCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872026071	FF	On-Demand	Anodyne	LTA4H	25	41
CC[C@H](NCc1cccc(OCCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872026071	FF	On-Demand	Anodyne	EPHX2	15	42
CC[C@@H](NCc1cccc(OCCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872026072	FF	On-Demand	Anodyne	LTA4H	25	41
CC[C@@H](NCc1cccc(OCCN2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872026072	FF	On-Demand	Anodyne	EPHX2	15	42
CC[C@@H](NCc1cccc(OCCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872026073	FF	On-Demand	Anodyne	LTA4H	25	41
CC[C@@H](NCc1cccc(OCCN2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872026073	FF	On-Demand	Anodyne	EPHX2	15	42
OC1CCN(CCCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872026144	DF	On-Demand	Anodyne	HTR1A	20	47
OC1CCN(CCCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872026145	DF	On-Demand	Anodyne	HTR1A	20	47
Fc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1F	ZINC000872026159	FI	On-Demand	Anodyne	SIGMAR1	16	47
Fc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1F	ZINC000872026159	FI	On-Demand	Anodyne	MCHR1	25	40
Fc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1F	ZINC000872026160	FI	On-Demand	Anodyne	SIGMAR1	16	47
Fc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1F	ZINC000872026160	FI	On-Demand	Anodyne	MCHR1	25	40
CCC(CC)C(=O)N1CCC(N[C@@H](CC)C(C)(C)CC)CC1	ZINC000872026205	DI	On-Demand	Anodyne	EPHX2	15	44
CCC(CC)C(=O)N1CCC(N[C@H](CC)C(C)(C)CC)CC1	ZINC000872026206	DI	On-Demand	Anodyne	EPHX2	15	44
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872026223	FG	On-Demand	Bother	SIGMAR1	20	41
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872026224	FG	On-Demand	Bother	SIGMAR1	20	41
C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cc(O)ccc1F	ZINC000872026247	EH	On-Demand	Anodyne	GRIN2B	17	45
C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cc(O)ccc1F	ZINC000872026247	EH	On-Demand	Anodyne	PKM	33	41
C[C@H](N[C@H](C)c1cc(O)ccc1F)c1ccc2c(c1)CCC(=O)N2	ZINC000872026248	EH	On-Demand	Anodyne	GRIN2B	17	45
C[C@H](N[C@H](C)c1cc(O)ccc1F)c1ccc2c(c1)CCC(=O)N2	ZINC000872026248	EH	On-Demand	Anodyne	PKM	33	41
C[C@H](N[C@@H](C)c1cc(O)ccc1F)c1ccc2c(c1)CCC(=O)N2	ZINC000872026249	EH	On-Demand	Anodyne	GRIN2B	17	45
C[C@H](N[C@@H](C)c1cc(O)ccc1F)c1ccc2c(c1)CCC(=O)N2	ZINC000872026249	EH	On-Demand	Anodyne	PKM	33	41
C[C@H](O)c1ccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872026315	DH	On-Demand	Bother	COLA	75	33
C[C@H](O)c1ccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872026317	DH	On-Demand	Bother	COLA	75	33
CC[C@@H](CCC(F)(F)F)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872026397	EH	On-Demand	Anodyne	CTSF	58	40
CC[C@H](CCC(F)(F)F)N[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872026398	EH	On-Demand	Anodyne	CTSF	58	40
CC[C@H](CCC(F)(F)F)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872026399	EH	On-Demand	Anodyne	CTSF	58	40
CC[C@@H](CCC(F)(F)F)N[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872026400	EH	On-Demand	Anodyne	CTSF	58	40
C[C@@H](NCCc1ccc(O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872026401	DG	On-Demand	Bother	COLA	90	34
COc1cccc(C(=O)NCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872026451	EF	On-Demand	Anodyne	DRD4	58	44
COc1cccc(C(=O)NCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872026451	EF	On-Demand	Anodyne	CTSL	26	41
COc1cccc(C(=O)NCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872026451	EF	On-Demand	Anodyne	CTSS	17	48
COc1cccc(C(=O)NCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872026451	EF	On-Demand	Anodyne	TAAR1	28	40
COc1cccc(C(=O)NCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872026451	EF	On-Demand	Anodyne	KCNK3	15	42
COc1cccc(C(=O)NCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872026452	EF	On-Demand	Anodyne	DRD4	58	44
COc1cccc(C(=O)NCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872026452	EF	On-Demand	Anodyne	CTSL	26	41
COc1cccc(C(=O)NCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872026452	EF	On-Demand	Anodyne	CTSS	17	48
COc1cccc(C(=O)NCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872026452	EF	On-Demand	Anodyne	TAAR1	28	40
COc1cccc(C(=O)NCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872026452	EF	On-Demand	Anodyne	KCNK3	15	42
C[C@@H](NC[C@@H](O)CN1CCCCC1)c1cccc(O)c1F	ZINC000872026477	CE	On-Demand	Anodyne	ABCB1	16	40
C[C@H](NC[C@H](O)CN1CCCCC1)c1cccc(O)c1F	ZINC000872026480	CE	On-Demand	Anodyne	ABCB1	16	40
C[C@@H](NC[C@@H]1CCCN1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872026488	CE	On-Demand	Bother	CHRNA10	55	41
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026507	DG	On-Demand	Anodyne	ADRB2	28	49
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026507	DG	On-Demand	Anodyne	ADRB1	32	47
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026507	DG	On-Demand	Anodyne	PDS	55	42
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026508	DG	On-Demand	Anodyne	ADRB2	28	49
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026508	DG	On-Demand	Anodyne	ADRB1	32	47
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026508	DG	On-Demand	Anodyne	PDS	55	42
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026509	DG	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026509	DG	On-Demand	Anodyne	ADRB1	32	47
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(F)c1	ZINC000872026509	DG	On-Demand	Anodyne	PDS	55	42
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026510	DG	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026510	DG	On-Demand	Anodyne	ADRB1	32	47
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(F)c1	ZINC000872026510	DG	On-Demand	Anodyne	PDS	55	42
COCCN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872026519	FG	On-Demand	Anodyne	SLC18A2	45	31
COCCN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872026519	FG	On-Demand	Anodyne	EHMT2	71	34
COCCN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872026520	FG	On-Demand	Anodyne	SLC18A2	45	31
COCCN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872026520	FG	On-Demand	Anodyne	EHMT2	71	34
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026529	DF	On-Demand	Anodyne	ADRB2	22	46
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026529	DF	On-Demand	Anodyne	ADRB1	22	46
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026529	DF	On-Demand	Anodyne	ADRB3	15	46
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026530	DF	On-Demand	Anodyne	ADRB2	22	46
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026530	DF	On-Demand	Anodyne	ADRB1	22	46
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026530	DF	On-Demand	Anodyne	ADRB3	15	46
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026531	DF	On-Demand	Anodyne	ADRB2	22	46
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026531	DF	On-Demand	Anodyne	ADRB1	22	46
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026531	DF	On-Demand	Anodyne	ADRB3	15	46
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026532	DF	On-Demand	Anodyne	ADRB2	22	46
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026532	DF	On-Demand	Anodyne	ADRB1	22	46
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1cccc(F)c1	ZINC000872026532	DF	On-Demand	Anodyne	ADRB3	15	46
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872026587	EG	On-Demand	Anodyne	EPHX2	18	44
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872026587	EG	On-Demand	Anodyne	L3MBTL3	65	37
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872026588	EG	On-Demand	Anodyne	EPHX2	18	44
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872026588	EG	On-Demand	Anodyne	L3MBTL3	65	37
O=C(c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1)N1CCOCC1	ZINC000872026613	FF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCOCC1	ZINC000872026614	FF	On-Demand	Anodyne	L3MBTL3	51	35
COc1cccc(C(=O)NCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872026621	EF	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872026621	EF	On-Demand	Anodyne	CTSL	19	40
COc1cccc(C(=O)NCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872026621	EF	On-Demand	Anodyne	MTNR1A	41	37
COc1cccc(C(=O)NCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872026621	EF	On-Demand	Anodyne	CTSS	16	40
COc1cccc(C(=O)NCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872026622	EF	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872026622	EF	On-Demand	Anodyne	CTSL	19	40
COc1cccc(C(=O)NCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872026622	EF	On-Demand	Anodyne	MTNR1A	41	37
COc1cccc(C(=O)NCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872026622	EF	On-Demand	Anodyne	CTSS	16	40
CC[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872026625	FF	On-Demand	Anodyne	NAMPT	40	37
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872026626	FF	On-Demand	Anodyne	NAMPT	40	37
CC[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872026627	FF	On-Demand	Anodyne	NAMPT	40	37
CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872026628	FF	On-Demand	Anodyne	NAMPT	40	37
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccc(S(C)(=O)=O)cc1	ZINC000872026630	GH	On-Demand	Anodyne	SIGMAR1	15	45
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccc(S(C)(=O)=O)cc1	ZINC000872026630	GH	On-Demand	Anodyne	CCR5	25	41
CC[C@@H](CCC(F)(F)F)NCC(=O)NCc1ccc(OC)cc1	ZINC000872026651	EG	On-Demand	Anodyne	PPARA	15	40
CC[C@@H](CCC(F)(F)F)NCC(=O)NCc1ccc(OC)cc1	ZINC000872026651	EG	On-Demand	Anodyne	CA9	15	44
O=S(=O)(c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCCC1	ZINC000872026668	GG	On-Demand	Anodyne	NAMPT	43	41
O=S(=O)(c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1)N1CCCC1	ZINC000872026669	GG	On-Demand	Anodyne	NAMPT	43	41
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026679	DG	On-Demand	Anodyne	ADRB2	37	47
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026679	DG	On-Demand	Anodyne	ADRB1	41	47
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026679	DG	On-Demand	Anodyne	ADRB3	17	43
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026680	DG	On-Demand	Anodyne	ADRB2	37	47
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026680	DG	On-Demand	Anodyne	ADRB1	41	47
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026680	DG	On-Demand	Anodyne	ADRB3	17	43
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026681	DG	On-Demand	Anodyne	ADRB2	37	47
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026681	DG	On-Demand	Anodyne	ADRB1	41	47
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872026681	DG	On-Demand	Anodyne	ADRB3	17	43
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026682	DG	On-Demand	Anodyne	ADRB2	37	47
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026682	DG	On-Demand	Anodyne	ADRB1	41	47
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)cc1	ZINC000872026682	DG	On-Demand	Anodyne	ADRB3	17	43
COc1cccc(C(=O)NCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872026715	EF	On-Demand	Anodyne	DRD4	59	48
COc1cccc(C(=O)NCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872026715	EF	On-Demand	Anodyne	CTSS	17	47
COc1cccc(C(=O)NCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872026715	EF	On-Demand	Anodyne	TAAR1	27	43
COc1cccc(C(=O)NCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872026716	EF	On-Demand	Anodyne	DRD4	59	48
COc1cccc(C(=O)NCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872026716	EF	On-Demand	Anodyne	CTSS	17	47
COc1cccc(C(=O)NCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872026716	EF	On-Demand	Anodyne	TAAR1	27	43
CC[C@H](N[C@H](C)C(=O)NCc1ccccc1)[C@@H]1CCCOC1	ZINC000872026746	DE	On-Demand	Anodyne	PROC	54	36
CC[C@H](N[C@H](C)C(=O)NCc1ccccc1)[C@@H]1CCCOC1	ZINC000872026746	DE	On-Demand	Anodyne	PDS	42	34
CC[C@H](N[C@H](C)C(=O)NCc1ccccc1)[C@H]1CCCOC1	ZINC000872026748	DE	On-Demand	Anodyne	PROC	54	36
CC[C@H](N[C@H](C)C(=O)NCc1ccccc1)[C@H]1CCCOC1	ZINC000872026748	DE	On-Demand	Anodyne	PDS	42	34
CC[C@H](N[C@@H](C)C(=O)NCc1ccccc1)[C@@H]1CCCOC1	ZINC000872026750	DE	On-Demand	Anodyne	PROC	54	36
CC[C@H](N[C@@H](C)C(=O)NCc1ccccc1)[C@@H]1CCCOC1	ZINC000872026750	DE	On-Demand	Anodyne	PDS	42	34
CC[C@H](N[C@@H](C)C(=O)NCc1ccccc1)[C@H]1CCCOC1	ZINC000872026752	DE	On-Demand	Anodyne	PROC	54	36
CC[C@H](N[C@@H](C)C(=O)NCc1ccccc1)[C@H]1CCCOC1	ZINC000872026752	DE	On-Demand	Anodyne	PDS	42	34
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC(F)(F)F	ZINC000872026770	FE	On-Demand	Anodyne	ACHE	16	41
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC(F)(F)F	ZINC000872026770	FE	On-Demand	Anodyne	SIGMAR1	23	40
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC(F)(F)F	ZINC000872026770	FE	On-Demand	Anodyne	CCR2	22	41
CCN(CC)C(=O)CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872026791	EE	On-Demand	Anodyne	ACHE	16	43
CCN(CC)C(=O)CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872026791	EE	On-Demand	Anodyne	SIGMAR1	28	44
CCN(CC)C(=O)CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872026791	EE	On-Demand	Anodyne	CCR5	15	40
c1cc(CN[C@H]2CCOC3(CCCC3)C2)cc(OCCN2CCOCC2)c1	ZINC000872026815	FF	On-Demand	Anodyne	LTA4H	25	42
c1cc(CN[C@H]2CCOC3(CCCC3)C2)cc(OCCN2CCOCC2)c1	ZINC000872026815	FF	On-Demand	Anodyne	EPHX2	18	42
c1cc(CN[C@@H]2CCOC3(CCCC3)C2)cc(OCCN2CCOCC2)c1	ZINC000872026818	FF	On-Demand	Anodyne	LTA4H	25	42
c1cc(CN[C@@H]2CCOC3(CCCC3)C2)cc(OCCN2CCOCC2)c1	ZINC000872026818	FF	On-Demand	Anodyne	EPHX2	18	42
C[C@H](NC[C@H](O)c1cccc(F)c1)c1cc(O)ccc1F	ZINC000872026825	CG	On-Demand	Anodyne	ADRB2	15	53
C[C@@H](NC[C@@H](O)c1cccc(F)c1)c1cc(O)ccc1F	ZINC000872026826	CG	On-Demand	Anodyne	ADRB2	15	53
CC[C@@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)[C@H]1CCCOC1	ZINC000872026843	FE	On-Demand	Anodyne	PDE6A	41	33
CC[C@@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)[C@@H]1CCCOC1	ZINC000872026845	FE	On-Demand	Anodyne	PDE6A	41	33
CC[C@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)[C@H]1CCCOC1	ZINC000872026847	FE	On-Demand	Anodyne	PDE6A	41	33
CC[C@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)[C@@H]1CCCOC1	ZINC000872026848	FE	On-Demand	Anodyne	PDE6A	41	33
OCc1ccccc1CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872026893	EG	On-Demand	Anodyne	SIGMAR1	28	40
COC(=O)N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872026975	CE	On-Demand	Anodyne	GPR119	19	40
COC(=O)N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872026976	CE	On-Demand	Anodyne	GPR119	19	40
C[C@@H](NC[C@@H]1CCCN1C)c1cccc(O)c1F	ZINC000872026978	CE	On-Demand	Anodyne	CHRNA10	65	43
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP13	48	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP2	27	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP3	50	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP8	28	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP9	30	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	TGM2	40	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP7	43	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027004	GF	On-Demand	Anodyne	MMP1	44	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP13	48	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP2	27	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP3	50	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP8	28	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP9	30	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	TGM2	40	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP7	43	42
CC[C@@H](NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027005	GF	On-Demand	Anodyne	MMP1	44	42
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	HTR1A	71	42
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	DRD2	57	43
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	ADRA1D	72	40
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	ADRA1A	62	40
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	ADRA1B	57	40
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1N1CCC(N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872027021	EH	On-Demand	Anodyne	HTR7	50	40
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	HTR1A	71	42
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	DRD2	57	43
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	ADRA1D	72	40
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	ADRA1A	62	40
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	ADRA1B	57	40
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1N1CCC(N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872027022	EH	On-Demand	Anodyne	HTR7	50	40
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	HTR1A	77	45
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	DRD2	63	45
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	ADRA1D	76	41
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	ADRA1A	65	41
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	ADRA1B	60	41
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	DRD3	58	45
CC[C@@H](CCC(F)(F)F)NC1CCN(c2ccccc2OC)CC1	ZINC000872027031	EI	On-Demand	Anodyne	HTR7	49	44
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872027049	DH	On-Demand	Anodyne	RIR1_HHV11	40	32
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872027049	DH	On-Demand	Anodyne	EPHX2	19	47
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872027049	DH	On-Demand	Anodyne	ETHR	41	37
CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872027065	EE	On-Demand	Anodyne	L3MBTL3	51	35
CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872027067	EE	On-Demand	Anodyne	L3MBTL3	51	35
CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872027070	EE	On-Demand	Anodyne	L3MBTL3	51	35
CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872027073	EE	On-Demand	Anodyne	L3MBTL3	51	35
CCOc1ccc(C(=O)N2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872027076	GH	On-Demand	Anodyne	L3MBTL3	57	34
CCOc1ccc(C(=O)N2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872027079	GH	On-Demand	Anodyne	L3MBTL3	57	34
C[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)c1cccc(O)c1F	ZINC000872027082	EH	On-Demand	Anodyne	DPP7	46	38
C[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)c1cccc(O)c1F	ZINC000872027082	EH	On-Demand	Anodyne	L3MBTL3	49	37
C[C@@H](NCCC(=O)Nc1ccccn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027097	EF	On-Demand	Bother	COLA	83	34
CC[C@@H](NCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872027109	EH	On-Demand	Anodyne	ACHE	49	42
CC[C@@H](NCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872027109	EH	On-Demand	Anodyne	SIGMAR1	55	42
CC[C@@H](NCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872027111	EH	On-Demand	Anodyne	ACHE	49	42
CC[C@@H](NCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872027111	EH	On-Demand	Anodyne	SIGMAR1	55	42
C[C@@H](N[C@@H](CC(=O)N(C)C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027133	FH	On-Demand	Bother	COLA	106	35
COc1cccc(C(=O)NCCN[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872027149	EF	On-Demand	Anodyne	DRD4	58	44
COc1cccc(C(=O)NCCN[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872027150	EF	On-Demand	Anodyne	DRD4	58	44
COc1cccc(C(=O)NCCN[C@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872027151	EF	On-Demand	Anodyne	DRD4	58	44
COc1cccc(C(=O)NCCN[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872027152	EF	On-Demand	Anodyne	DRD4	58	44
CCOc1ccc(C(=O)N2CCC(N[C@@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027173	GI	On-Demand	Anodyne	SLC6A5	34	41
CCOc1ccc(C(=O)N2CCC(N[C@@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027173	GI	On-Demand	Anodyne	EPHX2	26	42
CCOc1ccc(C(=O)N2CCC(N[C@@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027173	GI	On-Demand	Anodyne	L3MBTL3	58	34
CCOc1ccc(C(=O)N2CCC(N[C@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027174	GI	On-Demand	Anodyne	SLC6A5	34	41
CCOc1ccc(C(=O)N2CCC(N[C@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027174	GI	On-Demand	Anodyne	EPHX2	26	42
CCOc1ccc(C(=O)N2CCC(N[C@H](CC)CCC(F)(F)F)CC2)cc1	ZINC000872027174	GI	On-Demand	Anodyne	L3MBTL3	58	34
C[C@@H](N[C@H](CC(=O)N(C)C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027175	FH	On-Demand	Bother	COLA	106	35
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1cc(O)ccc1F	ZINC000872027177	EE	On-Demand	Anodyne	ADRB2	18	43
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1cc(O)ccc1F	ZINC000872027177	EE	On-Demand	Anodyne	ADRB1	24	43
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cc(O)ccc1F	ZINC000872027178	EE	On-Demand	Anodyne	ADRB2	18	43
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cc(O)ccc1F	ZINC000872027178	EE	On-Demand	Anodyne	ADRB1	24	43
C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cccc(O)c1F	ZINC000872027198	FF	On-Demand	Anodyne	ADRB1	26	43
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cccc(O)c1F	ZINC000872027200	FF	On-Demand	Anodyne	ADRB1	26	43
CNC(=O)CCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027217	CD	On-Demand	Bother	COLA	77	32
CNC(=O)CCCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027218	CD	On-Demand	Bother	COLA	77	32
O=C(CCN[C@H]1CCOC2(CCCC2)C1)NCc1cccnc1	ZINC000872027237	DE	On-Demand	Anodyne	NAMPT	43	42
O=C(CCN[C@@H]1CCOC2(CCCC2)C1)NCc1cccnc1	ZINC000872027238	DE	On-Demand	Anodyne	NAMPT	43	42
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027241	EF	On-Demand	Anodyne	ACE	42	36
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027241	EF	On-Demand	Anodyne	SIGMAR1	30	46
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027241	EF	On-Demand	Anodyne	CACNA1B	22	42
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027241	EF	On-Demand	Anodyne	ACE2	45	34
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027241	EF	On-Demand	Anodyne	BIRC2	49	43
CC[C@H](C)NC(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027251	EF	On-Demand	Anodyne	ACE	42	36
CC[C@H](C)NC(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027251	EF	On-Demand	Anodyne	SIGMAR1	30	46
CC[C@H](C)NC(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027251	EF	On-Demand	Anodyne	CACNA1B	22	42
CC[C@H](C)NC(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027251	EF	On-Demand	Anodyne	ACE2	45	34
CC[C@H](C)NC(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027251	EF	On-Demand	Anodyne	BIRC2	49	43
CC[C@H](C)NC(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027255	EF	On-Demand	Anodyne	ACE	42	36
CC[C@H](C)NC(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027255	EF	On-Demand	Anodyne	SIGMAR1	30	46
CC[C@H](C)NC(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027255	EF	On-Demand	Anodyne	CACNA1B	22	42
CC[C@H](C)NC(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027255	EF	On-Demand	Anodyne	ACE2	45	34
CC[C@H](C)NC(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872027255	EF	On-Demand	Anodyne	BIRC2	49	43
CCN(Cc1ccccc1)C(=O)CN[C@@H](C)c1cccc(O)c1F	ZINC000872027259	EG	On-Demand	Anodyne	PDS	34	41
CCN(Cc1ccccc1)C(=O)CN[C@H](C)c1cccc(O)c1F	ZINC000872027262	EG	On-Demand	Anodyne	PDS	34	41
C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027295	FG	On-Demand	Bother	COLA	89	37
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027320	EG	On-Demand	Anodyne	DRD4	58	44
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027320	EG	On-Demand	Anodyne	NQO2	22	41
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027320	EG	On-Demand	Anodyne	CTSS	19	46
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027322	EG	On-Demand	Anodyne	DRD4	58	44
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027322	EG	On-Demand	Anodyne	NQO2	22	41
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1cccc(OC)c1	ZINC000872027322	EG	On-Demand	Anodyne	CTSS	19	46
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027342	FH	On-Demand	Anodyne	SIGMAR1	23	44
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027342	FH	On-Demand	Anodyne	SSTR5	42	35
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027342	FH	On-Demand	Anodyne	MCHR1	15	40
CC[C@H](C)NC(=O)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027347	DF	On-Demand	Bother	COLA	61	31
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027349	FH	On-Demand	Anodyne	SIGMAR1	23	44
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027349	FH	On-Demand	Anodyne	SSTR5	42	35
CC[C@@H](NCC1CCN(Cc2ccc(OC)cc2)CC1)[C@H]1CCCOC1	ZINC000872027349	FH	On-Demand	Anodyne	MCHR1	15	40
CC[C@H](C)NC(=O)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027350	DF	On-Demand	Bother	COLA	61	31
CC[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872027352	EG	On-Demand	Anodyne	L3MBTL3	72	38
CC[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872027354	EG	On-Demand	Anodyne	L3MBTL3	72	38
CC[C@@H](NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872027356	EG	On-Demand	Anodyne	L3MBTL3	72	38
CC[C@@H](NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872027358	EG	On-Demand	Anodyne	L3MBTL3	72	38
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027397	DF	On-Demand	Anodyne	MME	41	37
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027397	DF	On-Demand	Anodyne	ANPEP	20	42
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027397	DF	On-Demand	Anodyne	FURIN	45	35
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027397	DF	On-Demand	Anodyne	AMP1_PLAFQ	48	42
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027397	DF	On-Demand	Anodyne	PDS	57	37
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872027399	DF	On-Demand	Anodyne	MME	41	37
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872027399	DF	On-Demand	Anodyne	ANPEP	20	42
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872027399	DF	On-Demand	Anodyne	FURIN	45	35
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872027399	DF	On-Demand	Anodyne	AMP1_PLAFQ	48	42
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872027399	DF	On-Demand	Anodyne	PDS	57	37
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027401	DF	On-Demand	Anodyne	MME	41	37
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027401	DF	On-Demand	Anodyne	ANPEP	20	42
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027401	DF	On-Demand	Anodyne	FURIN	45	35
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027401	DF	On-Demand	Anodyne	AMP1_PLAFQ	48	42
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCc1ccccc1	ZINC000872027401	DF	On-Demand	Anodyne	PDS	57	37
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	HTR7	18	53
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	BMP1	32	40
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP13	53	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP2	33	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP3	40	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP8	27	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP14	15	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP9	40	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	CA12	15	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	CA9	21	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	MMP1	41	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1	ZINC000872027403	JD	On-Demand	Clean	IDO1	33	50
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	GRIN2B	24	45
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	CCR1	15	40
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	C3AR1	49	46
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	MLNR	17	42
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	EPHX2	17	42
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027465	FH	On-Demand	Anodyne	CCR8	42	34
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	GRIN2B	24	45
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	CCR1	15	40
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	C3AR1	49	46
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	MLNR	17	42
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872027469	FH	On-Demand	Anodyne	CCR8	42	34
O=S(=O)(CCN[C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872027494	FG	On-Demand	Anodyne	PSEN2	50	31
O=S(=O)(CCN[C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872027494	FG	On-Demand	Anodyne	PSEN1	40	31
O=S(=O)(CCN[C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872027495	FG	On-Demand	Anodyne	PSEN2	50	31
O=S(=O)(CCN[C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872027495	FG	On-Demand	Anodyne	PSEN1	40	31
O=C(c1ccncc1)N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027530	EF	On-Demand	Anodyne	L3MBTL3	59	36
O=C(c1ccncc1)N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027532	EF	On-Demand	Anodyne	L3MBTL3	59	36
COCCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027546	FF	On-Demand	Anodyne	DRD2	15	40
COCCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027546	FF	On-Demand	Anodyne	DRD4	42	40
COCCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027546	FF	On-Demand	Anodyne	SIGMAR1	41	40
COCCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027548	FF	On-Demand	Anodyne	DRD2	15	40
COCCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027548	FF	On-Demand	Anodyne	DRD4	42	40
COCCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027548	FF	On-Demand	Anodyne	SIGMAR1	41	40
CCOc1ccc(C(=O)N2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872027561	GH	On-Demand	Anodyne	L3MBTL3	44	35
CCOc1ccc(C(=O)N2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872027565	GH	On-Demand	Anodyne	L3MBTL3	44	35
CC[C@@H](NCC(=O)N1CCCc2ccccc21)[C@H]1CCCOC1	ZINC000872027575	DF	On-Demand	Anodyne	AVPR2	45	38
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027578	DG	On-Demand	Anodyne	ADRB2	32	63
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027578	DG	On-Demand	Anodyne	ADRB1	32	63
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027578	DG	On-Demand	Anodyne	PDS	55	40
CC[C@@H](NCC(=O)N1CCCc2ccccc21)[C@@H]1CCCOC1	ZINC000872027579	DF	On-Demand	Anodyne	AVPR2	45	38
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027581	DG	On-Demand	Anodyne	ADRB2	32	63
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027581	DG	On-Demand	Anodyne	ADRB1	32	63
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1cccc(C)c1	ZINC000872027581	DG	On-Demand	Anodyne	PDS	55	40
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(C)c1	ZINC000872027586	DG	On-Demand	Anodyne	ADRB2	32	63
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(C)c1	ZINC000872027586	DG	On-Demand	Anodyne	ADRB1	32	63
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1cccc(C)c1	ZINC000872027586	DG	On-Demand	Anodyne	PDS	55	40
C[C@@H](NCCS(=O)(=O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027614	FF	On-Demand	Bother	COLA	91	40
CC[C@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027629	DF	On-Demand	Anodyne	TRPV1	16	41
CC[C@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027629	DF	On-Demand	Anodyne	MT-ND1	24	43
CC[C@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027629	DF	On-Demand	Anodyne	DRTS_TRYCR	52	36
CC[C@@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027631	DF	On-Demand	Anodyne	TRPV1	16	41
CC[C@@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027631	DF	On-Demand	Anodyne	MT-ND1	24	43
CC[C@@H](NCc1ccc(OCC(N)=O)c(OC)c1)C(C)(C)CC	ZINC000872027631	DF	On-Demand	Anodyne	DRTS_TRYCR	52	36
C[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)c1cc(O)ccc1F	ZINC000872027638	EH	On-Demand	Anodyne	DPP7	41	42
C[C@H](NCc1ccc(C(=O)N2CCCC2)cc1)c1cc(O)ccc1F	ZINC000872027638	EH	On-Demand	Anodyne	L3MBTL3	47	37
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NCc1ccccc1	ZINC000872027698	EG	On-Demand	Bother	COLA	107	37
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027701	EG	On-Demand	Bother	COLA	107	37
OC1CCN(CCCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027702	FE	On-Demand	Anodyne	ACHE	26	42
OC1CCN(CCCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027702	FE	On-Demand	Anodyne	SIGMAR1	48	38
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NCc1ccccc1	ZINC000872027703	EG	On-Demand	Bother	COLA	107	37
OC1CCN(CCCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027705	FE	On-Demand	Anodyne	ACHE	26	42
OC1CCN(CCCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872027705	FE	On-Demand	Anodyne	SIGMAR1	48	38
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	HTR1A	74	43
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	DRD2	59	43
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	ADRA1D	73	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	ADRA1A	64	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	ADRA1B	58	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	DRD3	50	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@H]1CCCOC1	ZINC000872027717	EG	On-Demand	Anodyne	HTR7	45	39
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	HTR1A	74	43
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	DRD2	59	43
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	ADRA1D	73	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	ADRA1A	64	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	ADRA1B	58	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	DRD3	50	40
CC[C@@H](NC1CCN(c2ccccc2OC)CC1)[C@@H]1CCCOC1	ZINC000872027719	EG	On-Demand	Anodyne	HTR7	45	39
CC[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872027723	EG	On-Demand	Anodyne	EPHX2	20	44
CC[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872027723	EG	On-Demand	Anodyne	L3MBTL3	77	37
CC[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872027729	EG	On-Demand	Anodyne	EPHX2	20	44
CC[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872027729	EG	On-Demand	Anodyne	L3MBTL3	77	37
COC(=O)N1CCC(N[C@H](c2ccc(F)cc2F)C(C)C)CC1	ZINC000872027757	EG	On-Demand	Anodyne	GPR119	20	40
COC(=O)N1CCC(N[C@@H](c2ccc(F)cc2F)C(C)C)CC1	ZINC000872027759	EG	On-Demand	Anodyne	GPR119	20	40
COc1cccc(C(=O)NCCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027786	FF	On-Demand	Bother	DRD4	55	43
COc1cccc(C(=O)NCCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027786	FF	On-Demand	Bother	CTSS	15	45
COc1cccc(C(=O)NCCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027786	FF	On-Demand	Bother	TAAR1	37	51
COc1cccc(C(=O)NCCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027788	FF	On-Demand	Bother	DRD4	55	43
COc1cccc(C(=O)NCCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027788	FF	On-Demand	Bother	CTSS	15	45
COc1cccc(C(=O)NCCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872027788	FF	On-Demand	Bother	TAAR1	37	51
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027836	DF	On-Demand	Anodyne	ADRB2	29	49
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027836	DF	On-Demand	Anodyne	ADRB1	33	49
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027836	DF	On-Demand	Anodyne	ADRB3	19	44
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027844	DF	On-Demand	Anodyne	ADRB2	29	49
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027844	DF	On-Demand	Anodyne	ADRB1	33	49
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cc(O)ccc1F	ZINC000872027844	DF	On-Demand	Anodyne	ADRB3	19	44
O=C(c1ccccc1)N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027873	EG	On-Demand	Anodyne	EPHX2	15	47
O=C(c1ccccc1)N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027873	EG	On-Demand	Anodyne	L3MBTL3	76	37
O=C(c1ccccc1)N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027874	EG	On-Demand	Anodyne	EPHX2	15	47
O=C(c1ccccc1)N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872027874	EG	On-Demand	Anodyne	L3MBTL3	76	37
CC[C@@H](NCCC(=O)N1CCN(c2ccc(F)cc2)CC1)[C@H]1CCCOC1	ZINC000872027919	GF	On-Demand	Anodyne	SSTR1	33	43
CC[C@@H](NCCC(=O)N1CCN(c2ccc(F)cc2)CC1)[C@@H]1CCCOC1	ZINC000872027928	GF	On-Demand	Anodyne	SSTR1	33	43
C[C@H](N[C@H](C)CCN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027951	CF	On-Demand	Bother	COLA	59	32
C[C@@H](CCN(C)C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027953	CF	On-Demand	Bother	COLA	59	32
C[C@@H](CCN(C)C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872027955	CF	On-Demand	Bother	COLA	59	32
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028000	DF	On-Demand	Anodyne	ADRB2	51	50
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028000	DF	On-Demand	Anodyne	ADRB1	59	48
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028000	DF	On-Demand	Anodyne	ADRB3	32	48
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028002	DF	On-Demand	Anodyne	ADRB2	51	50
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028002	DF	On-Demand	Anodyne	ADRB1	59	48
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cccc(O)c1F	ZINC000872028002	DF	On-Demand	Anodyne	ADRB3	32	48
C[C@@H](NCCNS(=O)(=O)c1ccccc1)c1cc(O)ccc1F	ZINC000872028015	EE	On-Demand	Anodyne	TBXA2R	45	36
CC[C@H](N[C@@H](C(=O)N(CC)CC)c1ccccc1)[C@@H]1CCCOC1	ZINC000872028027	EG	On-Demand	Anodyne	NPY2R	29	40
CC[C@H](N[C@H](C(=O)N(CC)CC)c1ccccc1)[C@H]1CCCOC1	ZINC000872028029	EG	On-Demand	Anodyne	NPY2R	29	40
CC[C@H](N[C@@H](C(=O)N(CC)CC)c1ccccc1)[C@H]1CCCOC1	ZINC000872028031	EG	On-Demand	Anodyne	NPY2R	29	40
CC[C@H](N[C@H](C(=O)N(CC)CC)c1ccccc1)[C@@H]1CCCOC1	ZINC000872028033	EG	On-Demand	Anodyne	NPY2R	29	40
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028034	FH	On-Demand	Bother	COLA	40	33
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028034	FH	On-Demand	Bother	L3MBTL3	40	36
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028041	FH	On-Demand	Bother	COLA	40	33
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028041	FH	On-Demand	Bother	L3MBTL3	40	36
CC[C@@H](NCc1cc(C)nc2ccccc12)[C@@H]1CCCOC1	ZINC000872028056	CH	On-Demand	Anodyne	ADAM17	61	40
CC[C@@H](NCc1cc(C)nc2ccccc12)[C@H]1CCCOC1	ZINC000872028057	CH	On-Demand	Anodyne	ADAM17	61	40
CC[C@H](NCc1cc(C)nc2ccccc12)[C@@H]1CCCOC1	ZINC000872028058	CH	On-Demand	Anodyne	ADAM17	61	40
CC[C@H](NCc1cc(C)nc2ccccc12)[C@H]1CCCOC1	ZINC000872028059	CH	On-Demand	Anodyne	ADAM17	61	40
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	GHRHR	40	31
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	GRIN2B	18	46
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	C3AR1	49	46
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	MLNR	27	42
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	EPHX2	23	44
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	CCR8	61	39
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	SFRP1	89	39
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	WNT3	64	38
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872028138	FI	On-Demand	Anodyne	ETHR	65	42
O=C(CCc1ccccc1)N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872028155	FH	On-Demand	Anodyne	C3AR1	43	43
O=C(CCc1ccccc1)N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872028155	FH	On-Demand	Anodyne	PREP	46	37
O=C(CCc1ccccc1)N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872028161	FH	On-Demand	Anodyne	C3AR1	43	43
O=C(CCc1ccccc1)N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872028161	FH	On-Demand	Anodyne	PREP	46	37
COC(=O)N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872028174	DG	On-Demand	Anodyne	GRIN2B	19	40
COC(=O)N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872028176	DG	On-Demand	Anodyne	GRIN2B	19	40
CC[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)C(C)(C)CC	ZINC000872028182	EG	On-Demand	Anodyne	ADRB1	20	43
CC[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)C(C)(C)CC	ZINC000872028186	EG	On-Demand	Anodyne	ADRB1	20	43
COc1cc2c(cc1OC)[C@@H](NCc1ccccc1CO)CCCC2	ZINC000872028230	EH	On-Demand	Anodyne	TACR1	18	43
COc1cc2c(cc1OC)[C@@H](NCc1ccccc1CO)CCCC2	ZINC000872028230	EH	On-Demand	Anodyne	C5AR1	20	41
COCCNS(=O)(=O)c1ccc(CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872028232	GE	On-Demand	Anodyne	TBXA2R	43	34
COCCNS(=O)(=O)c1ccc(CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872028234	GE	On-Demand	Anodyne	TBXA2R	43	34
CC[C@@H](NCC(=O)N1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872028317	EE	On-Demand	Anodyne	ADAM10	36	43
CC[C@@H](NCC(=O)N1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872028319	EE	On-Demand	Anodyne	ADAM10	36	43
CC[C@@H](CCC(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872028351	EH	On-Demand	Anodyne	MAPK14	35	40
CC[C@@H](CCC(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872028351	EH	On-Demand	Anodyne	CCR2	52	40
CC[C@H](CCC(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872028352	EH	On-Demand	Anodyne	MAPK14	35	40
CC[C@H](CCC(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872028352	EH	On-Demand	Anodyne	CCR2	52	40
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1F	ZINC000872028394	EE	On-Demand	Anodyne	ADRB2	24	43
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1F	ZINC000872028394	EE	On-Demand	Anodyne	ADRB1	21	43
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1F	ZINC000872028395	EE	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1F	ZINC000872028395	EE	On-Demand	Anodyne	ADRB1	21	43
C[C@@H](NC[C@@H]1CCCN1C)c1cc(O)ccc1F	ZINC000872028399	CE	On-Demand	Anodyne	CHRNA10	63	43
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)CN1CCCC1)CCCC2	ZINC000872028428	EF	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)CN1CCCC1)CCCC2	ZINC000872028431	EF	On-Demand	Anodyne	SLC18A2	49	35
CCOc1ccc(C(=O)N2CCC(N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872028452	GH	On-Demand	Anodyne	L3MBTL3	40	33
CCOc1ccc(C(=O)N2CCC(N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872028453	GH	On-Demand	Anodyne	L3MBTL3	40	33
CCOc1ccc(C(=O)N2CCC(N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872028455	GH	On-Demand	Anodyne	L3MBTL3	40	33
CCOc1ccc(C(=O)N2CCC(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872028457	GH	On-Demand	Anodyne	L3MBTL3	40	33
CC[C@H](C)NC(=O)CCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872028502	EG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@H](C)NC(=O)CCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872028503	EG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@@H](CCC(F)(F)F)NCC(=O)NCc1ccccc1	ZINC000872028545	DG	On-Demand	Anodyne	MME	20	42
CC[C@@H](CCC(F)(F)F)NCC(=O)NCc1ccccc1	ZINC000872028545	DG	On-Demand	Anodyne	PDS	69	39
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872028568	DF	On-Demand	Anodyne	ANPEP	24	43
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872028568	DF	On-Demand	Anodyne	FURIN	40	34
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872028568	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	43
C[C@H](N[C@H](C)C(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872028568	DF	On-Demand	Anodyne	PDS	55	38
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872028616	FG	On-Demand	Anodyne	GRIN2B	16	44
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872028616	FG	On-Demand	Anodyne	C3AR1	51	49
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872028616	FG	On-Demand	Anodyne	CCR8	48	36
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872028619	FG	On-Demand	Anodyne	GRIN2B	16	44
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872028619	FG	On-Demand	Anodyne	C3AR1	51	49
CC[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872028619	FG	On-Demand	Anodyne	CCR8	48	36
CC[C@H](CCC(F)(F)F)N[C@H](C)Cn1cncn1	ZINC000872028640	CE	On-Demand	Anodyne	HIS3	50	35
CC[C@@H](CCC(F)(F)F)N[C@@H](C)Cn1cncn1	ZINC000872028641	CE	On-Demand	Anodyne	HIS3	50	35
CC[C@H](CCC(F)(F)F)N[C@@H](C)Cn1cncn1	ZINC000872028642	CE	On-Demand	Anodyne	HIS3	50	35
CC[C@@H](CCC(F)(F)F)N[C@H](C)Cn1cncn1	ZINC000872028643	CE	On-Demand	Anodyne	HIS3	50	35
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	HTR1A	21	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	DRD4	52	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	HTR2A	17	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	DRD3	16	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	HTR7	34	46
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	MMP13	40	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1	ZINC000872028672	JF	On-Demand	Clean	MMP2	21	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1CO	ZINC000872028700	EH	On-Demand	Bother	COLA	33	42
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1CO	ZINC000872028701	EH	On-Demand	Bother	COLA	33	42
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028702	DF	On-Demand	Anodyne	ADRB2	33	52
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028702	DF	On-Demand	Anodyne	ADRB1	36	52
C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028702	DF	On-Demand	Anodyne	ADRB3	15	41
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028703	DF	On-Demand	Anodyne	ADRB2	33	52
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028703	DF	On-Demand	Anodyne	ADRB1	36	52
C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cccc(O)c1F	ZINC000872028703	DF	On-Demand	Anodyne	ADRB3	15	41
COCCN1CCC(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872028724	FG	On-Demand	Bother	KCNJ1	16	40
COCCN1CCC(N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872028725	FG	On-Demand	Bother	KCNJ1	16	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCCN1C	ZINC000872028730	DG	On-Demand	Bother	CHRNA10	48	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCCN1C	ZINC000872028732	DG	On-Demand	Bother	CHRNA10	48	32
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCCN1C	ZINC000872028734	DG	On-Demand	Bother	CHRNA10	48	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCCN1C	ZINC000872028737	DG	On-Demand	Bother	CHRNA10	48	32
CC[C@@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028768	EI	On-Demand	Anodyne	DPP7	45	37
CC[C@@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028768	EI	On-Demand	Anodyne	MLYCD	19	43
CC[C@@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028768	EI	On-Demand	Anodyne	L3MBTL3	58	36
CC[C@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028769	EI	On-Demand	Anodyne	DPP7	45	37
CC[C@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028769	EI	On-Demand	Anodyne	MLYCD	19	43
CC[C@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872028769	EI	On-Demand	Anodyne	L3MBTL3	58	36
O=C(CCN[C@H]1CCOC2(CCCC2)C1)N1CCN(c2ccc(F)cc2)CC1	ZINC000872028770	GF	On-Demand	Anodyne	SSTR1	30	42
O=C(CCN[C@@H]1CCOC2(CCCC2)C1)N1CCN(c2ccc(F)cc2)CC1	ZINC000872028771	GF	On-Demand	Anodyne	SSTR1	30	42
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028798	DF	On-Demand	Anodyne	ADRB2	40	52
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028798	DF	On-Demand	Anodyne	ADRB1	50	52
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028798	DF	On-Demand	Anodyne	ADRB3	31	52
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028800	DF	On-Demand	Anodyne	ADRB2	40	52
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028800	DF	On-Demand	Anodyne	ADRB1	50	52
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872028800	DF	On-Demand	Anodyne	ADRB3	31	52
C[C@@H](NCC(=O)NCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028835	DE	On-Demand	Bother	COLA	67	35
C[C@H](NCC(=O)NCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028836	DE	On-Demand	Bother	COLA	67	35
CCN(Cc1ccccc1)C(=O)CN[C@@H](C)c1cc(O)ccc1F	ZINC000872028849	EG	On-Demand	Anodyne	PDS	26	42
CCN(Cc1ccccc1)C(=O)CN[C@H](C)c1cc(O)ccc1F	ZINC000872028850	EG	On-Demand	Anodyne	PDS	26	42
CCOc1ccc(C(=O)N2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872028859	GH	On-Demand	Anodyne	L3MBTL3	47	35
CCOc1ccc(C(=O)N2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872028860	GH	On-Demand	Anodyne	L3MBTL3	47	35
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028865	GI	On-Demand	Bother	SIGMAR1	15	41
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028865	GI	On-Demand	Bother	C3AR1	46	45
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028865	GI	On-Demand	Bother	MLNR	15	42
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028866	GI	On-Demand	Bother	SIGMAR1	15	41
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028866	GI	On-Demand	Bother	C3AR1	46	45
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028866	GI	On-Demand	Bother	MLNR	15	42
COc1cc2c(cc1OC)[C@@H](NCc1nnnn1-c1ccccc1)CCCC2	ZINC000872028886	GG	On-Demand	Anodyne	TACR1	35	40
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC(C)(C)C	ZINC000872028894	EF	On-Demand	Anodyne	CACNA1B	32	45
C[C@@H](NCCS(=O)(=O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872028992	FF	On-Demand	Bother	COLA	100	38
CC[C@H](C)NC(=O)CCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872029052	EF	On-Demand	Anodyne	ACHE	21	40
CC[C@H](C)NC(=O)CCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872029052	EF	On-Demand	Anodyne	SIGMAR1	26	45
CC[C@H](C)NC(=O)CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872029053	EF	On-Demand	Anodyne	ACHE	21	40
CC[C@H](C)NC(=O)CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872029053	EF	On-Demand	Anodyne	SIGMAR1	26	45
COc1cc2c(cc1OC)[C@@H](NCCCN1CCC(O)CC1)CCCC2	ZINC000872029090	FF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](NCCCN1CCC(O)CC1)CCCC2	ZINC000872029090	FF	On-Demand	Anodyne	SIGMAR1	16	45
CC[C@@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872029097	FG	On-Demand	Anodyne	MLYCD	20	46
CC[C@H](CCC(F)(F)F)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872029098	FG	On-Demand	Anodyne	MLYCD	20	46
CC[C@@H](NCCC(=O)N1CCCc2ccccc21)[C@@H]1CCCOC1	ZINC000872029118	EG	On-Demand	Anodyne	AVPR2	42	37
CC[C@@H](NCCC(=O)N1CCCc2ccccc21)[C@H]1CCCOC1	ZINC000872029120	EG	On-Demand	Anodyne	AVPR2	42	37
C[C@@H](NCCn1cncn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029121	CD	On-Demand	Bother	HIS3	42	31
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	MME	56	38
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	ANPEP	31	43
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	FURIN	45	37
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	ACE2	41	36
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029127	DG	On-Demand	Anodyne	PDS	71	38
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	MME	56	38
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	ANPEP	31	43
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	FURIN	45	37
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	ACE2	41	36
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872029128	DG	On-Demand	Anodyne	PDS	71	38
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	MME	56	38
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	ANPEP	31	43
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	FURIN	45	37
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	ACE2	41	36
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029129	DG	On-Demand	Anodyne	PDS	71	38
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	MME	56	38
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	ANPEP	31	43
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	FURIN	45	37
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	ACE2	41	36
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCc1ccccc1	ZINC000872029130	DG	On-Demand	Anodyne	PDS	71	38
COc1cc2c(cc1OC)[C@@H](NCc1ccc(OCC(N)=O)cc1)CCCC2	ZINC000872029167	GG	On-Demand	Anodyne	HCRTR1	16	42
CC[C@H](CCC(F)(F)F)NCc1ccc(NS(C)(=O)=O)cc1	ZINC000872029169	EG	On-Demand	Anodyne	TRPV1	19	45
CC[C@@H](CCC(F)(F)F)NCc1ccc(NS(C)(=O)=O)cc1	ZINC000872029170	EG	On-Demand	Anodyne	TRPV1	19	45
C[C@@H](NCC(=O)N1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029211	DD	On-Demand	Bother	COLA	59	31
C[C@H](NCC(=O)N1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029212	DD	On-Demand	Bother	COLA	59	31
CC[C@@H](CC1CCCCC1)N[C@H](C)Cn1cncn1	ZINC000872029228	CG	On-Demand	Anodyne	HIS3	46	41
CC[C@@H](CC1CCCCC1)N[C@@H](C)Cn1cncn1	ZINC000872029230	CG	On-Demand	Anodyne	HIS3	46	41
CCN(CC)C(=O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029280	CE	On-Demand	Bother	COLA	104	35
CCN(CC)C(=O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029281	CE	On-Demand	Bother	COLA	104	35
COCCN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872029292	DG	On-Demand	Anodyne	HTR1A	15	42
COCCN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872029292	DG	On-Demand	Anodyne	HTR7	20	42
COCCN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872029293	DG	On-Demand	Anodyne	HTR1A	15	42
COCCN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872029293	DG	On-Demand	Anodyne	HTR7	20	42
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	CCR2	19	41
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	EPHX2	35	42
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	CCR8	57	39
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	SFRP1	124	45
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	WNT3	81	37
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	L3MBTL3	75	35
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872029326	EI	On-Demand	Anodyne	ETHR	49	38
CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872029359	EE	On-Demand	Anodyne	ITGAL	40	31
CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872029363	EE	On-Demand	Anodyne	ITGAL	40	31
CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)[C@H]1CCCOC1	ZINC000872029366	EE	On-Demand	Anodyne	ITGAL	40	31
CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)[C@@H]1CCCOC1	ZINC000872029370	EE	On-Demand	Anodyne	ITGAL	40	31
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	GRIN2B	50	44
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	MC4R	19	42
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	CCR1	30	45
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	C3AR1	47	45
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	MLNR	18	41
C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029401	FH	On-Demand	Anodyne	CCR8	43	34
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	GRIN2B	50	44
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	MC4R	19	42
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	SIGMAR1	22	40
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	CCR1	30	45
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	C3AR1	47	45
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	MLNR	18	41
C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029403	FH	On-Demand	Anodyne	CCR8	43	34
C[C@H](NC[C@H](CO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029419	EG	On-Demand	Bother	COLA	64	34
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872029421	DE	On-Demand	Anodyne	DRD4	55	41
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872029421	DE	On-Demand	Anodyne	CTSL	18	41
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872029421	DE	On-Demand	Anodyne	MTNR1A	42	39
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872029421	DE	On-Demand	Anodyne	CTSS	17	41
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872029422	DE	On-Demand	Anodyne	DRD4	55	41
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872029422	DE	On-Demand	Anodyne	CTSL	18	41
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872029422	DE	On-Demand	Anodyne	MTNR1A	42	39
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872029422	DE	On-Demand	Anodyne	CTSS	17	41
C[C@@H](NC[C@@H](CO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029423	EG	On-Demand	Bother	COLA	64	34
C[C@@H](NCCCC(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029448	CE	On-Demand	Bother	COLA	98	34
CC[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCOC1	ZINC000872029468	FG	On-Demand	Clean	NPY2R	23	40
CC[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCOC1	ZINC000872029469	FG	On-Demand	Clean	NPY2R	23	40
CC[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCOC1	ZINC000872029470	FG	On-Demand	Clean	NPY2R	23	40
CC[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCOC1	ZINC000872029471	FG	On-Demand	Clean	NPY2R	23	40
CNC(=O)CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872029472	DD	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H](Cn1cncn1)N[C@@H](C)c1cc(O)ccc1F	ZINC000872029491	CD	On-Demand	Anodyne	HIS3	80	35
C[C@@H](Cn1cncn1)N[C@H](C)c1cc(O)ccc1F	ZINC000872029492	CD	On-Demand	Anodyne	HIS3	80	35
C[C@H](N[C@H](C)Cn1cncn1)c1cc(O)ccc1F	ZINC000872029493	CD	On-Demand	Anodyne	HIS3	80	35
CNC(=O)CCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872029526	DF	On-Demand	Anodyne	SLC18A2	46	35
CNC(=O)CCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872029527	DF	On-Demand	Anodyne	SLC18A2	46	35
Fc1ccc2c(CCN[C@H]3CCOC4(CCCC4)C3)c[nH]c2c1	ZINC000872029536	DH	On-Demand	Anodyne	SLC6A4	15	44
Fc1ccc2c(CCN[C@H]3CCOC4(CCCC4)C3)c[nH]c2c1	ZINC000872029536	DH	On-Demand	Anodyne	MPO	81	40
Fc1ccc2c(CCN[C@@H]3CCOC4(CCCC4)C3)c[nH]c2c1	ZINC000872029537	DH	On-Demand	Anodyne	SLC6A4	15	44
Fc1ccc2c(CCN[C@@H]3CCOC4(CCCC4)C3)c[nH]c2c1	ZINC000872029537	DH	On-Demand	Anodyne	MPO	81	40
CC[C@@H](NCCc1c[nH]c2cc(F)ccc12)[C@@H]1CCCOC1	ZINC000872029551	DH	On-Demand	Anodyne	SLC6A4	16	42
CC[C@@H](NCCc1c[nH]c2cc(F)ccc12)[C@@H]1CCCOC1	ZINC000872029551	DH	On-Demand	Anodyne	MPO	80	41
CC[C@@H](NCCc1c[nH]c2cc(F)ccc12)[C@H]1CCCOC1	ZINC000872029552	DH	On-Demand	Anodyne	SLC6A4	16	42
CC[C@@H](NCCc1c[nH]c2cc(F)ccc12)[C@H]1CCCOC1	ZINC000872029552	DH	On-Demand	Anodyne	MPO	80	41
C[C@@H](Cn1cncn1)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029563	CE	On-Demand	Bother	HIS3	65	34
C[C@@H](Cn1cncn1)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029564	CE	On-Demand	Bother	HIS3	65	34
C[C@H](N[C@H](C)Cn1cncn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029565	CE	On-Demand	Bother	HIS3	65	34
FC(F)CN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029570	FG	On-Demand	Anodyne	DRD4	28	40
FC(F)CN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029570	FG	On-Demand	Anodyne	SIGMAR1	33	41
FC(F)CN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029571	FG	On-Demand	Anodyne	DRD4	28	40
FC(F)CN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029571	FG	On-Demand	Anodyne	SIGMAR1	33	41
CCOc1ccc(C(=O)N2CCC(N[C@H](CC)[C@H]3CCCOC3)CC2)cc1	ZINC000872029601	FG	On-Demand	Anodyne	L3MBTL3	58	35
CCOc1ccc(C(=O)N2CCC(N[C@@H](CC)[C@@H]3CCCOC3)CC2)cc1	ZINC000872029602	FG	On-Demand	Anodyne	L3MBTL3	58	35
CCOc1ccc(C(=O)N2CCC(N[C@@H](CC)[C@H]3CCCOC3)CC2)cc1	ZINC000872029603	FG	On-Demand	Anodyne	L3MBTL3	58	35
CCOc1ccc(C(=O)N2CCC(N[C@H](CC)[C@@H]3CCCOC3)CC2)cc1	ZINC000872029604	FG	On-Demand	Anodyne	L3MBTL3	58	35
CC[C@@H](CCC(F)(F)F)NCc1ccc(-n2ccnc2)cc1	ZINC000872029609	DI	On-Demand	Anodyne	CYP2C19	16	40
CC[C@H](CCC(F)(F)F)NCc1ccc(-n2ccnc2)cc1	ZINC000872029610	DI	On-Demand	Anodyne	CYP2C19	16	40
C[C@@H](NCCc1ccc(O)cc1)c1cccc(O)c1F	ZINC000872029652	CG	On-Demand	Anodyne	ADRB3	15	48
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029664	EG	On-Demand	Anodyne	GRIN2B	36	44
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029664	EG	On-Demand	Anodyne	EPHX2	17	42
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029664	EG	On-Demand	Anodyne	SFRP1	79	43
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029664	EG	On-Demand	Anodyne	L3MBTL3	63	36
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029665	EG	On-Demand	Anodyne	GRIN2B	36	44
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029665	EG	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029665	EG	On-Demand	Anodyne	SFRP1	79	43
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872029665	EG	On-Demand	Anodyne	L3MBTL3	63	36
C[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029666	FH	On-Demand	Bother	COLA	63	34
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000872029667	FH	On-Demand	Bother	COLA	63	34
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000872029668	FH	On-Demand	Bother	COLA	63	34
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029719	FH	On-Demand	Anodyne	ADRB2	18	46
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029719	FH	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029720	FH	On-Demand	Anodyne	ADRB2	18	46
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029720	FH	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029721	FH	On-Demand	Anodyne	ADRB2	18	46
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029721	FH	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029722	FH	On-Demand	Anodyne	ADRB2	18	46
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccc(C(F)(F)F)cc1	ZINC000872029722	FH	On-Demand	Anodyne	ADRB1	25	41
COC(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029729	FF	On-Demand	Anodyne	DRD4	39	42
COC(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029729	FF	On-Demand	Anodyne	SIGMAR1	40	46
COC(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029729	FF	On-Demand	Anodyne	MLNR	42	38
COC(=O)N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029729	FF	On-Demand	Anodyne	MCHR1	16	42
COC(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029730	FF	On-Demand	Anodyne	DRD4	39	42
COC(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029730	FF	On-Demand	Anodyne	SIGMAR1	40	46
COC(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029730	FF	On-Demand	Anodyne	MLNR	42	38
COC(=O)N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872029730	FF	On-Demand	Anodyne	MCHR1	16	42
O=C(CN[C@@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872029824	FE	On-Demand	Anodyne	ADAM10	36	42
O=C(CN[C@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872029825	FE	On-Demand	Anodyne	ADAM10	36	42
C[C@@H](NCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029866	CD	On-Demand	Bother	COLA	85	36
COc1cc2c(cc1OC)[C@@H](NCC(=O)N1CCN(C)CC1)CCCC2	ZINC000872029916	FD	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NCC(=O)N1CCN(C)CC1)CCCC2	ZINC000872029916	FD	On-Demand	Anodyne	MTNR1B	18	43
COc1cc2c(cc1OC)[C@@H](NCC(=O)N1CCN(C)CC1)CCCC2	ZINC000872029916	FD	On-Demand	Anodyne	KDM1A	16	41
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)Cn1cncn1	ZINC000872029932	DF	On-Demand	Bother	HIS3	65	33
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)Cn1cncn1	ZINC000872029933	DF	On-Demand	Bother	HIS3	65	33
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)Cn1cncn1	ZINC000872029934	DF	On-Demand	Bother	HIS3	65	33
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)Cn1cncn1	ZINC000872029935	DF	On-Demand	Bother	HIS3	65	33
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000872030014	DF	On-Demand	Bother	COLA	110	35
C[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030015	DF	On-Demand	Bother	COLA	110	35
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000872030016	DF	On-Demand	Bother	COLA	110	35
CCOc1cccc([C@@H](C)N[C@H](C)c2cccc(O)c2F)c1	ZINC000872030047	DI	On-Demand	Anodyne	PDS	60	40
CCOc1cccc([C@@H](C)N[C@@H](C)c2cccc(O)c2F)c1	ZINC000872030048	DI	On-Demand	Anodyne	PDS	60	40
CCOc1cccc([C@H](C)N[C@H](C)c2cccc(O)c2F)c1	ZINC000872030049	DI	On-Demand	Anodyne	PDS	60	40
CCOc1cccc([C@H](C)N[C@@H](C)c2cccc(O)c2F)c1	ZINC000872030050	DI	On-Demand	Anodyne	PDS	60	40
CC[C@H](N[C@H](C(=O)N1CCCCC1)c1ccccc1)[C@@H]1CCCOC1	ZINC000872030081	EH	On-Demand	Anodyne	DPP7	40	35
CC[C@H](N[C@@H](C(=O)N1CCCCC1)c1ccccc1)[C@@H]1CCCOC1	ZINC000872030082	EH	On-Demand	Anodyne	DPP7	40	35
CC[C@H](N[C@@H](C(=O)N1CCCCC1)c1ccccc1)[C@H]1CCCOC1	ZINC000872030083	EH	On-Demand	Anodyne	DPP7	40	35
CC[C@H](N[C@H](C(=O)N1CCCCC1)c1ccccc1)[C@H]1CCCOC1	ZINC000872030084	EH	On-Demand	Anodyne	DPP7	40	35
C[C@@H](Cn1cncn1)N[C@@H](C)c1cccc(O)c1F	ZINC000872030096	CD	On-Demand	Anodyne	HIS3	75	37
C[C@@H](Cn1cncn1)N[C@H](C)c1cccc(O)c1F	ZINC000872030097	CD	On-Demand	Anodyne	HIS3	75	37
C[C@H](N[C@H](C)Cn1cncn1)c1cccc(O)c1F	ZINC000872030098	CD	On-Demand	Anodyne	HIS3	75	37
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	DRD2	57	42
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	ADRA1D	73	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	ADRA1A	64	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	ADRA1B	58	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CCC(N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872030139	EH	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	DRD2	57	42
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	ADRA1D	73	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	ADRA1A	64	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	ADRA1B	58	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CCC(N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872030140	EH	On-Demand	Anodyne	HTR7	43	41
C[C@@H](NCC(=O)N1CCN(C)CC1)c1cc(O)ccc1F	ZINC000872030145	CC	On-Demand	Anodyne	HRH4	17	40
C[C@@H](NCC(=O)N1CCN(C)CC1)c1cc(O)ccc1F	ZINC000872030145	CC	On-Demand	Anodyne	KDM1A	16	40
C[C@H](NCC(=O)N1CCN(C)CC1)c1cc(O)ccc1F	ZINC000872030146	CC	On-Demand	Anodyne	HRH4	17	40
C[C@H](NCC(=O)N1CCN(C)CC1)c1cc(O)ccc1F	ZINC000872030146	CC	On-Demand	Anodyne	KDM1A	16	40
C[C@@H](NCCCCN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030147	CF	On-Demand	Bother	COLA	61	32
C[C@@H](NCCC(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872030183	DF	On-Demand	Anodyne	GRIA1	46	37
C[C@@H](NCCC(=O)NCc1ccccc1)c1cc(O)ccc1F	ZINC000872030183	DF	On-Demand	Anodyne	PDS	52	35
COc1cc2c(cc1OC)[C@@H](NCc1cccc(O)c1)CCCC2	ZINC000872030198	EH	On-Demand	Anodyne	HCRTR1	17	41
CC[C@H](NCc1ccccc1N1CCN(C(C)=O)CC1)[C@H]1CCCOC1	ZINC000872030199	FF	On-Demand	Anodyne	KCNQ2	49	34
CC[C@H](NCc1ccccc1N1CCN(C(C)=O)CC1)[C@@H]1CCCOC1	ZINC000872030200	FF	On-Demand	Anodyne	KCNQ2	49	34
CC[C@@H](NCc1ccccc1N1CCN(C(C)=O)CC1)[C@H]1CCCOC1	ZINC000872030201	FF	On-Demand	Anodyne	KCNQ2	49	34
CC[C@@H](NCc1ccccc1N1CCN(C(C)=O)CC1)[C@@H]1CCCOC1	ZINC000872030202	FF	On-Demand	Anodyne	KCNQ2	49	34
C[C@@H](NCCC(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030207	CD	On-Demand	Bother	COLA	105	35
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	ACE	45	37
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	OPRM1	23	45
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	GHRHR	65	35
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	MME	39	41
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	MC4R	53	42
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	TRY2_BOVIN	60	35
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	TIMP3	47	33
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	PREP	22	48
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030225	FG	On-Demand	Anodyne	ACE2	44	39
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	ACE	45	37
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	OPRM1	23	45
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	GHRHR	65	35
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	MME	39	41
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	MC4R	53	42
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	TRY2_BOVIN	60	35
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	TIMP3	47	33
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	PREP	22	48
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030226	FG	On-Demand	Anodyne	ACE2	44	39
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	ACE	45	37
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	OPRM1	23	45
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	GHRHR	65	35
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	MME	39	41
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	MC4R	53	42
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	TRY2_BOVIN	60	35
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	TIMP3	47	33
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	PREP	22	48
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030227	FG	On-Demand	Anodyne	ACE2	44	39
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	ACE	45	37
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	OPRM1	23	45
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	GHRHR	65	35
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	MME	39	41
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	MC4R	53	42
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	TRY2_BOVIN	60	35
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	TIMP3	47	33
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	PREP	22	48
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCCC1	ZINC000872030228	FG	On-Demand	Anodyne	ACE2	44	39
CO[C@@H](C)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030294	CF	On-Demand	Bother	COLA	53	34
CO[C@@H](C)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030295	CF	On-Demand	Bother	COLA	53	34
COc1cc2c(cc1OC)[C@@H](NCC[C@H](C)OC)CCCC2	ZINC000872030346	DG	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@@H](NCC[C@@H](C)OC)CCCC2	ZINC000872030347	DG	On-Demand	Anodyne	SLC18A2	51	38
CC[C@@H](CCC(F)(F)F)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000872030394	FH	On-Demand	Anodyne	MC4R	41	40
CC[C@@H](CCC(F)(F)F)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000872030394	FH	On-Demand	Anodyne	KCNQ2	65	36
CC[C@H](CCC(F)(F)F)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000872030395	FH	On-Demand	Anodyne	MC4R	41	40
CC[C@H](CCC(F)(F)F)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000872030395	FH	On-Demand	Anodyne	KCNQ2	65	36
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	DRD2	36	44
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	DRD3	34	44
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030396	EH	On-Demand	Anodyne	HTR7	33	44
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	DRD2	36	44
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	DRD3	34	44
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030397	EH	On-Demand	Anodyne	HTR7	33	44
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	DRD2	36	44
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	DRD3	34	44
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872030398	EH	On-Demand	Anodyne	HTR7	33	44
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	DRD2	36	44
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	DRD3	34	44
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872030399	EH	On-Demand	Anodyne	HTR7	33	44
O=C(CCN[C@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872030434	FF	On-Demand	Anodyne	ADAM10	37	41
O=C(CCN[C@@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872030435	FF	On-Demand	Anodyne	ADAM10	37	41
CC[C@@H](CCC(F)(F)F)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000872030446	FF	On-Demand	Anodyne	ETHR	48	35
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030452	EI	On-Demand	Anodyne	HTR1A	48	45
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030452	EI	On-Demand	Anodyne	DRD2	34	45
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030452	EI	On-Demand	Anodyne	DRD4	17	41
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030452	EI	On-Demand	Anodyne	DRD3	31	41
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030452	EI	On-Demand	Anodyne	HTR7	32	41
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030453	EI	On-Demand	Anodyne	HTR1A	48	45
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030453	EI	On-Demand	Anodyne	DRD2	34	45
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030453	EI	On-Demand	Anodyne	DRD4	17	41
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030453	EI	On-Demand	Anodyne	DRD3	31	41
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030453	EI	On-Demand	Anodyne	HTR7	32	41
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030454	EI	On-Demand	Anodyne	HTR1A	48	45
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030454	EI	On-Demand	Anodyne	DRD2	34	45
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030454	EI	On-Demand	Anodyne	DRD4	17	41
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030454	EI	On-Demand	Anodyne	DRD3	31	41
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000872030454	EI	On-Demand	Anodyne	HTR7	32	41
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030455	EI	On-Demand	Anodyne	HTR1A	48	45
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030455	EI	On-Demand	Anodyne	DRD2	34	45
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030455	EI	On-Demand	Anodyne	DRD4	17	41
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030455	EI	On-Demand	Anodyne	DRD3	31	41
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872030455	EI	On-Demand	Anodyne	HTR7	32	41
CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872030470	FG	On-Demand	Anodyne	MC4R	62	43
CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872030470	FG	On-Demand	Anodyne	KCNQ2	60	37
CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cccc(O)c2F)CC1	ZINC000872030471	FG	On-Demand	Anodyne	MC4R	62	43
CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cccc(O)c2F)CC1	ZINC000872030471	FG	On-Demand	Anodyne	KCNQ2	60	37
O[C@@H](CN[C@@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030496	DF	On-Demand	Anodyne	ADRB1	18	47
O[C@@H](CN[C@@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030496	DF	On-Demand	Anodyne	ADRB3	17	41
O[C@@H](CN[C@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030497	DF	On-Demand	Anodyne	ADRB1	18	47
O[C@@H](CN[C@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030497	DF	On-Demand	Anodyne	ADRB3	17	41
O[C@H](CN[C@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030498	DF	On-Demand	Anodyne	ADRB1	18	47
O[C@H](CN[C@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030498	DF	On-Demand	Anodyne	ADRB3	17	41
O[C@H](CN[C@@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030499	DF	On-Demand	Anodyne	ADRB1	18	47
O[C@H](CN[C@@H]1CCCCc2ccccc2C1)COCC1CC1	ZINC000872030499	DF	On-Demand	Anodyne	ADRB3	17	41
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030530	EH	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030530	EH	On-Demand	Anodyne	DRD2	38	46
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030530	EH	On-Demand	Anodyne	ADRA1D	40	38
COc1ccccc1N1CC[C@@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030530	EH	On-Demand	Anodyne	HTR7	40	39
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030531	EH	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030531	EH	On-Demand	Anodyne	DRD2	38	46
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030531	EH	On-Demand	Anodyne	ADRA1D	40	38
COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030531	EH	On-Demand	Anodyne	HTR7	40	39
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030532	EH	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030532	EH	On-Demand	Anodyne	DRD2	38	46
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030532	EH	On-Demand	Anodyne	ADRA1D	40	38
COc1ccccc1N1CC[C@H](CN[C@H](C)c2cccc(O)c2F)C1	ZINC000872030532	EH	On-Demand	Anodyne	HTR7	40	39
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030533	EH	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030533	EH	On-Demand	Anodyne	DRD2	38	46
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030533	EH	On-Demand	Anodyne	ADRA1D	40	38
COc1ccccc1N1CC[C@H](CN[C@@H](C)c2cccc(O)c2F)C1	ZINC000872030533	EH	On-Demand	Anodyne	HTR7	40	39
C[C@@H](NCCNC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872030541	EF	On-Demand	Bother	COLA	88	40
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	ACE	74	42
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	GHRHR	53	32
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	MME	70	42
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	MC4R	47	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	TRY2_BOVIN	67	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	CYSP_TRYCR	22	40
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	PREP	24	47
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	REN	46	45
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	ACE2	62	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030542	EG	On-Demand	Anodyne	ST14	43	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	ACE	74	42
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	GHRHR	53	32
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	MME	70	42
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	MC4R	47	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	TRY2_BOVIN	67	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	CYSP_TRYCR	22	40
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	PREP	24	47
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	REN	46	45
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	ACE2	62	36
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@@H]1CCCOC1	ZINC000872030543	EG	On-Demand	Anodyne	ST14	43	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	ACE	74	42
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	GHRHR	53	32
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	MME	70	42
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	MC4R	47	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	TRY2_BOVIN	67	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	CYSP_TRYCR	22	40
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	PREP	24	47
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	REN	46	45
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	ACE2	62	36
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030544	EG	On-Demand	Anodyne	ST14	43	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	ACE	74	42
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	GHRHR	53	32
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	MME	70	42
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	MC4R	47	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	TRY2_BOVIN	67	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	CYSP_TRYCR	22	40
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	PREP	24	47
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	REN	46	45
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	ACE2	62	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)[C@H]1CCCOC1	ZINC000872030545	EG	On-Demand	Anodyne	ST14	43	34
C[C@@H](NCCC(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872030580	DF	On-Demand	Anodyne	AMP1_PLAFQ	40	36
C[C@@H](NCCC(=O)NCc1ccccc1)c1cccc(O)c1F	ZINC000872030580	DF	On-Demand	Anodyne	PDS	54	37
CC[C@@H](NC1CCN(C(=O)c2ccc(C)cc2)CC1)[C@H]1CCCOC1	ZINC000872030653	EG	On-Demand	Anodyne	L3MBTL3	76	37
CC[C@@H](NC1CCN(C(=O)c2ccc(C)cc2)CC1)[C@@H]1CCCOC1	ZINC000872030664	EG	On-Demand	Anodyne	L3MBTL3	76	37
C[C@@H](NCCC(=O)N1CCCCCC1)c1cccc(O)c1F	ZINC000872030689	DF	On-Demand	Anodyne	DPP7	49	37
NC(=O)C1CCN(c2ncccc2CN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872030715	GG	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872030715	GG	On-Demand	Anodyne	SCN10A	18	41
NC(=O)C1CCN(c2ncccc2CN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872030716	GG	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872030716	GG	On-Demand	Anodyne	SCN10A	18	41
C[C@H](NC[C@H](O)COCC1CC1)c1cccc(O)c1F	ZINC000872030782	CD	On-Demand	Anodyne	ADRB2	17	48
C[C@H](NC[C@H](O)COCC1CC1)c1cccc(O)c1F	ZINC000872030782	CD	On-Demand	Anodyne	ADRB1	16	48
C[C@@H](NC[C@@H](O)COCC1CC1)c1cccc(O)c1F	ZINC000872030785	CD	On-Demand	Anodyne	ADRB2	17	48
C[C@@H](NC[C@@H](O)COCC1CC1)c1cccc(O)c1F	ZINC000872030785	CD	On-Demand	Anodyne	ADRB1	16	48
CC[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)[C@H]1CCCOC1	ZINC000872030825	FH	On-Demand	Anodyne	NAMPT	53	39
CC[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)[C@H]1CCCOC1	ZINC000872030827	FH	On-Demand	Anodyne	NAMPT	53	39
CC[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)[C@@H]1CCCOC1	ZINC000872030829	FH	On-Demand	Anodyne	NAMPT	53	39
CC[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)[C@@H]1CCCOC1	ZINC000872030831	FH	On-Demand	Anodyne	NAMPT	53	39
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)CN1CCN(C)CC1	ZINC000872030847	FF	On-Demand	Bother	KCNJ1	22	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)CN1CCN(C)CC1	ZINC000872030848	FF	On-Demand	Bother	KCNJ1	22	41
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](C)CN1CCN(C)CC1	ZINC000872030849	FF	On-Demand	Bother	KCNJ1	22	41
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](C)CN1CCN(C)CC1	ZINC000872030850	FF	On-Demand	Bother	KCNJ1	22	41
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872030956	EI	On-Demand	Anodyne	GPR119	39	41
C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(O)c1F	ZINC000872030963	FG	On-Demand	Anodyne	MC4R	15	41
C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(O)c1F	ZINC000872030966	FG	On-Demand	Anodyne	MC4R	15	41
CC[C@@H](NCCC(=O)NCc1ccccc1)[C@H]1CCCOC1	ZINC000872031029	DE	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NCCC(=O)NCc1ccccc1)[C@@H]1CCCOC1	ZINC000872031030	DE	On-Demand	Anodyne	PDS	42	34
CC[C@H](C(=O)N1CCC(N[C@H](CC)[C@@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031075	FH	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(N[C@H](CC)[C@@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031075	FH	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C(=O)N1CCC(N[C@@H](CC)[C@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031077	FH	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(N[C@@H](CC)[C@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031077	FH	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C(=O)N1CCC(N[C@@H](CC)[C@@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031079	FH	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(N[C@@H](CC)[C@@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031079	FH	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C(=O)N1CCC(N[C@H](CC)[C@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031081	FH	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(N[C@H](CC)[C@H]2CCCOC2)CC1)c1ccccc1	ZINC000872031081	FH	On-Demand	Anodyne	CCR8	23	40
C[C@H](NC1CCN(CC(F)(F)F)CC1)c1cccc(O)c1F	ZINC000872031102	DG	On-Demand	Anodyne	HPGDS	37	42
C[C@@H](NC1CCN(CC(F)(F)F)CC1)c1cccc(O)c1F	ZINC000872031104	DG	On-Demand	Anodyne	HPGDS	37	42
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N(C)C)c1	ZINC000872031163	GG	On-Demand	Bother	COLA	75	37
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N(C)C)c1	ZINC000872031164	GG	On-Demand	Bother	COLA	75	37
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)CN1CCN(C)CC1)CCCC2	ZINC000872031176	GF	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)CN1CCN(C)CC1)CCCC2	ZINC000872031177	GF	On-Demand	Anodyne	SLC18A2	49	35
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000872031181	FI	On-Demand	Anodyne	L3MBTL3	70	37
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000872031181	FI	On-Demand	Anodyne	ETHR	40	33
CC(=O)Nc1ccc(CCN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872031215	DG	On-Demand	Anodyne	ADRB1	18	44
CC(=O)Nc1ccc(CCN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872031215	DG	On-Demand	Anodyne	ADRB3	24	44
CC(=O)Nc1ccc(CCN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872031216	DG	On-Demand	Anodyne	ADRB1	18	44
CC(=O)Nc1ccc(CCN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872031216	DG	On-Demand	Anodyne	ADRB3	24	44
c1cnc(N2CCN(CCCCN[C@H]3CCOC4(CCCC4)C3)CC2)nc1	ZINC000872031217	FE	On-Demand	Anodyne	HTR1A	18	48
c1cnc(N2CCN(CCCCN[C@@H]3CCOC4(CCCC4)C3)CC2)nc1	ZINC000872031218	FE	On-Demand	Anodyne	HTR1A	18	48
COc1ccccc1N1CC[C@H](CN[C@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872031234	EH	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1N1CC[C@H](CN[C@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872031234	EH	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1N1CC[C@H](CN[C@@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872031235	EH	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1N1CC[C@H](CN[C@@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872031235	EH	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1N1CC[C@H](CN[C@@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872031236	EH	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1N1CC[C@H](CN[C@@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872031236	EH	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1N1CC[C@H](CN[C@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872031237	EH	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1N1CC[C@H](CN[C@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872031237	EH	On-Demand	Anodyne	DRD2	22	43
C[C@@H](NCCC(=O)N1CCCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031238	EG	On-Demand	Bother	COLA	42	32
C[C@@H](NCCC(=O)N1CCCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031238	EG	On-Demand	Bother	DPP7	24	42
C[C@@H](NCC1CCN(S(C)(=O)=O)CC1)c1cccc(O)c1F	ZINC000872031312	ED	On-Demand	Anodyne	HTR4	27	41
CC[C@@H](CCC(F)(F)F)NCCC(=O)N1CCCCCC1	ZINC000872031331	DG	On-Demand	Anodyne	RIR1_HHV11	41	34
CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872031356	FG	On-Demand	Anodyne	MC4R	108	46
CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872031356	FG	On-Demand	Anodyne	KCNQ2	60	38
CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872031356	FG	On-Demand	Anodyne	NPY2R	67	36
CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872031357	FG	On-Demand	Anodyne	MC4R	108	46
CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872031357	FG	On-Demand	Anodyne	KCNQ2	60	38
CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872031357	FG	On-Demand	Anodyne	NPY2R	67	36
CC[C@@H](NCCCCN1CCN(c2ncccn2)CC1)[C@H]1CCCOC1	ZINC000872031376	FE	On-Demand	Anodyne	HTR1A	17	42
CC[C@@H](NCCCCN1CCN(c2ncccn2)CC1)[C@@H]1CCCOC1	ZINC000872031377	FE	On-Demand	Anodyne	HTR1A	17	42
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	HTR1A	61	50
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	DRD2	53	48
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	DRD4	36	48
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	ADRA1D	15	40
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	HTR2A	40	48
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	HTR2C	17	40
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	ADRA1A	19	41
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	DRD3	62	44
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	HTR7	59	39
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cccc(O)c1F	ZINC000872031395	FF	On-Demand	Anodyne	P2RX3	17	41
CC[C@H](C)N(C)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031455	CG	On-Demand	Bother	COLA	42	31
CC[C@H](C)N(C)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031456	CG	On-Demand	Bother	COLA	42	31
c1ccc(CCN2CC[C@@H](CN[C@@H]3CCOC4(CCCC4)C3)C2)cc1	ZINC000872031458	EH	On-Demand	Anodyne	SIGMAR1	23	40
CC[C@@H](CCC(F)(F)F)NCCC(=O)N1CCN(c2ncccn2)CC1	ZINC000872031552	FE	On-Demand	Anodyne	ETHR	48	33
c1ccc(CCN2CC[C@H](CN[C@@H]3CCOC4(CCCC4)C3)C2)cc1	ZINC000872031559	EH	On-Demand	Anodyne	SIGMAR1	23	40
c1ccc(CCN2CC[C@H](CN[C@H]3CCOC4(CCCC4)C3)C2)cc1	ZINC000872031560	EH	On-Demand	Anodyne	SIGMAR1	23	40
c1ccc(CCN2CC[C@@H](CN[C@H]3CCOC4(CCCC4)C3)C2)cc1	ZINC000872031561	EH	On-Demand	Anodyne	SIGMAR1	23	40
CC[C@@H](NCCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872031564	DG	On-Demand	Anodyne	ADRA1D	20	40
CC[C@@H](NCCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872031564	DG	On-Demand	Anodyne	ADRA1A	16	41
CC[C@@H](NCCCOc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872031564	DG	On-Demand	Anodyne	ADRA1B	19	40
CC[C@@H](NCCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872031565	DG	On-Demand	Anodyne	ADRA1D	20	40
CC[C@@H](NCCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872031565	DG	On-Demand	Anodyne	ADRA1A	16	41
CC[C@@H](NCCCOc1ccccc1OC)[C@H]1CCCOC1	ZINC000872031565	DG	On-Demand	Anodyne	ADRA1B	19	40
C[C@@H](NCCCNC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031593	EG	On-Demand	Bother	COLA	56	37
C[C@@H](NCCCN1CCC[C@H]1C(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031607	FE	On-Demand	Bother	COLA	46	31
C[C@@H](NCCCN1CCC[C@@H]1C(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031608	FE	On-Demand	Bother	COLA	46	31
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000872031668	GH	On-Demand	Anodyne	EPHX2	20	41
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000872031668	GH	On-Demand	Anodyne	CCR8	55	36
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000872031668	GH	On-Demand	Anodyne	SFRP1	72	37
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000872031668	GH	On-Demand	Anodyne	WNT3	53	37
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000872031668	GH	On-Demand	Anodyne	ETHR	43	35
C[C@@H](NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872031719	EH	On-Demand	Anodyne	HTR1D	16	43
C[C@@H](NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872031719	EH	On-Demand	Anodyne	OPRM1	16	41
C[C@@H](NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872031719	EH	On-Demand	Anodyne	HTR4	16	43
C[C@@H](NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872031719	EH	On-Demand	Anodyne	SIGMAR1	34	44
C[C@@H](NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872031719	EH	On-Demand	Anodyne	BIRC2	39	40
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCN(C)C1)CCCC2	ZINC000872031754	DF	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C)C1)CCCC2	ZINC000872031755	DF	On-Demand	Anodyne	SLC18A2	47	33
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031774	EH	On-Demand	Anodyne	GPR119	49	52
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031774	EH	On-Demand	Anodyne	SFRP1	30	40
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031774	EH	On-Demand	Anodyne	WNT3	42	34
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031781	EH	On-Demand	Anodyne	GPR119	49	52
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031781	EH	On-Demand	Anodyne	SFRP1	30	40
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872031781	EH	On-Demand	Anodyne	WNT3	42	34
O=C(Nc1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1)c1cccnc1	ZINC000872031831	FH	On-Demand	Anodyne	NAMPT	50	39
O=C(Nc1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1)c1cccnc1	ZINC000872031832	FH	On-Demand	Anodyne	NAMPT	50	39
C[C@@H](NCCC(=O)NCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031871	EG	On-Demand	Bother	COLA	92	37
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	DRD2	20	45
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	ADRA1D	29	41
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	ADRA1A	28	42
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	ADRA1B	27	42
COc1ccccc1N1CC[C@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032077	EH	On-Demand	Anodyne	HTR7	20	41
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	DRD2	20	45
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	ADRA1D	29	41
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	ADRA1A	28	42
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	ADRA1B	27	42
COc1ccccc1N1CC[C@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032078	EH	On-Demand	Anodyne	HTR7	20	41
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	DRD2	20	45
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	ADRA1D	29	41
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	ADRA1A	28	42
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	ADRA1B	27	42
COc1ccccc1N1CC[C@@H](CN[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872032079	EH	On-Demand	Anodyne	HTR7	20	41
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	DRD2	20	45
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	ADRA1D	29	41
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	ADRA1A	28	42
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	ADRA1B	27	42
COc1ccccc1N1CC[C@@H](CN[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872032080	EH	On-Demand	Anodyne	HTR7	20	41
CC[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872032089	FF	On-Demand	Anodyne	SSTR1	40	37
CC[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872032089	FF	On-Demand	Anodyne	ADAM10	36	40
CC[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872032092	FF	On-Demand	Anodyne	SSTR1	40	37
CC[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872032092	FF	On-Demand	Anodyne	ADAM10	36	40
O[C@@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)COCC1CC1	ZINC000872032107	EE	On-Demand	Anodyne	SIGMAR1	15	41
O[C@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)COCC1CC1	ZINC000872032108	EE	On-Demand	Anodyne	SIGMAR1	15	41
O[C@@H](CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)COCC1CC1	ZINC000872032109	EE	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc2c(cc1OC)[C@@H](NCc1ccccc1O)CCCC2	ZINC000872032114	EH	On-Demand	Clean	TACR1	19	42
CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872032214	CE	On-Demand	Anodyne	ACHE	26	40
CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872032214	CE	On-Demand	Anodyne	SIGMAR1	44	40
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032270	EH	On-Demand	Anodyne	GPR119	58	50
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032270	EH	On-Demand	Anodyne	SFRP1	57	41
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032270	EH	On-Demand	Anodyne	WNT3	43	35
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032272	EH	On-Demand	Anodyne	GPR119	58	50
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032272	EH	On-Demand	Anodyne	SFRP1	57	41
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872032272	EH	On-Demand	Anodyne	WNT3	43	35
CC[C@@H](CCC(F)(F)F)NCCC(=O)NCc1ccccc1	ZINC000872032306	DG	On-Demand	Anodyne	PDS	67	38
C[C@@H](NCCc1ccccc1O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872032326	DG	On-Demand	Bother	COLA	124	40
CC[C@@H](CC1CCCCC1)NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872032435	FH	On-Demand	Anodyne	REN	42	35
CC[C@@H](CC1CCCCC1)NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872032435	FH	On-Demand	Anodyne	SIRT3	47	33
CC[C@@H](CC1CCCCC1)NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872032435	FH	On-Demand	Anodyne	SIRT2	44	33
CC[C@@H](CC1CCCCC1)NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872032435	FH	On-Demand	Anodyne	SIRT1	41	33
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	DRD4	33	53
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	LTA4H	16	44
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	SIGMAR1	21	50
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	CCR3	23	41
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	EPHX2	33	41
C/C=C\C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032441	DD	On-Demand	Anodyne	TGM2	27	40
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	DRD4	33	53
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	LTA4H	16	44
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	SIGMAR1	21	50
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	CCR3	23	41
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	EPHX2	33	41
C/C=C/C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872032442	DD	On-Demand	Anodyne	TGM2	27	40
CC(=O)Nc1ccc(CCN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872032482	DG	On-Demand	Anodyne	ADRB1	22	42
CC(=O)Nc1ccc(CCN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872032482	DG	On-Demand	Anodyne	ADRB3	27	42
CC(=O)Nc1ccc(CCN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872032483	DG	On-Demand	Anodyne	ADRB1	22	42
CC(=O)Nc1ccc(CCN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872032483	DG	On-Demand	Anodyne	ADRB3	27	42
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872032508	EI	On-Demand	Anodyne	ACHE	23	43
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872032508	EI	On-Demand	Anodyne	SIGMAR1	31	43
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872032509	EI	On-Demand	Anodyne	ACHE	23	43
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872032509	EI	On-Demand	Anodyne	SIGMAR1	31	43
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872032510	EI	On-Demand	Anodyne	ACHE	23	43
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872032510	EI	On-Demand	Anodyne	SIGMAR1	31	43
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872032511	EI	On-Demand	Anodyne	ACHE	23	43
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872032511	EI	On-Demand	Anodyne	SIGMAR1	31	43
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	HTR1A	61	48
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	DRD2	55	47
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	DRD4	46	47
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	HTR2A	39	47
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	HTR2C	15	41
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	DRD3	65	47
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	HTR7	68	40
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	P2RX3	19	41
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	ABCC1	42	32
C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc(O)ccc1F	ZINC000872032565	FF	On-Demand	Anodyne	HNMT	42	33
CC(=O)Nc1ccc(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872032622	EH	On-Demand	Bother	COLA	100	42
CC(=O)Nc1ccc(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872032623	EH	On-Demand	Bother	COLA	100	42
CC[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032647	EG	On-Demand	Anodyne	SIRT3	40	32
CC[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032647	EG	On-Demand	Anodyne	SIRT2	44	32
CC[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032647	EG	On-Demand	Anodyne	SIRT1	40	32
CC[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032648	EG	On-Demand	Anodyne	SIRT3	40	32
CC[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032648	EG	On-Demand	Anodyne	SIRT2	44	32
CC[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C(C)(C)CC	ZINC000872032648	EG	On-Demand	Anodyne	SIRT1	40	32
C[C@@H](NCCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872032653	DD	On-Demand	Bother	COLA	78	34
COc1cc2c(cc1OC)[C@@H](NCC1CCN(C)CC1)CCCC2	ZINC000872032804	EG	On-Demand	Anodyne	SLC18A2	49	34
CC[C@@H](CCC(F)(F)F)NCCCN1CCC[C@@H](C(N)=O)C1	ZINC000872032871	DE	On-Demand	Anodyne	SLC6A1	45	32
CC[C@@H](CCC(F)(F)F)NCCCN1CCC[C@H](C(N)=O)C1	ZINC000872032873	DE	On-Demand	Anodyne	SLC6A1	45	32
C[C@H](NCc1ccc(CN2CCC(O)CC2)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872032902	GH	On-Demand	Bother	SIGMAR1	23	45
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C3CC3)C1)CCCC2	ZINC000872032936	EG	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCN(C3CC3)C1)CCCC2	ZINC000872032937	EG	On-Demand	Anodyne	SLC18A2	49	34
CN1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872032972	EF	On-Demand	Anodyne	HTR1A	28	47
CN1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872032972	EF	On-Demand	Anodyne	DRD2	17	40
CN1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872032972	EF	On-Demand	Anodyne	DRD3	15	40
CN1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872032972	EF	On-Demand	Anodyne	HNMT	49	34
CN1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872032973	EF	On-Demand	Anodyne	HTR1A	28	47
CN1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872032973	EF	On-Demand	Anodyne	DRD2	17	40
CN1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872032973	EF	On-Demand	Anodyne	DRD3	15	40
CN1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872032973	EF	On-Demand	Anodyne	HNMT	49	34
C[C@H](NCc1ccc(F)c(CN(C)C)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033038	EH	On-Demand	Bother	COLA	95	34
c1ccc(CN2C[C@H]3CC[C@@H](NC4CCN(C[C@@H]5CCCO5)CC4)[C@H]3C2)cc1	ZINC000872033045	GG	On-Demand	Anodyne	SIGMAR1	27	40
c1ccc(CN2C[C@H]3CC[C@H](NC4CCN(C[C@H]5CCCO5)CC4)[C@H]3C2)cc1	ZINC000872033046	GG	On-Demand	Anodyne	SIGMAR1	27	40
c1ccc(CN2C[C@H]3CC[C@@H](NC4CCN(C[C@H]5CCCO5)CC4)[C@H]3C2)cc1	ZINC000872033047	GG	On-Demand	Anodyne	SIGMAR1	27	40
c1ccc(CN2C[C@H]3CC[C@H](NC4CCN(C[C@@H]5CCCO5)CC4)[C@H]3C2)cc1	ZINC000872033048	GG	On-Demand	Anodyne	SIGMAR1	27	40
CCOc1cc(CN[C@@H](CC)[C@@H]2CCCOC2)ccc1OC	ZINC000872033055	DG	On-Demand	Anodyne	SSTR5	41	39
CCOc1cc(CN[C@@H](CC)[C@H]2CCCOC2)ccc1OC	ZINC000872033056	DG	On-Demand	Anodyne	SSTR5	41	39
CCOc1cc(CN[C@H](CC)[C@@H]2CCCOC2)ccc1OC	ZINC000872033057	DG	On-Demand	Anodyne	SSTR5	41	39
CCOc1cc(CN[C@H](CC)[C@H]2CCCOC2)ccc1OC	ZINC000872033058	DG	On-Demand	Anodyne	SSTR5	41	39
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033104	GJ	On-Demand	Anodyne	FLT1	24	40
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033104	GJ	On-Demand	Anodyne	ROCK2	27	45
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033104	GJ	On-Demand	Anodyne	NAMPT	40	36
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033104	GJ	On-Demand	Anodyne	PDS	41	33
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033109	GJ	On-Demand	Anodyne	FLT1	24	40
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033109	GJ	On-Demand	Anodyne	ROCK2	27	45
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033109	GJ	On-Demand	Anodyne	NAMPT	40	36
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000872033109	GJ	On-Demand	Anodyne	PDS	41	33
C[C@@H](NCC1(C(=O)N(C)C)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033133	EG	On-Demand	Bother	COLA	85	33
C=CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033134	EG	On-Demand	Mild	DRD4	25	40
C=CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033134	EG	On-Demand	Mild	SIGMAR1	34	40
C=CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033135	EG	On-Demand	Mild	DRD4	25	40
C=CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033135	EG	On-Demand	Mild	SIGMAR1	34	40
COc1cc2c(cc1OC)[C@@H](NCC1CCN(C(C)=O)CC1)CCCC2	ZINC000872033140	FG	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](NCC1CCN(C(C)=O)CC1)CCCC2	ZINC000872033140	FG	On-Demand	Anodyne	MTNR1B	18	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	DRD4	43	36
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	HTR7	20	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	MMP13	47	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	TRY2_BOVIN	40	35
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	CCR1	28	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	MMP2	24	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	MMP9	38	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	MMP12	15	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	MMP1	39	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	SFRP1	90	38
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1	ZINC000872033199	JF	On-Demand	Clean	WNT3	52	38
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1cccc(O)c1F	ZINC000872033249	EG	On-Demand	Anodyne	MME	21	41
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1cccc(O)c1F	ZINC000872033249	EG	On-Demand	Anodyne	ECE1	41	41
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1cccc(O)c1F	ZINC000872033251	EG	On-Demand	Anodyne	MME	21	41
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1cccc(O)c1F	ZINC000872033251	EG	On-Demand	Anodyne	ECE1	41	41
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033268	FG	On-Demand	Bother	TACR1	22	42
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033268	FG	On-Demand	Bother	NMBR	62	33
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033270	FG	On-Demand	Bother	TACR1	22	42
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033270	FG	On-Demand	Bother	NMBR	62	33
Fc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033371	DH	On-Demand	Anodyne	HTR1A	16	45
Fc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033371	DH	On-Demand	Anodyne	SLC6A4	27	49
Fc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033371	DH	On-Demand	Anodyne	MPO	104	50
Fc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033372	DH	On-Demand	Anodyne	HTR1A	16	45
Fc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033372	DH	On-Demand	Anodyne	SLC6A4	27	49
Fc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872033372	DH	On-Demand	Anodyne	MPO	104	50
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)N1CCN(C)CC1	ZINC000872033405	FF	On-Demand	Bother	KCNJ1	16	44
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)N1CCN(C)CC1	ZINC000872033406	FF	On-Demand	Bother	KCNJ1	16	44
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](C)N1CCN(C)CC1	ZINC000872033407	FF	On-Demand	Bother	KCNJ1	16	44
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](C)N1CCN(C)CC1	ZINC000872033408	FF	On-Demand	Bother	KCNJ1	16	44
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033410	EF	On-Demand	Anodyne	ADRB2	31	49
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033410	EF	On-Demand	Anodyne	ADRB1	38	49
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033410	EF	On-Demand	Anodyne	ADRB3	23	49
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033412	EF	On-Demand	Anodyne	ADRB2	31	49
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033412	EF	On-Demand	Anodyne	ADRB1	38	49
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cc(O)ccc1F	ZINC000872033412	EF	On-Demand	Anodyne	ADRB3	23	49
O=C(NCCN[C@H]1CCOC2(CCCC2)C1)c1ccccc1Cl	ZINC000872033514	EG	On-Demand	Anodyne	HCN1	42	31
O=C(NCCN[C@H]1CCOC2(CCCC2)C1)c1ccccc1Cl	ZINC000872033514	EG	On-Demand	Anodyne	HCN4	40	31
O=C(NCCN[C@@H]1CCOC2(CCCC2)C1)c1ccccc1Cl	ZINC000872033515	EG	On-Demand	Anodyne	HCN1	42	31
O=C(NCCN[C@@H]1CCOC2(CCCC2)C1)c1ccccc1Cl	ZINC000872033515	EG	On-Demand	Anodyne	HCN4	40	31
CCC[C@@H](O)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872033552	DG	On-Demand	Anodyne	SLC18A2	48	34
CCC[C@H](O)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872033554	DG	On-Demand	Anodyne	SLC18A2	48	34
CCC[C@H](O)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872033556	DG	On-Demand	Anodyne	SLC18A2	48	34
CCC[C@@H](O)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872033558	DG	On-Demand	Anodyne	SLC18A2	48	34
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	MME	89	38
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	ANPEP	46	35
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	CTSB	36	41
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	PAPA1_CARPA	47	41
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	CTSF	45	36
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	CTSK	17	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	CTSL	23	41
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	ACE2	52	38
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033560	EG	On-Demand	Anodyne	CTRB_BOVIN	46	32
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	MME	89	38
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	ANPEP	46	35
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	CTSB	36	41
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	PAPA1_CARPA	47	41
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	CTSF	45	36
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	CTSK	17	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	CTSL	23	41
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	ACE2	52	38
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033564	EG	On-Demand	Anodyne	CTRB_BOVIN	46	32
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	MME	89	38
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	ANPEP	46	35
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	CTSB	36	41
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	PAPA1_CARPA	47	41
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	CTSF	45	36
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	CTSK	17	40
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	CTSL	23	41
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	ACE2	52	38
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033566	EG	On-Demand	Anodyne	CTRB_BOVIN	46	32
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	MME	89	38
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	ANPEP	46	35
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	CTSB	36	41
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	PAPA1_CARPA	47	41
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	CTSF	45	36
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	CTSK	17	40
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	CTSL	23	41
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	ACE2	52	38
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872033568	EG	On-Demand	Anodyne	CTRB_BOVIN	46	32
CN1CCC(N2CC[C@@H](N[C@@H]3CC[C@@H]4CN(Cc5ccccc5)C[C@@H]43)C2)CC1	ZINC000872033583	GF	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](N[C@H]3CC[C@@H]4CN(Cc5ccccc5)C[C@@H]43)C2)CC1	ZINC000872033585	GF	On-Demand	Anodyne	SLC6A5	17	42
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033586	DG	On-Demand	Anodyne	GPR119	43	48
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033586	DG	On-Demand	Anodyne	SFRP1	79	41
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033586	DG	On-Demand	Anodyne	WNT3	52	36
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033587	DG	On-Demand	Anodyne	GPR119	43	48
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033587	DG	On-Demand	Anodyne	SFRP1	79	41
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872033587	DG	On-Demand	Anodyne	WNT3	52	36
CCC(CC)[C@@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033609	CG	On-Demand	Bother	COLA	43	33
CCC(CC)[C@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033615	CG	On-Demand	Bother	COLA	43	33
CCC(CC)[C@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033616	CG	On-Demand	Bother	COLA	43	33
CCC(CC)[C@@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033618	CG	On-Demand	Bother	COLA	43	33
CCC[C@](C)(O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033670	CF	On-Demand	Bother	COLA	53	32
CCC[C@](C)(O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033673	CF	On-Demand	Bother	COLA	53	32
C[C@@H](NC[C@@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033674	CF	On-Demand	Bother	COLA	69	33
C[C@H](NC[C@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033675	CF	On-Demand	Bother	COLA	69	33
CC[C@H](C)[C@](C)(O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033686	CG	On-Demand	Bother	COLA	42	32
CC[C@H](C)[C@@](C)(O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033687	CG	On-Demand	Bother	COLA	42	32
CC[C@H](C)[C@@](C)(O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033688	CG	On-Demand	Bother	COLA	42	32
CC[C@H](C)[C@](C)(O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872033689	CG	On-Demand	Bother	COLA	42	32
C=CCN1CCC(N[C@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872033711	EH	On-Demand	Mild	SLC18A2	47	33
C=CCN1CCC(N[C@@H]2CCCCc3cc(OC)c(OC)cc32)CC1	ZINC000872033712	EH	On-Demand	Mild	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)N(C)C)CCCC2	ZINC000872033725	DG	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)N(C)C)CCCC2	ZINC000872033726	DG	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCN(C)CC1)CCCC2	ZINC000872033741	GG	On-Demand	Anodyne	HTR1A	15	48
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCN(C)CC1)CCCC2	ZINC000872033741	GG	On-Demand	Anodyne	SLC18A2	46	36
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCN(C)CC1)CCCC2	ZINC000872033741	GG	On-Demand	Anodyne	SIGMAR1	15	44
COc1cc2c(cc1OC)[C@@H](NCCCN1CCCN(C)CC1)CCCC2	ZINC000872033741	GG	On-Demand	Anodyne	EHMT2	63	36
N#CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033787	EE	On-Demand	Mild	DRD4	26	40
N#CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033787	EE	On-Demand	Mild	SIGMAR1	32	40
N#CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033788	EE	On-Demand	Mild	DRD4	26	40
N#CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033788	EE	On-Demand	Mild	SIGMAR1	32	40
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	TACR1	25	41
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	CCKAR	41	38
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	GRPR	60	33
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	ECE1	43	39
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	MMP11	52	32
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	CCKBR	45	38
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	GHSR	44	39
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	MMP9	20	42
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033883	EH	On-Demand	Anodyne	MC1R	49	32
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	TACR1	25	41
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	CCKAR	41	38
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	GRPR	60	33
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	ECE1	43	39
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	MMP11	52	32
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	CCKBR	45	38
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	GHSR	44	39
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	MMP9	20	42
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033885	EH	On-Demand	Anodyne	MC1R	49	32
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	TACR1	25	41
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	CCKAR	41	38
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	GRPR	60	33
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	ECE1	43	39
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	MMP11	52	32
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	CCKBR	45	38
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	GHSR	44	39
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	MMP9	20	42
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033887	EH	On-Demand	Anodyne	MC1R	49	32
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	TACR1	25	41
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	CCKAR	41	38
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	GRPR	60	33
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	ECE1	43	39
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	MMP11	52	32
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	CCKBR	45	38
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	GHSR	44	39
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	MMP9	20	42
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000872033890	EH	On-Demand	Anodyne	MC1R	49	32
CN1CCCN(CCCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872033895	FF	On-Demand	Anodyne	SIGMAR1	30	41
CC[C@H](CCC(F)(F)F)NCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872033919	FG	On-Demand	Anodyne	CTSF	42	33
CC[C@@H](CCC(F)(F)F)NCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872033921	FG	On-Demand	Anodyne	CTSF	42	33
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)N1CCN(C)CC1)CCCC2	ZINC000872033969	FF	On-Demand	Anodyne	SLC18A2	51	36
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)N1CCN(C)CC1)CCCC2	ZINC000872033970	FF	On-Demand	Anodyne	SLC18A2	51	36
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034024	EF	On-Demand	Anodyne	MME	80	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034024	EF	On-Demand	Anodyne	PAPA1_CARPA	42	35
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034024	EF	On-Demand	Anodyne	CAPNS1	50	32
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034024	EF	On-Demand	Anodyne	ACE2	54	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034024	EF	On-Demand	Anodyne	FPR1	43	34
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034026	EF	On-Demand	Anodyne	MME	80	37
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034026	EF	On-Demand	Anodyne	PAPA1_CARPA	42	35
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034026	EF	On-Demand	Anodyne	CAPNS1	50	32
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034026	EF	On-Demand	Anodyne	ACE2	54	37
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cccc(O)c1F	ZINC000872034026	EF	On-Demand	Anodyne	FPR1	43	34
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CN(C)CCN1C)CCCC2	ZINC000872034042	EE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CN(C)CCN1C)CCCC2	ZINC000872034045	EE	On-Demand	Anodyne	SLC18A2	47	33
CC[C@@H](CCC(F)(F)F)NCCC(=O)Nc1ccccc1	ZINC000872034104	DH	On-Demand	Anodyne	LTA4H	20	42
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)C(C)C)CCCC2	ZINC000872034110	DG	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)C(C)C)CCCC2	ZINC000872034112	DG	On-Demand	Anodyne	SLC18A2	49	35
NC(=O)[C@H]1CCCN(CCCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872034144	GE	On-Demand	Anodyne	SLC6A1	146	41
NC(=O)[C@@H]1CCCN(CCCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872034145	GE	On-Demand	Anodyne	SLC6A1	146	41
NC(=O)[C@H]1CCCN(CCCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872034146	GE	On-Demand	Anodyne	SLC6A1	146	41
NC(=O)[C@@H]1CCCN(CCCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872034147	GE	On-Demand	Anodyne	SLC6A1	146	41
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872034166	DH	On-Demand	Anodyne	GPR119	29	41
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872034169	DH	On-Demand	Anodyne	GPR119	29	41
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872034170	DH	On-Demand	Anodyne	GPR119	29	41
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872034172	DH	On-Demand	Anodyne	GPR119	29	41
C[C@@H](NC[C@@H](C)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034177	CE	On-Demand	Bother	COLA	82	34
C[C@H](NC[C@H](C)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034178	CE	On-Demand	Bother	COLA	82	34
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])N(C)C	ZINC000872034179	CE	On-Demand	Bother	COLA	82	34
O=C(NCc1ccncc1)Nc1cccc(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872034195	GH	On-Demand	Anodyne	ROCK2	17	42
O=C(NCc1ccncc1)Nc1cccc(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872034198	GH	On-Demand	Anodyne	ROCK2	17	42
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CN1CCN(C)CC1)CCCC2	ZINC000872034212	FF	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CN1CCN(C)CC1)CCCC2	ZINC000872034214	FF	On-Demand	Anodyne	SLC18A2	49	35
C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034225	EH	On-Demand	Bother	COLA	60	36
C[C@H](NC[C@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034244	DF	On-Demand	Bother	COLA	80	35
C[C@@H](NC[C@@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034249	DF	On-Demand	Bother	COLA	80	35
CC[C@@H](CCC(F)(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872034274	FI	On-Demand	Anodyne	SLC6A3	21	43
CC[C@@H](CCC(F)(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872034275	FI	On-Demand	Anodyne	SLC6A3	21	43
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccccc1Cl	ZINC000872034287	EH	On-Demand	Anodyne	ECR	57	39
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccccc1Cl	ZINC000872034289	EH	On-Demand	Anodyne	ECR	57	39
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C3CCN(C)CC3)C1)CCCC2	ZINC000872034339	GG	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCN(C3CCN(C)CC3)C1)CCCC2	ZINC000872034340	GG	On-Demand	Anodyne	SLC18A2	47	33
C[C@@H](NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872034361	GF	On-Demand	Anodyne	ADAMTS4	42	31
C[C@@H](NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872034361	GF	On-Demand	Anodyne	CACNA1I	44	32
C[C@@H](NCC1(O)CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034376	CE	On-Demand	Bother	COLA	45	32
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)[C@H]1CCCOC1	ZINC000872034390	DE	On-Demand	Anodyne	MME	49	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)[C@H]1CCCOC1	ZINC000872034390	DE	On-Demand	Anodyne	TIMP3	44	33
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)[C@@H]1CCCOC1	ZINC000872034391	DE	On-Demand	Anodyne	MME	49	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)[C@@H]1CCCOC1	ZINC000872034391	DE	On-Demand	Anodyne	TIMP3	44	33
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)[C@H]1CCCOC1	ZINC000872034392	DE	On-Demand	Anodyne	MME	49	35
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)[C@H]1CCCOC1	ZINC000872034392	DE	On-Demand	Anodyne	TIMP3	44	33
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)[C@@H]1CCCOC1	ZINC000872034393	DE	On-Demand	Anodyne	MME	49	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)[C@@H]1CCCOC1	ZINC000872034393	DE	On-Demand	Anodyne	TIMP3	44	33
COc1cc2c(cc1OC)[C@@H](NCc1cc(C(C)C)no1)CCCC2	ZINC000872034436	EI	On-Demand	Anodyne	SLC5A7	24	42
C[C@@H](NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872034450	FH	On-Demand	Anodyne	SLC6A3	22	43
C[C@@H](NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872034452	FH	On-Demand	Anodyne	SLC6A3	22	43
C[C@@H](NCC1CCN(CCN(C)C)CC1)c1cccc(O)c1F	ZINC000872034493	DE	On-Demand	Anodyne	HTR4	23	40
C[C@@H](NCC1(C(N)=O)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034506	DE	On-Demand	Bother	COLA	54	32
C[C@@H](N[C@H](CO)Cc1ccccc1)c1cc(O)ccc1F	ZINC000872034591	CF	On-Demand	Anodyne	OPRM1	15	42
C[C@@H](N[C@@H](CO)Cc1ccccc1)c1cc(O)ccc1F	ZINC000872034592	CF	On-Demand	Anodyne	OPRM1	15	42
C[C@@H](NC[C@@H](O)CN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034617	CD	On-Demand	Bother	COLA	88	33
C[C@H](NC[C@H](O)CN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034618	CD	On-Demand	Bother	COLA	88	33
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CN1CCN(C)CC1	ZINC000872034649	FF	On-Demand	Bother	KCNJ1	27	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CN1CCN(C)CC1	ZINC000872034650	FF	On-Demand	Bother	KCNJ1	27	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CN1CCN(C)CC1	ZINC000872034652	FF	On-Demand	Bother	KCNJ1	27	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CN1CCN(C)CC1	ZINC000872034653	FF	On-Demand	Bother	KCNJ1	27	43
OC[C@H]1CCCN1CCCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872034712	FF	On-Demand	Anodyne	SIGMAR1	20	45
OC[C@@H]1CCCN1CCCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872034713	FF	On-Demand	Anodyne	SIGMAR1	20	45
OC[C@H]1CCCN1CCCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872034714	FF	On-Demand	Anodyne	SIGMAR1	20	45
OC[C@@H]1CCCN1CCCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872034715	FF	On-Demand	Anodyne	SIGMAR1	20	45
C[C@@H](N[C@H]1CCN(C2CCN(C)CC2)C1)c1cc(O)ccc1F	ZINC000872034717	DE	On-Demand	Anodyne	SLC6A5	17	43
C[C@H](N[C@@H]1CCN(C2CCN(C)CC2)C1)c1cc(O)ccc1F	ZINC000872034718	DE	On-Demand	Anodyne	SLC6A5	17	43
C[C@@H](NCC1(O)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034731	CF	On-Demand	Bother	COLA	45	32
C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1F	ZINC000872034755	DG	On-Demand	Bother	MMP8	23	40
C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1F	ZINC000872034755	DG	On-Demand	Bother	MMP1	18	40
C[C@@H](NCCCN1CCC[C@@H](C(N)=O)C1)c1cc(O)ccc1F	ZINC000872034774	DD	On-Demand	Anodyne	SLC6A1	139	37
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	HTR1D	33	47
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	NQO2	16	49
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	MPO	64	40
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034813	EH	On-Demand	Anodyne	MTNR1A	25	51
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	HTR1D	33	47
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	NQO2	16	49
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	MPO	64	40
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCN[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034814	EH	On-Demand	Anodyne	MTNR1A	25	51
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	HTR1D	33	47
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	NQO2	16	49
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	MPO	64	40
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@@H](C(C)(C)C)C3)c2c1	ZINC000872034815	EH	On-Demand	Anodyne	MTNR1A	25	51
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	HTR1D	33	47
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	NQO2	16	49
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	MPO	64	40
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCN[C@H]3CCO[C@H](C(C)(C)C)C3)c2c1	ZINC000872034816	EH	On-Demand	Anodyne	MTNR1A	25	51
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872034828	DH	On-Demand	Anodyne	HTR1A	16	43
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872034828	DH	On-Demand	Anodyne	SLC6A4	26	45
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872034828	DH	On-Demand	Anodyne	MPO	103	51
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872034829	DH	On-Demand	Anodyne	HTR1A	16	43
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872034829	DH	On-Demand	Anodyne	SLC6A4	26	45
CC[C@@H](NCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872034829	DH	On-Demand	Anodyne	MPO	103	51
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034863	DG	On-Demand	Anodyne	GPR119	39	50
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034863	DG	On-Demand	Anodyne	SFRP1	45	40
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034863	DG	On-Demand	Anodyne	WNT3	43	35
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034864	DG	On-Demand	Anodyne	GPR119	39	50
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034864	DG	On-Demand	Anodyne	SFRP1	45	40
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872034864	DG	On-Demand	Anodyne	WNT3	43	35
C[C@@H](N[C@H](CO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034875	DG	On-Demand	Bother	COLA	93	33
C[C@@H](NCCCN1CCC[C@H](C(N)=O)C1)c1cc(O)ccc1F	ZINC000872034896	DD	On-Demand	Anodyne	SLC6A1	139	37
CC[C@@](C)(O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034948	CF	On-Demand	Bother	COLA	69	33
CC[C@@](C)(O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034950	CF	On-Demand	Bother	COLA	69	33
C[C@@H](NCC(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035037	CE	On-Demand	Bother	COLA	88	34
C[C@H](NCC(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035039	CE	On-Demand	Bother	COLA	88	34
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872035040	EG	On-Demand	Anodyne	SFRP1	58	36
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872035042	EG	On-Demand	Anodyne	SFRP1	58	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872035044	EG	On-Demand	Anodyne	SFRP1	58	36
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872035045	EG	On-Demand	Anodyne	SFRP1	58	36
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035260	EF	On-Demand	Anodyne	ADRB2	33	48
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035260	EF	On-Demand	Anodyne	ADRB1	33	48
C[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035260	EF	On-Demand	Anodyne	ADRB3	15	43
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035262	EF	On-Demand	Anodyne	ADRB2	33	48
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035262	EF	On-Demand	Anodyne	ADRB1	33	48
C[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1cccc(O)c1F	ZINC000872035262	EF	On-Demand	Anodyne	ADRB3	15	43
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(OC)c1	ZINC000872035322	DG	On-Demand	Anodyne	ADRB2	16	46
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(OC)c1	ZINC000872035322	DG	On-Demand	Anodyne	ADRB3	20	41
CC[C@@H](CCC(F)(F)F)NC[C@H](O)c1cccc(OC)c1	ZINC000872035324	DG	On-Demand	Anodyne	ADRB2	16	46
CC[C@@H](CCC(F)(F)F)NC[C@H](O)c1cccc(OC)c1	ZINC000872035324	DG	On-Demand	Anodyne	ADRB3	20	41
CC[C@H](CCC(F)(F)F)NC[C@H](O)c1cccc(OC)c1	ZINC000872035326	DG	On-Demand	Anodyne	ADRB2	16	46
CC[C@H](CCC(F)(F)F)NC[C@H](O)c1cccc(OC)c1	ZINC000872035326	DG	On-Demand	Anodyne	ADRB3	20	41
CC[C@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(OC)c1	ZINC000872035327	DG	On-Demand	Anodyne	ADRB2	16	46
CC[C@H](CCC(F)(F)F)NC[C@@H](O)c1cccc(OC)c1	ZINC000872035327	DG	On-Demand	Anodyne	ADRB3	20	41
COc1cc2c(cc1OC)[C@@H](NCC[C@@H](C)O)CCCC2	ZINC000872035330	CF	On-Demand	Anodyne	SLC18A2	53	38
COc1cc2c(cc1OC)[C@@H](NCC[C@H](C)O)CCCC2	ZINC000872035342	CF	On-Demand	Anodyne	SLC18A2	53	38
CCOc1cc(CN[C@H](C)c2cccc(O)c2F)ccc1OC	ZINC000872035377	DH	On-Demand	Anodyne	DRTS_TRYCR	43	31
CCOc1cc(CN[C@@H](C)c2cccc(O)c2F)ccc1OC	ZINC000872035378	DH	On-Demand	Anodyne	DRTS_TRYCR	43	31
CN1CCN(C)[C@@H](CN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035388	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCN(C)[C@@H](CN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035390	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCN(C)[C@H](CN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035392	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCN(C)[C@H](CN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035394	DE	On-Demand	Anodyne	CHRNA10	53	37
C[C@@H](N[C@H](CO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035429	DF	On-Demand	Bother	COLA	73	34
C[C@@H](N[C@@H](CO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035430	DF	On-Demand	Bother	COLA	73	34
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	HTR1D	31	47
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	NQO2	18	51
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	MPO	58	39
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	MTNR1A	38	51
COc1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035459	EH	On-Demand	Anodyne	MTNR1B	24	51
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	HTR1D	31	47
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	NQO2	18	51
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	MPO	58	39
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	MTNR1A	38	51
COc1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872035461	EH	On-Demand	Anodyne	MTNR1B	24	51
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)c(F)c1	ZINC000872035503	EG	On-Demand	Anodyne	ADRB2	21	43
CC[C@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)c(F)c1	ZINC000872035503	EG	On-Demand	Anodyne	ADRB1	22	42
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)c(F)c1	ZINC000872035504	EG	On-Demand	Anodyne	ADRB2	21	43
CC[C@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)c(F)c1	ZINC000872035504	EG	On-Demand	Anodyne	ADRB1	22	42
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)c(F)c1	ZINC000872035505	EG	On-Demand	Anodyne	ADRB2	21	43
CC[C@@H](CCC(F)(F)F)NC[C@H](O)COc1ccc(F)c(F)c1	ZINC000872035505	EG	On-Demand	Anodyne	ADRB1	22	42
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)c(F)c1	ZINC000872035506	EG	On-Demand	Anodyne	ADRB2	21	43
CC[C@@H](CCC(F)(F)F)NC[C@@H](O)COc1ccc(F)c(F)c1	ZINC000872035506	EG	On-Demand	Anodyne	ADRB1	22	42
C[C@@H](NCC1(N2CCCC2)CCOCC1)c1cccc(O)c1F	ZINC000872035530	DF	On-Demand	Anodyne	HCN1	50	43
C[C@@H](NCCCN1CCC[C@@H](C(N)=O)C1)c1cccc(O)c1F	ZINC000872035598	DD	On-Demand	Anodyne	SLC6A1	149	40
C[C@@H](NCCCN1CCC[C@H](C(N)=O)C1)c1cccc(O)c1F	ZINC000872035600	DD	On-Demand	Anodyne	SLC6A1	149	40
NC(=O)[C@H]1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035697	EF	On-Demand	Anodyne	HTR1A	24	41
NC(=O)[C@H]1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035697	EF	On-Demand	Anodyne	SLC6A1	152	41
NC(=O)[C@@H]1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035699	EF	On-Demand	Anodyne	HTR1A	24	41
NC(=O)[C@@H]1CCCN(CCCN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872035699	EF	On-Demand	Anodyne	SLC6A1	152	41
NC(=O)[C@H]1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035701	EF	On-Demand	Anodyne	HTR1A	24	41
NC(=O)[C@H]1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035701	EF	On-Demand	Anodyne	SLC6A1	152	41
c1ccc(CN2C[C@H]3CC[C@@H](N[C@@H]4CCN(CCN5CCOCC5)C4)[C@H]3C2)cc1	ZINC000872035702	GD	On-Demand	Anodyne	SIGMAR1	42	39
NC(=O)[C@@H]1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035703	EF	On-Demand	Anodyne	HTR1A	24	41
NC(=O)[C@@H]1CCCN(CCCN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872035703	EF	On-Demand	Anodyne	SLC6A1	152	41
c1ccc(CN2C[C@H]3CC[C@H](N[C@@H]4CCN(CCN5CCOCC5)C4)[C@H]3C2)cc1	ZINC000872035717	GD	On-Demand	Anodyne	SIGMAR1	42	39
c1ccc(CN2C[C@H]3CC[C@@H](N[C@H]4CCN(CCN5CCOCC5)C4)[C@H]3C2)cc1	ZINC000872035720	GD	On-Demand	Anodyne	SIGMAR1	42	39
c1ccc(CN2C[C@H]3CC[C@H](N[C@H]4CCN(CCN5CCOCC5)C4)[C@H]3C2)cc1	ZINC000872035723	GD	On-Demand	Anodyne	SIGMAR1	42	39
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	MME	80	39
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	PAPA1_CARPA	42	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	PYGL	17	46
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	CAPNS1	52	33
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	GRIA1	40	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035731	EF	On-Demand	Anodyne	ACE2	52	36
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	MME	80	39
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	PAPA1_CARPA	42	37
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	PYGL	17	46
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	CAPNS1	52	33
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	GRIA1	40	37
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(O)ccc1F	ZINC000872035733	EF	On-Demand	Anodyne	ACE2	52	36
C[C@@H](NC[C@@H](O)CC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035772	CG	On-Demand	Bother	COLA	51	32
C[C@H](NC[C@H](O)CC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035778	CG	On-Demand	Bother	COLA	51	32
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	ESR1	75	37
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	ESR2	52	38
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	LTA4H	55	46
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	HRH3	56	47
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	PSMB2	43	44
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035790	EG	On-Demand	Anodyne	PSMB1	47	44
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	ESR1	75	37
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	ESR2	52	38
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	LTA4H	55	46
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	HRH3	56	47
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	PSMB2	43	44
CC[C@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035792	EG	On-Demand	Anodyne	PSMB1	47	44
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	ESR1	75	37
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	ESR2	52	38
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	LTA4H	55	46
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	HRH3	56	47
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	PSMB2	43	44
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872035794	EG	On-Demand	Anodyne	PSMB1	47	44
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	ESR1	75	37
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	ESR2	52	38
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	LTA4H	55	46
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	HRH3	56	47
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	PSMB2	43	44
CC[C@@H](NCc1ccc(OCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872035797	EG	On-Demand	Anodyne	PSMB1	47	44
CN(C)C(=O)CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035811	GE	On-Demand	Anodyne	DRD4	34	42
CN(C)C(=O)CCN1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035811	GE	On-Demand	Anodyne	SIGMAR1	34	42
CN(C)C(=O)CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035814	GE	On-Demand	Anodyne	DRD4	34	42
CN(C)C(=O)CCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035814	GE	On-Demand	Anodyne	SIGMAR1	34	42
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CCCN(C)C1)CCCC2	ZINC000872035868	EG	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CCCN(C)C1)CCCC2	ZINC000872035869	EG	On-Demand	Anodyne	SLC18A2	49	34
C[C@@H](NCC1CCN(CCN(C)C)CC1)c1cc(O)ccc1F	ZINC000872035899	DE	On-Demand	Anodyne	CACNA1I	45	33
C[C@@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872035920	GF	On-Demand	Bother	COLA	56	34
C[C@@H](NCC1CCN(C)CC1)c1cc(O)ccc1F	ZINC000872035932	CF	On-Demand	Anodyne	CACNA1I	54	32
CN1CCC(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035944	EF	On-Demand	Anodyne	ACHE	42	39
CN1CCC(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035944	EF	On-Demand	Anodyne	SLC6A3	16	45
CN1CCC(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872035944	EF	On-Demand	Anodyne	SIGMAR1	51	40
CCOc1cc(CN[C@H](C)c2cc(O)ccc2F)ccc1OC	ZINC000872035988	DH	On-Demand	Anodyne	DRTS_TRYCR	46	32
CCOc1cc(CN[C@@H](C)c2cc(O)ccc2F)ccc1OC	ZINC000872035989	DH	On-Demand	Anodyne	DRTS_TRYCR	46	32
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1cc(O)ccc1F	ZINC000872036067	EG	On-Demand	Anodyne	TACR1	23	41
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1cc(O)ccc1F	ZINC000872036069	EG	On-Demand	Anodyne	TACR1	23	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](CO)c1ccccc1	ZINC000872036071	EH	On-Demand	Bother	F2RL3	46	35
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](CO)c1ccccc1	ZINC000872036074	EH	On-Demand	Bother	F2RL3	46	35
CC[C@H](C)[C@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036137	CF	On-Demand	Bother	COLA	44	33
CC[C@H](C)[C@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036138	CF	On-Demand	Bother	COLA	44	33
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@@H]1CCCOC1	ZINC000872036154	DH	On-Demand	Anodyne	HTR1D	31	46
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@@H]1CCCOC1	ZINC000872036154	DH	On-Demand	Anodyne	HTR1B	29	46
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@@H]1CCCOC1	ZINC000872036154	DH	On-Demand	Anodyne	NQO2	15	48
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@@H]1CCCOC1	ZINC000872036154	DH	On-Demand	Anodyne	MTNR1A	31	48
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@@H]1CCCOC1	ZINC000872036154	DH	On-Demand	Anodyne	MTNR1B	17	48
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@H]1CCCOC1	ZINC000872036155	DH	On-Demand	Anodyne	HTR1D	31	46
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@H]1CCCOC1	ZINC000872036155	DH	On-Demand	Anodyne	HTR1B	29	46
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@H]1CCCOC1	ZINC000872036155	DH	On-Demand	Anodyne	NQO2	15	48
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@H]1CCCOC1	ZINC000872036155	DH	On-Demand	Anodyne	MTNR1A	31	48
CC[C@@H](NCCc1c[nH]c2ccc(OC)cc12)[C@H]1CCCOC1	ZINC000872036155	DH	On-Demand	Anodyne	MTNR1B	17	48
NC(=O)C1(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCCC1	ZINC000872036174	EF	On-Demand	Anodyne	NPFFR1	41	37
NC(=O)C1(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCCC1	ZINC000872036175	EF	On-Demand	Anodyne	NPFFR1	41	37
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	HTR1D	50	49
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	HTR1B	41	49
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	NQO2	26	53
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	MPO	85	44
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	MTNR1A	52	54
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	MTNR1B	35	53
COc1ccc2[nH]cc(CCN[C@H](C)c3cccc(O)c3F)c2c1	ZINC000872036228	EH	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	HTR1D	50	49
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	HTR1B	41	49
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	NQO2	26	53
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	MPO	85	44
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	MTNR1A	52	54
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	MTNR1B	35	53
COc1ccc2[nH]cc(CCN[C@@H](C)c3cccc(O)c3F)c2c1	ZINC000872036229	EH	On-Demand	Anodyne	ABCG2	25	41
Cc1ccccc1[C@@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036316	DG	On-Demand	Bother	COLA	66	32
Cc1ccccc1[C@@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036318	DG	On-Demand	Bother	COLA	66	32
CC[C@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872036396	GH	On-Demand	Anodyne	ROCK2	18	41
CC[C@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)[C@H]1CCCOC1	ZINC000872036397	GH	On-Demand	Anodyne	ROCK2	18	41
CC[C@@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)[C@H]1CCCOC1	ZINC000872036398	GH	On-Demand	Anodyne	ROCK2	18	41
CC[C@@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872036399	GH	On-Demand	Anodyne	ROCK2	18	41
CC[C@H](N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H]1CCCOC1	ZINC000872036408	DF	On-Demand	Anodyne	ECE1	41	35
CC[C@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H]1CCCOC1	ZINC000872036409	DF	On-Demand	Anodyne	ECE1	41	35
CC[C@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H]1CCCOC1	ZINC000872036410	DF	On-Demand	Anodyne	ECE1	41	35
CC[C@H](N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H]1CCCOC1	ZINC000872036411	DF	On-Demand	Anodyne	ECE1	41	35
OC[C@@H](Cc1c[nH]c2ccccc12)N[C@H]1CCOC2(CCCC2)C1	ZINC000872036564	EG	On-Demand	Anodyne	NMBR	48	37
OC[C@@H](Cc1c[nH]c2ccccc12)N[C@H]1CCOC2(CCCC2)C1	ZINC000872036564	EG	On-Demand	Anodyne	GHSR	26	41
OC[C@@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCOC2(CCCC2)C1	ZINC000872036565	EG	On-Demand	Anodyne	NMBR	48	37
OC[C@@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCOC2(CCCC2)C1	ZINC000872036565	EG	On-Demand	Anodyne	GHSR	26	41
OC[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCOC2(CCCC2)C1	ZINC000872036566	EG	On-Demand	Anodyne	NMBR	48	37
OC[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCOC2(CCCC2)C1	ZINC000872036566	EG	On-Demand	Anodyne	GHSR	26	41
OC[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCOC2(CCCC2)C1	ZINC000872036567	EG	On-Demand	Anodyne	NMBR	48	37
OC[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCOC2(CCCC2)C1	ZINC000872036567	EG	On-Demand	Anodyne	GHSR	26	41
CC[C@@H](CCC(F)(F)F)N[C@H](CO)Cc1ccccc1	ZINC000872036592	CG	On-Demand	Anodyne	MME	43	39
CC[C@H](CCC(F)(F)F)N[C@H](CO)Cc1ccccc1	ZINC000872036593	CG	On-Demand	Anodyne	MME	43	39
CC[C@@H](CCC(F)(F)F)N[C@@H](CO)Cc1ccccc1	ZINC000872036594	CG	On-Demand	Anodyne	MME	43	39
CC[C@H](CCC(F)(F)F)N[C@@H](CO)Cc1ccccc1	ZINC000872036595	CG	On-Demand	Anodyne	MME	43	39
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(N)=O)CC1)CCCC2	ZINC000872036600	EF	On-Demand	Anodyne	MTNR1B	15	41
CCC[C@@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036645	CF	On-Demand	Bother	COLA	44	31
CCC[C@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036646	CF	On-Demand	Bother	COLA	44	31
CCC[C@@H](O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036647	CF	On-Demand	Bother	COLA	44	31
CCC[C@H](O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036648	CF	On-Demand	Bother	COLA	44	31
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036723	FG	On-Demand	Bother	COLA	112	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036724	FG	On-Demand	Bother	COLA	112	38
c1ccc(CN2C[C@H]3CC[C@H](NCCOCC4CC4)[C@H]3C2)cc1	ZINC000872036857	DF	On-Demand	Anodyne	SIGMAR1	18	47
c1ccc(CN2C[C@H]3CC[C@@H](NCCOCC4CC4)[C@H]3C2)cc1	ZINC000872036858	DF	On-Demand	Anodyne	SIGMAR1	18	47
CC[C@@H](CCC(F)(F)F)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000872036899	GH	On-Demand	Anodyne	SLC6A1	72	32
CC[C@H](CCC(F)(F)F)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000872036900	GH	On-Demand	Anodyne	SLC6A1	72	32
CC[C@@H](CCC(F)(F)F)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000872036901	GH	On-Demand	Anodyne	SLC6A1	72	32
CC[C@H](CCC(F)(F)F)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000872036902	GH	On-Demand	Anodyne	SLC6A1	72	32
CN(C)C(=O)CCN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872036933	FF	On-Demand	Anodyne	HTR7	26	41
CN(C)C(=O)CCN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872036934	FF	On-Demand	Anodyne	HTR7	26	41
CCC[C@@H](O)CN[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872036997	CF	On-Demand	Anodyne	ADRB2	17	40
CCC[C@@H](O)CN[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872036998	CF	On-Demand	Anodyne	ADRB2	17	40
CCC[C@H](O)CN[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872036999	CF	On-Demand	Anodyne	ADRB2	17	40
CCC[C@H](O)CN[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872037000	CF	On-Demand	Anodyne	ADRB2	17	40
COc1cc2c(cc1OC)[C@@H](NCC(C)(C)O)CCCC2	ZINC000872037005	CF	On-Demand	Anodyne	SLC18A2	40	33
COC[C@@H](CCO)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037184	DE	On-Demand	Anodyne	SLC18A2	47	35
COC[C@@H](CCO)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037187	DE	On-Demand	Anodyne	SLC18A2	47	35
C[C@H](N[C@H](C)CCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037190	CE	On-Demand	Bother	COLA	68	32
C[C@@H](CCO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037191	CE	On-Demand	Bother	COLA	68	32
C[C@@H](CCO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037192	CE	On-Demand	Bother	COLA	68	32
C[C@H](CCO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037193	CE	On-Demand	Bother	COLA	68	32
O=C(c1ccccc1)N1CCC(CN[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872037217	FH	On-Demand	Anodyne	L3MBTL3	63	34
O=C(c1ccccc1)N1CCC(CN[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872037218	FH	On-Demand	Anodyne	L3MBTL3	63	34
C[C@@H](NCCNc1ccccn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037280	DF	On-Demand	Bother	COLA	41	34
CC[C@H](CCC(F)(F)F)NCc1cccc(OCC(N)=O)c1	ZINC000872037310	DF	On-Demand	Anodyne	PDS	86	39
CC[C@@H](CCC(F)(F)F)NCc1cccc(OCC(N)=O)c1	ZINC000872037313	DF	On-Demand	Anodyne	PDS	86	39
C[C@@H](NCC1(O)CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037365	DD	On-Demand	Bother	COLA	46	31
CC[C@@H](CCC(F)(F)F)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872037402	FI	On-Demand	Anodyne	GRIN2B	44	38
CC[C@@H](CCC(F)(F)F)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872037402	FI	On-Demand	Anodyne	EPHX2	20	45
CC[C@@H](CCC(F)(F)F)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872037402	FI	On-Demand	Anodyne	SFRP1	59	39
CC[C@@H](CCC(F)(F)F)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872037402	FI	On-Demand	Anodyne	L3MBTL3	60	33
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CCO)CCCC2	ZINC000872037437	CF	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CCO)CCCC2	ZINC000872037440	CF	On-Demand	Anodyne	SLC18A2	51	38
CC(C)[C@H](CCO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037463	CF	On-Demand	Bother	COLA	44	31
CC(C)[C@H](CCO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037464	CF	On-Demand	Bother	COLA	44	31
CC[C@H](CCC(F)(F)F)NCCc1ccccc1[N+](=O)[O-]	ZINC000872037476	DH	On-Demand	Bother	COLA	120	42
CC[C@@H](CCC(F)(F)F)NCCc1ccccc1[N+](=O)[O-]	ZINC000872037477	DH	On-Demand	Bother	COLA	120	42
C[C@@H](NCCN1CCC[C@H]1C)c1cc(O)ccc1F	ZINC000872037535	CF	On-Demand	Anodyne	HRH3	62	37
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CO)CCCC2	ZINC000872037540	CE	On-Demand	Anodyne	SLC18A2	50	37
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037565	GH	On-Demand	Bother	COLA	47	33
CC[C@H](CCO)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037570	DG	On-Demand	Anodyne	SLC18A2	48	35
CC[C@@H](CCO)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037571	DG	On-Demand	Anodyne	SLC18A2	48	35
CC[C@@H](CCO)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037572	DG	On-Demand	Anodyne	SLC18A2	48	35
CC[C@H](CCO)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872037573	DG	On-Demand	Anodyne	SLC18A2	48	35
CC[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872037607	EG	On-Demand	Anodyne	L3MBTL3	66	35
CC[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872037608	EG	On-Demand	Anodyne	L3MBTL3	66	35
C[C@@H](NCC1(N2CCCCC2)CCN(C)CC1)c1cccc(O)c1F	ZINC000872037679	EG	On-Demand	Anodyne	HCN1	70	37
C[C@@H](NCC1(N2CCCCC2)CCN(C)CC1)c1cccc(O)c1F	ZINC000872037679	EG	On-Demand	Anodyne	HCN4	51	36
COc1cccc(O[C@H](C)CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872037692	DH	On-Demand	Anodyne	MTNR1A	17	48
COc1cccc(O[C@H](C)CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872037692	DH	On-Demand	Anodyne	MTNR1B	15	48
COc1cccc(O[C@@H](C)CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872037693	DH	On-Demand	Anodyne	MTNR1A	17	48
COc1cccc(O[C@@H](C)CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872037693	DH	On-Demand	Anodyne	MTNR1B	15	48
COc1cccc(O[C@H](C)CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872037694	DH	On-Demand	Anodyne	MTNR1A	17	48
COc1cccc(O[C@H](C)CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872037694	DH	On-Demand	Anodyne	MTNR1B	15	48
COc1cccc(O[C@@H](C)CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872037695	DH	On-Demand	Anodyne	MTNR1A	17	48
COc1cccc(O[C@@H](C)CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872037695	DH	On-Demand	Anodyne	MTNR1B	15	48
C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1c(F)cccc1[N+](=O)[O-]	ZINC000872037734	EH	On-Demand	Bother	COLA	132	42
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037895	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037895	GG	On-Demand	Anodyne	TGM2	69	39
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037895	GG	On-Demand	Anodyne	F13A1	64	37
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037895	GG	On-Demand	Anodyne	SFRP1	122	42
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037895	GG	On-Demand	Anodyne	WNT3	79	35
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037896	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037896	GG	On-Demand	Anodyne	TGM2	69	39
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037896	GG	On-Demand	Anodyne	F13A1	64	37
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037896	GG	On-Demand	Anodyne	SFRP1	122	42
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872037896	GG	On-Demand	Anodyne	WNT3	79	35
COc1cc2c(cc1OC)[C@@H](NCC1(O)CCN(C)CC1)CCCC2	ZINC000872037962	EF	On-Demand	Anodyne	SLC18A2	48	36
CC[C@H](NCc1cccc(OCC(N)=O)c1)C(C)(C)CC	ZINC000872038101	CF	On-Demand	Anodyne	PDS	83	37
CC[C@@H](NCc1cccc(OCC(N)=O)c1)C(C)(C)CC	ZINC000872038102	CF	On-Demand	Anodyne	PDS	83	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038143	EG	On-Demand	Bother	COLA	77	32
CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038144	EG	On-Demand	Bother	COLA	77	32
CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038145	EG	On-Demand	Bother	COLA	77	32
CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038146	EG	On-Demand	Bother	COLA	77	32
COc1cc2c(cc1OC)[C@@H](NCc1ccn(C(C)C)n1)CCCC2	ZINC000872038180	EI	On-Demand	Anodyne	SLC18A2	42	34
C[C@@H](NCCc1cccc(C(=O)N(C)C)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038240	FG	On-Demand	Bother	COLA	98	34
C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1cccc(O)c1F	ZINC000872038320	DG	On-Demand	Bother	COLA	131	44
CCOc1cc(CCCN[C@@H](CC)[C@@H]2CCCOC2)ccc1OC	ZINC000872038438	EH	On-Demand	Anodyne	SSTR5	40	39
CCOc1cc(CCCN[C@H](CC)[C@@H]2CCCOC2)ccc1OC	ZINC000872038440	EH	On-Demand	Anodyne	SSTR5	40	39
CCOc1cc(CCCN[C@@H](CC)[C@H]2CCCOC2)ccc1OC	ZINC000872038442	EH	On-Demand	Anodyne	SSTR5	40	39
CCOc1cc(CCCN[C@H](CC)[C@H]2CCCOC2)ccc1OC	ZINC000872038444	EH	On-Demand	Anodyne	SSTR5	40	39
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872038497	FH	On-Demand	Anodyne	GRIN2B	75	41
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872038497	FH	On-Demand	Anodyne	CACNA1I	50	34
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872038497	FH	On-Demand	Anodyne	L3MBTL3	47	33
C[C@@H](NCCN1CCC[C@H]1C)c1cccc(O)c1F	ZINC000872038602	CF	On-Demand	Anodyne	HRH3	61	36
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038651	GG	On-Demand	Anodyne	TGM2	69	38
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038651	GG	On-Demand	Anodyne	F13A1	62	36
C[C@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038651	GG	On-Demand	Anodyne	SFRP1	70	39
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038652	GG	On-Demand	Anodyne	TGM2	69	38
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038652	GG	On-Demand	Anodyne	F13A1	62	36
C[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872038652	GG	On-Demand	Anodyne	SFRP1	70	39
COc1cccc(O[C@H](C)CN[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872038656	DH	On-Demand	Anodyne	MTNR1B	16	49
COc1cccc(O[C@H](C)CN[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872038657	DH	On-Demand	Anodyne	MTNR1B	16	49
COc1cccc(O[C@H](C)CN[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872038658	DH	On-Demand	Anodyne	MTNR1B	16	49
COc1cccc(O[C@H](C)CN[C@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872038659	DH	On-Demand	Anodyne	MTNR1B	16	49
C[C@@H](NC[C@@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038695	EH	On-Demand	Bother	COLA	66	31
C[C@H](NC[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872038696	EH	On-Demand	Bother	COLA	66	31
C[C@H]1CCN(CCN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872038893	CF	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCN[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872038894	CF	On-Demand	Anodyne	ESR1	17	40
C[C@@H]1CCN(CCN[C@H](C)c2cc(O)ccc2F)C1	ZINC000872038895	CF	On-Demand	Anodyne	ESR1	17	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](CO)c1ccccc1	ZINC000872038942	EH	On-Demand	Bother	F2RL3	45	35
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](CO)c1ccccc1	ZINC000872038943	EH	On-Demand	Bother	F2RL3	45	35
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](CO)c1ccccc1	ZINC000872038945	EH	On-Demand	Bother	F2RL3	45	35
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](CO)c1ccccc1	ZINC000872038947	EH	On-Demand	Bother	F2RL3	45	35
CC(C)(C)C(=O)NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872039074	EF	On-Demand	Anodyne	ACHE	41	45
CC(C)(C)C(=O)NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872039074	EF	On-Demand	Anodyne	SIGMAR1	38	40
CC(C)(C)C(=O)NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872039075	EF	On-Demand	Anodyne	ACHE	41	45
CC(C)(C)C(=O)NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872039075	EF	On-Demand	Anodyne	SIGMAR1	38	40
C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1cc(O)ccc1F	ZINC000872039114	DG	On-Demand	Bother	COLA	129	41
CC[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872039130	FF	On-Demand	Anodyne	TGM2	46	37
CC[C@@H](NC1CCN(S(=O)(=O)c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872039131	FF	On-Demand	Anodyne	TGM2	46	37
CC[C@@H](NCCCOC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872039222	FH	On-Demand	Anodyne	SIGMAR1	26	50
CC[C@@H](NCCCOC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872039225	FH	On-Demand	Anodyne	SIGMAR1	26	50
Cc1ccccc1[C@H](CO)N[C@H](C)c1cccc(O)c1F	ZINC000872039250	CG	On-Demand	Anodyne	CTSA	41	35
Cc1ccccc1[C@@H](CO)N[C@H](C)c1cccc(O)c1F	ZINC000872039252	CG	On-Demand	Anodyne	CTSA	41	35
Cc1ccccc1[C@@H](CO)N[C@@H](C)c1cccc(O)c1F	ZINC000872039254	CG	On-Demand	Anodyne	CTSA	41	35
Cc1ccccc1[C@H](CO)N[C@@H](C)c1cccc(O)c1F	ZINC000872039256	CG	On-Demand	Anodyne	CTSA	41	35
CC[C@@H](NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000872039402	CF	On-Demand	Bother	COLA	101	34
CC[C@@H](NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000872039403	CF	On-Demand	Bother	COLA	101	34
C[C@@H](N[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872039562	DH	On-Demand	Bother	COLA	94	34
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872039692	GH	On-Demand	Anodyne	EPHX2	15	44
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872039692	GH	On-Demand	Anodyne	TGM2	63	39
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872039692	GH	On-Demand	Anodyne	F13A1	53	37
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872039692	GH	On-Demand	Anodyne	SFRP1	129	47
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872039692	GH	On-Demand	Anodyne	WNT3	86	38
C[C@H](NCc1cc(N(C)C)nc2ccccc12)c1cccc(O)c1F	ZINC000872039772	EH	On-Demand	Anodyne	METG	54	34
c1ccc(NCCCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872039883	CH	On-Demand	Anodyne	ICMT	81	34
c1ccc(NCCCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872039885	CH	On-Demand	Anodyne	ICMT	81	34
C[C@@H](NCC1(O)Cc2ccccc2C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872039943	EF	On-Demand	Bother	COLA	73	34
C[C@@H](N[C@@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872039954	EH	On-Demand	Bother	COLA	77	33
C[C@@H](N[C@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872039955	EH	On-Demand	Bother	COLA	77	33
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	ACE	20	43
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MME	26	41
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	EDNRA	39	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	TACR1	26	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	CCKAR	79	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	BRS3	26	41
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	TIMP3	20	46
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	NMBR	35	45
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MC3R	51	35
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MC5R	64	31
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP2	27	49
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP8	40	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP14	19	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	GRPR	57	31
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	ECE1	59	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP11	53	33
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	CCKBR	76	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	GHSR	58	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP9	26	51
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MC1R	78	37
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	MMP1	21	49
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	NPR	27	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	ADAM12	15	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040006	EF	On-Demand	Anodyne	PSMB8	25	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	ACE	20	43
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MME	26	41
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	EDNRA	39	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	TACR1	26	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	CCKAR	79	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	BRS3	26	41
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	TIMP3	20	46
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	NMBR	35	45
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MC3R	51	35
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MC5R	64	31
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP2	27	49
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP8	40	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP14	19	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	GRPR	57	31
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	ECE1	59	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP11	53	33
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	CCKBR	76	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	GHSR	58	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP9	26	51
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MC1R	78	37
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	MMP1	21	49
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	NPR	27	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	ADAM12	15	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040007	EF	On-Demand	Anodyne	PSMB8	25	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	ACE	20	43
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MME	26	41
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	EDNRA	39	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	TACR1	26	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	CCKAR	79	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	BRS3	26	41
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	TIMP3	20	46
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	NMBR	35	45
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MC3R	51	35
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MC5R	64	31
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP2	27	49
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP8	40	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP14	19	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	GRPR	57	31
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	ECE1	59	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP11	53	33
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	CCKBR	76	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	GHSR	58	42
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP9	26	51
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MC1R	78	37
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	MMP1	21	49
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	NPR	27	40
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	ADAM12	15	47
CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@@H]1CCCOC1	ZINC000872040008	EF	On-Demand	Anodyne	PSMB8	25	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	ACE	20	43
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MME	26	41
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	EDNRA	39	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	TACR1	26	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	CCKAR	79	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	BRS3	26	41
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	TIMP3	20	46
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	NMBR	35	45
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MC3R	51	35
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MC5R	64	31
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP2	27	49
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP8	40	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP14	19	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	GRPR	57	31
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	ECE1	59	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP11	53	33
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	CCKBR	76	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	GHSR	58	42
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP9	26	51
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MC1R	78	37
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	MMP1	21	49
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	NPR	27	40
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	ADAM12	15	47
CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)[C@H]1CCCOC1	ZINC000872040009	EF	On-Demand	Anodyne	PSMB8	25	40
C[C@@H](NCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040043	DG	On-Demand	Bother	COLA	74	35
Cc1ccccc1[C@H](CO)N[C@H](C)c1cc(O)ccc1F	ZINC000872040063	CG	On-Demand	Anodyne	CTSA	43	33
Cc1ccccc1[C@H](CO)N[C@@H](C)c1cc(O)ccc1F	ZINC000872040064	CG	On-Demand	Anodyne	CTSA	43	33
Cc1ccccc1[C@@H](CO)N[C@H](C)c1cc(O)ccc1F	ZINC000872040065	CG	On-Demand	Anodyne	CTSA	43	33
Cc1ccccc1[C@@H](CO)N[C@@H](C)c1cc(O)ccc1F	ZINC000872040066	CG	On-Demand	Anodyne	CTSA	43	33
C[C@H](CCO)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040099	CE	On-Demand	Bother	COLA	60	33
C[C@@H](CCO)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040100	CE	On-Demand	Bother	COLA	60	33
C[C@@H](CCO)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040101	CE	On-Demand	Bother	COLA	60	33
Cc1ccccc1[C@H](CO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040127	DG	On-Demand	Bother	COLA	57	31
Cc1ccccc1[C@@H](CO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040128	DG	On-Demand	Bother	COLA	57	31
Cc1ccccc1[C@@H](CO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040129	DG	On-Demand	Bother	COLA	57	31
Cc1ccccc1[C@H](CO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040130	DG	On-Demand	Bother	COLA	57	31
C[C@@H](NCCC1CCN(CC(F)(F)F)CC1)c1cccc(O)c1F	ZINC000872040149	EH	On-Demand	Anodyne	HPGDS	35	40
CC[C@@H](NCc1csc(-c2ccc(OC)cc2)n1)[C@@H]1CCCOC1	ZINC000872040151	EI	On-Demand	Anodyne	AVPR1B	20	47
CC[C@@H](NCc1csc(-c2ccc(OC)cc2)n1)[C@H]1CCCOC1	ZINC000872040152	EI	On-Demand	Anodyne	AVPR1B	20	47
CC[C@H](NCc1csc(-c2ccc(OC)cc2)n1)[C@@H]1CCCOC1	ZINC000872040153	EI	On-Demand	Anodyne	AVPR1B	20	47
CC[C@H](NCc1csc(-c2ccc(OC)cc2)n1)[C@H]1CCCOC1	ZINC000872040154	EI	On-Demand	Anodyne	AVPR1B	20	47
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872040169	FH	On-Demand	Anodyne	GRIN2B	53	37
C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872040169	FH	On-Demand	Anodyne	L3MBTL3	50	34
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc(O)c1F	ZINC000872040200	FG	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc(O)c1F	ZINC000872040201	FG	On-Demand	Anodyne	SIGMAR1	38	40
CC[C@H](N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1)[C@@H]1CCCOC1	ZINC000872040242	EG	On-Demand	Anodyne	DRD4	15	40
CC[C@H](N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1)[C@H]1CCCOC1	ZINC000872040250	EG	On-Demand	Anodyne	DRD4	15	40
CC[C@H](N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)[C@H]1CCCOC1	ZINC000872040252	EG	On-Demand	Anodyne	DRD4	15	40
CC[C@H](N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)[C@@H]1CCCOC1	ZINC000872040254	EG	On-Demand	Anodyne	DRD4	15	40
COc1cc2c(cc1OC)[C@@H](NCc1cccc(OCC(N)=O)c1)CCCC2	ZINC000872040318	GG	On-Demand	Anodyne	FKBP1A	41	37
COc1cc2c(cc1OC)[C@@H](NCc1cccc(OCC(N)=O)c1)CCCC2	ZINC000872040318	GG	On-Demand	Anodyne	MTNR1B	15	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872040322	FG	On-Demand	Anodyne	CCR3	46	37
CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872040323	FG	On-Demand	Anodyne	CCR3	46	37
CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872040324	FG	On-Demand	Anodyne	CCR3	46	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872040325	FG	On-Demand	Anodyne	CCR3	46	37
CCOC[C@H](O)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872040360	DE	On-Demand	Anodyne	SLC18A2	45	33
CCOC[C@H](O)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872040363	DE	On-Demand	Anodyne	SLC18A2	45	33
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	ACE	20	48
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MME	28	46
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	EDNRB	54	38
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	EDNRA	33	42
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	TACR1	33	48
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MC4R	45	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	CCKAR	113	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	CTSL	25	42
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	BRS3	28	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	NMBR	48	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MC3R	65	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MC5R	61	36
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP2	35	55
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP8	48	55
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP14	25	52
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	GRPR	82	37
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	ECE1	64	47
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	LNPEP	19	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	SSTR3	22	41
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP11	83	38
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	CCKBR	84	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	GHSR	60	47
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP9	32	59
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MC1R	90	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	CTSC	17	48
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP7	21	42
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	MMP1	27	59
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	NPR	30	45
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	ADAM12	17	52
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	SSSIM	26	40
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	KISS1R	72	35
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040475	FH	On-Demand	Anodyne	ERAP2	44	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	ACE	20	48
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MME	28	46
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	EDNRB	54	38
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	EDNRA	33	42
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	TACR1	33	48
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MC4R	45	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	CCKAR	113	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	CTSL	25	42
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	BRS3	28	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	NMBR	48	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MC3R	65	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MC5R	61	36
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP2	35	55
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP8	48	55
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP14	25	52
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	GRPR	82	37
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	ECE1	64	47
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	LNPEP	19	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	SSTR3	22	41
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP11	83	38
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	CCKBR	84	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	GHSR	60	47
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP9	32	59
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MC1R	90	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	CTSC	17	48
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP7	21	42
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	MMP1	27	59
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	NPR	30	45
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	ADAM12	17	52
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	SSSIM	26	40
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	KISS1R	72	35
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC	ZINC000872040477	FH	On-Demand	Anodyne	ERAP2	44	40
NC(=O)[C@@H]1CCC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872040540	EF	On-Demand	Anodyne	SIGMAR1	22	42
C[C@@H](CCCO)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872040541	DF	On-Demand	Anodyne	SIGMAR1	21	43
NC(=O)[C@@H]1CCC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872040544	EF	On-Demand	Anodyne	SIGMAR1	22	42
C[C@@H](CCCO)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872040546	DF	On-Demand	Anodyne	SIGMAR1	21	43
NC(=O)[C@@H]1CCC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872040549	EF	On-Demand	Anodyne	SIGMAR1	22	42
NC(=O)[C@@H]1CCC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872040556	EF	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040605	EG	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040605	EG	On-Demand	Anodyne	DRD2	17	42
COc1ccccc1N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040605	EG	On-Demand	Anodyne	ADRA1D	36	40
COc1ccccc1N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040605	EG	On-Demand	Anodyne	ADRA1A	29	42
COc1ccccc1N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040605	EG	On-Demand	Anodyne	ADRA1B	31	42
COc1ccccc1N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040608	EG	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040608	EG	On-Demand	Anodyne	DRD2	17	42
COc1ccccc1N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040608	EG	On-Demand	Anodyne	ADRA1D	36	40
COc1ccccc1N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040608	EG	On-Demand	Anodyne	ADRA1A	29	42
COc1ccccc1N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040608	EG	On-Demand	Anodyne	ADRA1B	31	42
COc1ccccc1N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040612	EG	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040612	EG	On-Demand	Anodyne	DRD2	17	42
COc1ccccc1N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040612	EG	On-Demand	Anodyne	ADRA1D	36	40
COc1ccccc1N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040612	EG	On-Demand	Anodyne	ADRA1A	29	42
COc1ccccc1N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872040612	EG	On-Demand	Anodyne	ADRA1B	31	42
COc1ccccc1N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040616	EG	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040616	EG	On-Demand	Anodyne	DRD2	17	42
COc1ccccc1N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040616	EG	On-Demand	Anodyne	ADRA1D	36	40
COc1ccccc1N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040616	EG	On-Demand	Anodyne	ADRA1A	29	42
COc1ccccc1N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872040616	EG	On-Demand	Anodyne	ADRA1B	31	42
C[C@@H](NCCN1CCC[C@H]1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872040620	CF	On-Demand	Bother	HRH3	50	42
C[C@@H](NCC(=O)N(C)C1CCCCC1)c1cc(O)ccc1F	ZINC000872040664	DF	On-Demand	Anodyne	PYGL	26	45
C[C@H](NCC(=O)N(C)C1CCCCC1)c1cc(O)ccc1F	ZINC000872040725	DF	On-Demand	Anodyne	PYGL	26	45
c1ccc(CN2CCC(OCCCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872040819	GI	On-Demand	Anodyne	ACHE	18	41
c1ccc(CN2CCC(OCCCN[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872040819	GI	On-Demand	Anodyne	SIGMAR1	46	52
c1ccc(CN2CCC(OCCCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872040827	GI	On-Demand	Anodyne	ACHE	18	41
c1ccc(CN2CCC(OCCCN[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872040827	GI	On-Demand	Anodyne	SIGMAR1	46	52
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1CS(C)(=O)=O	ZINC000872040829	GH	On-Demand	Bother	COLA	35	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1CS(C)(=O)=O	ZINC000872040832	GH	On-Demand	Bother	COLA	35	40
CC[C@@H](CCC(F)(F)F)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000872040881	FG	On-Demand	Anodyne	CACNA1I	46	47
C[C@@H](CCCO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041101	CF	On-Demand	Bother	COLA	46	31
C[C@@H](CCCO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041102	CF	On-Demand	Bother	COLA	46	31
C[C@H](N[C@H](C)CCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041103	CF	On-Demand	Bother	COLA	46	31
CC(C)(C)NC(=O)CN1CCC(CN[C@@H]2CCO[C@H](C(C)(C)C)C2)CC1	ZINC000872041124	FF	On-Demand	Anodyne	CACNA1I	38	46
CC(C)(C)NC(=O)CN1CCC(CN[C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1	ZINC000872041125	FF	On-Demand	Anodyne	CACNA1I	38	46
CC(C)(C)NC(=O)CN1CCC(CN[C@H]2CCO[C@H](C(C)(C)C)C2)CC1	ZINC000872041126	FF	On-Demand	Anodyne	CACNA1I	38	46
CC(C)(C)NC(=O)CN1CCC(CN[C@H]2CCO[C@@H](C(C)(C)C)C2)CC1	ZINC000872041127	FF	On-Demand	Anodyne	CACNA1I	38	46
C[C@@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872041203	FE	On-Demand	Anodyne	SFRP1	78	34
C[C@@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872041203	FE	On-Demand	Anodyne	WNT3	43	32
C[C@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872041225	FE	On-Demand	Anodyne	SFRP1	78	34
C[C@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872041225	FE	On-Demand	Anodyne	WNT3	43	32
C[C@@H](NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872041287	FF	On-Demand	Anodyne	CACNA1I	72	52
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041323	DG	On-Demand	Anodyne	HTR1A	46	40
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041323	DG	On-Demand	Anodyne	DRD2	30	40
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041323	DG	On-Demand	Anodyne	ADRA1D	43	37
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041361	DG	On-Demand	Anodyne	HTR1A	46	40
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041361	DG	On-Demand	Anodyne	DRD2	30	40
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041361	DG	On-Demand	Anodyne	ADRA1D	43	37
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041363	DG	On-Demand	Anodyne	HTR1A	46	40
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041363	DG	On-Demand	Anodyne	DRD2	30	40
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1)[C@H]1CCCOC1	ZINC000872041363	DG	On-Demand	Anodyne	ADRA1D	43	37
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041365	DG	On-Demand	Anodyne	HTR1A	46	40
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041365	DG	On-Demand	Anodyne	DRD2	30	40
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1)[C@@H]1CCCOC1	ZINC000872041365	DG	On-Demand	Anodyne	ADRA1D	43	37
C[C@H](NCC(C)(C)CCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041423	CF	On-Demand	Bother	COLA	51	32
C[C@@H](NCC(C)(C)CCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041426	CF	On-Demand	Bother	COLA	51	32
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C(N)=O)nc1)CCCC2	ZINC000872041518	FF	On-Demand	Anodyne	HCRTR1	17	40
C[C@@H](NCC(=O)N(C)C1CCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041635	EG	On-Demand	Bother	COLA	94	35
C[C@H](NCC(=O)N(C)C1CCCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041638	EG	On-Demand	Bother	COLA	94	35
CC[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872041676	EG	On-Demand	Anodyne	C3AR1	45	44
CC[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872041676	EG	On-Demand	Anodyne	BIRC2	19	41
CC[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872041677	EG	On-Demand	Anodyne	C3AR1	45	44
CC[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872041677	EG	On-Demand	Anodyne	BIRC2	19	41
CC[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872041678	EG	On-Demand	Anodyne	C3AR1	45	44
CC[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872041678	EG	On-Demand	Anodyne	BIRC2	19	41
CC[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872041679	EG	On-Demand	Anodyne	C3AR1	45	44
CC[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872041679	EG	On-Demand	Anodyne	BIRC2	19	41
C[C@H](NC[C@H](CO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041727	DG	On-Demand	Bother	COLA	82	32
C[C@@H](NC[C@@H](CO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041729	DG	On-Demand	Bother	COLA	82	32
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041900	FG	On-Demand	Anodyne	GRIN2B	19	44
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041900	FG	On-Demand	Anodyne	C3AR1	42	41
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041900	FG	On-Demand	Anodyne	MLNR	20	41
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041900	FG	On-Demand	Anodyne	BIRC2	24	40
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041907	FG	On-Demand	Anodyne	GRIN2B	19	44
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041907	FG	On-Demand	Anodyne	C3AR1	42	41
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041907	FG	On-Demand	Anodyne	MLNR	20	41
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(O)c1F	ZINC000872041907	FG	On-Demand	Anodyne	BIRC2	24	40
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)CCO)CCCC2	ZINC000872041937	DG	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)CCO)CCCC2	ZINC000872041938	DG	On-Demand	Anodyne	SLC18A2	50	37
C[C@H](NC1CN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872041960	DF	On-Demand	Anodyne	GPR119	22	44
C[C@@H](NC1CN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872041961	DF	On-Demand	Anodyne	GPR119	22	44
C[C@@H](NCC1(CO)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041994	CE	On-Demand	Bother	COLA	55	32
C[C@@H](N[C@H]1CCN(c2ncccc2F)C1)c1cccc(O)c1F	ZINC000872041998	DF	On-Demand	Anodyne	PRKCQ	42	34
C[C@H](N[C@@H]1CCN(c2ncccc2F)C1)c1cccc(O)c1F	ZINC000872041999	DF	On-Demand	Anodyne	PRKCQ	42	34
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CCCO)CCCC2	ZINC000872042004	DG	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CCCO)CCCC2	ZINC000872042006	DG	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](NCCN1CCC(N(C)C)CC1)CCCC2	ZINC000872042011	GG	On-Demand	Anodyne	SLC18A2	41	34
CC[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CCCOC1	ZINC000872042075	DH	On-Demand	Anodyne	AMP1_PLAFQ	53	38
CC[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CCCOC1	ZINC000872042076	DH	On-Demand	Anodyne	AMP1_PLAFQ	53	38
CC[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CCCOC1	ZINC000872042078	DH	On-Demand	Anodyne	AMP1_PLAFQ	53	38
CC[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CCCOC1	ZINC000872042081	DH	On-Demand	Anodyne	AMP1_PLAFQ	53	38
C[C@H](N[C@H](C)CC(N)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042227	CD	On-Demand	Bother	COLA	91	33
CCC(=O)N1CC[C@H](N[C@@H]2CC(C)(C)Sc3ccccc32)C1	ZINC000872042271	DH	On-Demand	Anodyne	EPHX2	16	41
CCC(=O)N1CC[C@@H](N[C@H]2CC(C)(C)Sc3ccccc32)C1	ZINC000872042272	DH	On-Demand	Anodyne	EPHX2	16	41
CCC(=O)N1CC[C@@H](N[C@@H]2CC(C)(C)Sc3ccccc32)C1	ZINC000872042273	DH	On-Demand	Anodyne	EPHX2	16	41
CCC(=O)N1CC[C@H](N[C@H]2CC(C)(C)Sc3ccccc32)C1	ZINC000872042274	DH	On-Demand	Anodyne	EPHX2	16	41
COc1cc2c(cc1OC)[C@@H](NCc1ccc(F)cn1)CCCC2	ZINC000872042302	EH	On-Demand	Anodyne	GRIN2B	15	43
C[C@@H](NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042321	GG	On-Demand	Bother	CACNA1I	45	45
C[C@H](NC1CCC(N2CCCCC2)CC1)c1cccc(O)c1F	ZINC000872042341	DH	On-Demand	Anodyne	L3MBTL3	60	36
C[C@@H](NC1CCC(N2CCCCC2)CC1)c1cccc(O)c1F	ZINC000872042342	DH	On-Demand	Anodyne	L3MBTL3	60	36
CCC(=O)N1CC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042365	EE	On-Demand	Anodyne	DRD4	33	42
CCC(=O)N1CC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042365	EE	On-Demand	Anodyne	SIGMAR1	30	42
CCC(=O)N1CC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042365	EE	On-Demand	Anodyne	MLNR	45	37
CCC(=O)N1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042370	EE	On-Demand	Anodyne	DRD4	33	42
CCC(=O)N1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042370	EE	On-Demand	Anodyne	SIGMAR1	30	42
CCC(=O)N1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042370	EE	On-Demand	Anodyne	MLNR	45	37
CCC(=O)N1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042371	EE	On-Demand	Anodyne	DRD4	33	42
CCC(=O)N1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042371	EE	On-Demand	Anodyne	SIGMAR1	30	42
CCC(=O)N1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042371	EE	On-Demand	Anodyne	MLNR	45	37
CCC(=O)N1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042372	EE	On-Demand	Anodyne	DRD4	33	42
CCC(=O)N1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042372	EE	On-Demand	Anodyne	SIGMAR1	30	42
CCC(=O)N1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872042372	EE	On-Demand	Anodyne	MLNR	45	37
C[C@H](N[C@H](C)C[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042377	EH	On-Demand	Bother	COLA	77	32
C[C@H](N[C@H](C)C[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042380	EH	On-Demand	Bother	COLA	77	32
C[C@@H](NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1cccc(O)c1F	ZINC000872042389	FF	On-Demand	Anodyne	CACNA1I	58	48
C[C@H](C[C@@H](O)c1ccccc1)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042540	EH	On-Demand	Bother	COLA	77	32
CCC(=O)N1CC[C@@H](N[C@H](CC)C(C)(C)CC)C1	ZINC000872042573	CF	On-Demand	Anodyne	EPHX2	17	47
CCC(=O)N1CC[C@@H](N[C@@H](CC)C(C)(C)CC)C1	ZINC000872042576	CF	On-Demand	Anodyne	EPHX2	17	47
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	HTR1A	56	42
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	DRD2	45	42
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	ADRA1D	55	38
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	ADRA1A	46	38
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	ADRA1B	44	38
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	DRD3	41	42
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042578	EH	On-Demand	Anodyne	HTR7	39	40
CCC(=O)N1CC[C@H](N[C@H](CC)C(C)(C)CC)C1	ZINC000872042579	CF	On-Demand	Anodyne	EPHX2	17	47
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	HTR1A	56	42
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	DRD2	45	42
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	ADRA1D	55	38
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	ADRA1A	46	38
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	ADRA1B	44	38
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	DRD3	41	42
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000872042580	EH	On-Demand	Anodyne	HTR7	39	40
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	HTR1A	56	42
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	DRD2	45	42
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	ADRA1D	55	38
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	ADRA1A	46	38
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	ADRA1B	44	38
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	DRD3	41	42
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042581	EH	On-Demand	Anodyne	HTR7	39	40
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	HTR1A	56	42
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	DRD2	45	42
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	ADRA1D	55	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	ADRA1A	46	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	ADRA1B	44	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	DRD3	41	42
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000872042582	EH	On-Demand	Anodyne	HTR7	39	40
CCC(=O)N1CC[C@H](N[C@@H](CC)C(C)(C)CC)C1	ZINC000872042583	CF	On-Demand	Anodyne	EPHX2	17	47
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042596	EG	On-Demand	Anodyne	HTR1A	42	39
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042596	EG	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042596	EG	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042596	EG	On-Demand	Anodyne	ADRA1B	40	37
COc1ccccc1N1CC[C@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042597	EG	On-Demand	Anodyne	HTR1A	42	39
COc1ccccc1N1CC[C@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042597	EG	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042597	EG	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042597	EG	On-Demand	Anodyne	ADRA1B	40	37
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042598	EG	On-Demand	Anodyne	HTR1A	42	39
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042598	EG	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042598	EG	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872042598	EG	On-Demand	Anodyne	ADRA1B	40	37
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042600	EG	On-Demand	Anodyne	HTR1A	42	39
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042600	EG	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042600	EG	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872042600	EG	On-Demand	Anodyne	ADRA1B	40	37
C[C@@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1cc(O)ccc1F	ZINC000872042642	EH	On-Demand	Anodyne	PRKCQ	43	35
C[C@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1cc(O)ccc1F	ZINC000872042643	EH	On-Demand	Anodyne	PRKCQ	43	35
C[C@@H](NCCNc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042724	DG	On-Demand	Bother	COLA	101	34
C[C@@H](NCCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872042835	CG	On-Demand	Bother	COLA	51	34
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042974	FE	On-Demand	Anodyne	DRD4	23	40
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042974	FE	On-Demand	Anodyne	GHRHR	46	29
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042974	FE	On-Demand	Anodyne	TRY2_BOVIN	64	37
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042974	FE	On-Demand	Anodyne	CACNA1B	25	40
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042974	FE	On-Demand	Anodyne	PGA5	41	33
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042975	FE	On-Demand	Anodyne	DRD4	23	40
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042975	FE	On-Demand	Anodyne	GHRHR	46	29
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042975	FE	On-Demand	Anodyne	TRY2_BOVIN	64	37
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042975	FE	On-Demand	Anodyne	CACNA1B	25	40
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042975	FE	On-Demand	Anodyne	PGA5	41	33
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042976	FE	On-Demand	Anodyne	DRD4	23	40
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042976	FE	On-Demand	Anodyne	GHRHR	46	29
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042976	FE	On-Demand	Anodyne	TRY2_BOVIN	64	37
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042976	FE	On-Demand	Anodyne	CACNA1B	25	40
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N1CCOCC1	ZINC000872042976	FE	On-Demand	Anodyne	PGA5	41	33
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043022	EG	On-Demand	Anodyne	ADRA1D	51	38
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043022	EG	On-Demand	Anodyne	ADRA1A	42	38
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043022	EG	On-Demand	Anodyne	ADRA1B	40	38
COc1ccccc1N1CC[C@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043023	EG	On-Demand	Anodyne	ADRA1D	51	38
COc1ccccc1N1CC[C@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043023	EG	On-Demand	Anodyne	ADRA1A	42	38
COc1ccccc1N1CC[C@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043023	EG	On-Demand	Anodyne	ADRA1B	40	38
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043024	EG	On-Demand	Anodyne	ADRA1D	51	38
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043024	EG	On-Demand	Anodyne	ADRA1A	42	38
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872043024	EG	On-Demand	Anodyne	ADRA1B	40	38
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043025	EG	On-Demand	Anodyne	ADRA1D	51	38
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043025	EG	On-Demand	Anodyne	ADRA1A	42	38
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872043025	EG	On-Demand	Anodyne	ADRA1B	40	38
C[C@@H](NCCc1ccncc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043142	CG	On-Demand	Bother	COLA	82	33
CCC(=O)N1CC[C@H](N[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872043182	DF	On-Demand	Anodyne	EPHX2	17	45
CCC(=O)N1CC[C@@H](N[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872043183	DF	On-Demand	Anodyne	EPHX2	17	45
CCC(=O)N1CC[C@H](N[C@H]2CCCCc3ccccc3C2)C1	ZINC000872043184	DF	On-Demand	Anodyne	EPHX2	17	45
CCC(=O)N1CC[C@@H](N[C@H]2CCCCc3ccccc3C2)C1	ZINC000872043185	DF	On-Demand	Anodyne	EPHX2	17	45
COc1cc2c(cc1OC)[C@@H](NCCN1CCC(OC)CC1)CCCC2	ZINC000872043225	FG	On-Demand	Anodyne	SLC18A2	41	34
C[C@@H](N[C@H]1CCN(c2ncccc2F)C1)c1cc(O)ccc1F	ZINC000872043228	DF	On-Demand	Anodyne	PRKCQ	43	33
C[C@H](N[C@@H]1CCN(c2ncccc2F)C1)c1cc(O)ccc1F	ZINC000872043229	DF	On-Demand	Anodyne	PRKCQ	43	33
COc1ccccc1N1CC[C@H](N[C@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872043257	EG	On-Demand	Anodyne	DRD2	19	45
COc1ccccc1N1CC[C@H](N[C@@H]2CCO[C@H](C(C)(C)C)C2)C1	ZINC000872043258	EG	On-Demand	Anodyne	DRD2	19	45
COc1ccccc1N1CC[C@H](N[C@@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872043260	EG	On-Demand	Anodyne	DRD2	19	45
COc1ccccc1N1CC[C@H](N[C@H]2CCO[C@@H](C(C)(C)C)C2)C1	ZINC000872043261	EG	On-Demand	Anodyne	DRD2	19	45
C[C@@H](NCCCNc1ccccn1)c1cc(O)ccc1F	ZINC000872043352	CG	On-Demand	Anodyne	METG	57	32
O=C(CCc1ccccc1)N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872043370	FG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872043371	FG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872043372	FG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872043373	FG	On-Demand	Anodyne	C3AR1	40	40
c1ccc(NCCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872043392	CG	On-Demand	Anodyne	ICMT	89	42
c1ccc(NCCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872043393	CG	On-Demand	Anodyne	ICMT	89	42
CCC(=O)N1CC[C@@H](N[C@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872043493	EF	On-Demand	Anodyne	MLNR	43	39
CCC(=O)N1CC[C@@H](N[C@@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872043494	EF	On-Demand	Anodyne	MLNR	43	39
CCC(=O)N1CC[C@H](N[C@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872043495	EF	On-Demand	Anodyne	MLNR	43	39
CCC(=O)N1CC[C@H](N[C@@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872043496	EF	On-Demand	Anodyne	MLNR	43	39
CC[C@@H](O)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043543	CF	On-Demand	Bother	COLA	59	32
CC[C@H](O)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043544	CF	On-Demand	Bother	COLA	59	32
CC[C@@H](O)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043545	CF	On-Demand	Bother	COLA	59	32
CC[C@H](O)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043546	CF	On-Demand	Bother	COLA	59	32
CC[C@H](CCO)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043579	DG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@H](CCO)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043580	DG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@@H](CCO)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043581	DG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@@H](CCO)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043582	DG	On-Demand	Anodyne	SLC18A2	47	34
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	GRIN2B	15	45
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	C3AR1	44	41
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	EPHX2	21	42
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	CCR8	52	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	BIRC2	20	41
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	SFRP1	81	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	WNT3	60	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043593	FH	On-Demand	Anodyne	ETHR	57	40
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	GRIN2B	15	45
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	C3AR1	44	41
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	EPHX2	21	42
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	CCR8	52	36
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	BIRC2	20	41
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	SFRP1	81	36
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	WNT3	60	36
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043594	FH	On-Demand	Anodyne	ETHR	57	40
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	GRIN2B	15	45
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	C3AR1	44	41
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	EPHX2	21	42
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	CCR8	52	36
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	BIRC2	20	41
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	SFRP1	81	36
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	WNT3	60	36
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043595	FH	On-Demand	Anodyne	ETHR	57	40
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	GRIN2B	15	45
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	C3AR1	44	41
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	EPHX2	21	42
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	CCR8	52	36
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	BIRC2	20	41
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	SFRP1	81	36
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	WNT3	60	36
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872043596	FH	On-Demand	Anodyne	ETHR	57	40
CC[C@@H](NCC1CCN(CC(=O)NC(C)(C)C)CC1)[C@@H]1CCCOC1	ZINC000872043617	FE	On-Demand	Anodyne	CACNA1I	22	43
CC[C@@H](NCC1CCN(CC(=O)NC(C)(C)C)CC1)[C@H]1CCCOC1	ZINC000872043619	FE	On-Demand	Anodyne	CACNA1I	22	43
CC(C)(C)NC(=O)CN1CCC(CN[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872043624	FF	On-Demand	Anodyne	CACNA1I	28	44
CC(C)(C)NC(=O)CN1CCC(CN[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872043625	FF	On-Demand	Anodyne	CACNA1I	28	44
C[C@@H](N[C@@H](CO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043763	DG	On-Demand	Bother	COLA	93	33
C[C@H](CCS(C)(=O)=O)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043921	DE	On-Demand	Bother	COLA	73	34
C[C@@H](CCS(C)(=O)=O)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043922	DE	On-Demand	Bother	COLA	73	34
C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043923	DE	On-Demand	Bother	COLA	73	34
C[C@H](N[C@H](C)CCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872043924	DE	On-Demand	Bother	COLA	73	34
CC[C@@H](O)CCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043989	DG	On-Demand	Anodyne	SLC18A2	50	37
CC[C@H](O)CCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043990	DG	On-Demand	Anodyne	SLC18A2	50	37
CC[C@H](O)CCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043991	DG	On-Demand	Anodyne	SLC18A2	50	37
CC[C@@H](O)CCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872043992	DG	On-Demand	Anodyne	SLC18A2	50	37
CCC(=O)N1CC[C@@H](N[C@H](CC)CCC(F)(F)F)C1	ZINC000872044007	CF	On-Demand	Anodyne	EPHX2	21	43
CCC(=O)N1CC[C@H](N[C@H](CC)CCC(F)(F)F)C1	ZINC000872044008	CF	On-Demand	Anodyne	EPHX2	21	43
CCC(=O)N1CC[C@H](N[C@@H](CC)CCC(F)(F)F)C1	ZINC000872044009	CF	On-Demand	Anodyne	EPHX2	21	43
CCC(=O)N1CC[C@@H](N[C@@H](CC)CCC(F)(F)F)C1	ZINC000872044010	CF	On-Demand	Anodyne	EPHX2	21	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](CO)c1ccccc1	ZINC000872044199	EH	On-Demand	Bother	F2RL3	46	35
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](CO)c1ccccc1	ZINC000872044200	EH	On-Demand	Bother	F2RL3	46	35
C[C@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872044454	GG	On-Demand	Anodyne	PTPN2	43	37
C[C@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872044454	GG	On-Demand	Anodyne	SIGMAR1	17	46
C[C@@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872044455	GG	On-Demand	Anodyne	PTPN2	43	37
C[C@@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872044455	GG	On-Demand	Anodyne	SIGMAR1	17	46
C[C@@H](NCCCNC(=O)c1ccc(F)cc1)c1cccc(O)c1F	ZINC000872044477	EG	On-Demand	Anodyne	FOLH1	16	40
C[C@@H](NCCCNC(=O)c1ccc(F)cc1)c1cccc(O)c1F	ZINC000872044477	EG	On-Demand	Anodyne	BCHE	20	40
C[C@@H](NCCCC(=O)N1Cc2ccccc2C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044524	FH	On-Demand	Bother	COLA	71	33
CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044599	DE	On-Demand	Bother	COLA	85	34
CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044600	DE	On-Demand	Bother	COLA	85	34
CCS(=O)(=O)C[C@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044601	DE	On-Demand	Bother	COLA	85	34
CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044602	DE	On-Demand	Bother	COLA	85	34
CCC(=O)N1CC[C@H](N[C@@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044662	EG	On-Demand	Anodyne	SLC18A2	47	33
CCC(=O)N1CC[C@H](N[C@@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044662	EG	On-Demand	Anodyne	MTNR1B	15	42
CCC(=O)N1CC[C@@H](N[C@@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044666	EG	On-Demand	Anodyne	SLC18A2	47	33
CCC(=O)N1CC[C@@H](N[C@@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044666	EG	On-Demand	Anodyne	MTNR1B	15	42
CCC(=O)N1CC[C@H](N[C@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044668	EG	On-Demand	Anodyne	SLC18A2	47	33
CCC(=O)N1CC[C@H](N[C@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044668	EG	On-Demand	Anodyne	MTNR1B	15	42
CCC(=O)N1CC[C@@H](N[C@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044672	EG	On-Demand	Anodyne	SLC18A2	47	33
CCC(=O)N1CC[C@@H](N[C@H]2CCCCc3cc(OC)c(OC)cc32)C1	ZINC000872044672	EG	On-Demand	Anodyne	MTNR1B	15	42
C[C@@H](NCCc1ccc(Cl)nc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044708	DH	On-Demand	Bother	NACHRBETA2	41	38
CCC(=O)N1CC[C@@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872044712	CE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](N[C@H](C)c2cccc(O)c2F)C1	ZINC000872044716	CE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872044721	CE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@@H](N[C@@H](C)c2cccc(O)c2F)C1	ZINC000872044722	CE	On-Demand	Anodyne	EPHX2	18	42
C[C@@H](NCCS(=O)(=O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044830	EF	On-Demand	Bother	COLA	82	34
COC[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044849	EI	On-Demand	Bother	CACNA1D	47	38
COC[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044849	EI	On-Demand	Bother	F2RL3	46	35
COC[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044850	EI	On-Demand	Bother	CACNA1D	47	38
COC[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044850	EI	On-Demand	Bother	F2RL3	46	35
COC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044851	EI	On-Demand	Bother	CACNA1D	47	38
COC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044851	EI	On-Demand	Bother	F2RL3	46	35
COC[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044852	EI	On-Demand	Bother	CACNA1D	47	38
COC[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1	ZINC000872044852	EI	On-Demand	Bother	F2RL3	46	35
C[C@H](NCC(=O)NC1CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044853	DE	On-Demand	Bother	COLA	49	32
C[C@@H](NCC(=O)NC1CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044854	DE	On-Demand	Bother	COLA	49	32
C[C@@H](N[C@H](CO)c1c(F)cccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044867	EG	On-Demand	Bother	COLA	78	33
C[C@@H](N[C@@H](CO)c1c(F)cccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872044868	EG	On-Demand	Bother	COLA	78	33
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872044875	GH	On-Demand	Anodyne	SFRP1	74	33
CC[C@@H](CCC(F)(F)F)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872044875	GH	On-Demand	Anodyne	WNT3	43	33
C[C@H](CS(C)(=O)=O)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872044877	ED	On-Demand	Anodyne	SIGMAR1	21	40
CC[C@@H](CCC(F)(F)F)NCCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872044909	DH	On-Demand	Anodyne	ERG2	18	48
CC[C@@H](CCC(F)(F)F)NCCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872044909	DH	On-Demand	Anodyne	Q2TU57_MAIZE	20	48
CCS(=O)(=O)C[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872044910	FE	On-Demand	Anodyne	SIGMAR1	26	43
CCS(=O)(=O)C[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872044911	FE	On-Demand	Anodyne	SIGMAR1	26	43
CCS(=O)(=O)C[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872044912	FE	On-Demand	Anodyne	SIGMAR1	26	43
CCC(=O)N1CC[C@@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872044953	CE	On-Demand	Anodyne	EPHX2	17	40
CCC(=O)N1CC[C@H](N[C@H](C)c2cc(O)ccc2F)C1	ZINC000872044954	CE	On-Demand	Anodyne	EPHX2	17	40
CCC(=O)N1CC[C@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872044955	CE	On-Demand	Anodyne	EPHX2	17	40
CCC(=O)N1CC[C@@H](N[C@@H](C)c2cc(O)ccc2F)C1	ZINC000872044956	CE	On-Demand	Anodyne	EPHX2	17	40
CC[C@@H](NC1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1)[C@@H]1CCCOC1	ZINC000872045062	GG	On-Demand	Anodyne	L3MBTL3	59	34
CC[C@@H](NC1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1)[C@H]1CCCOC1	ZINC000872045064	GG	On-Demand	Anodyne	L3MBTL3	59	34
NC(=O)C1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872045214	EF	On-Demand	Anodyne	DRD4	22	40
NC(=O)C1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872045214	EF	On-Demand	Anodyne	SIGMAR1	26	41
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CC(N)=O)CCCC2	ZINC000872045371	DE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CC(N)=O)CCCC2	ZINC000872045372	DE	On-Demand	Anodyne	SLC18A2	46	34
C[C@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872045375	GG	On-Demand	Anodyne	PTPN2	43	36
C[C@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872045375	GG	On-Demand	Anodyne	SIGMAR1	16	45
C[C@@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872045376	GG	On-Demand	Anodyne	PTPN2	43	36
C[C@@H](NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872045376	GG	On-Demand	Anodyne	SIGMAR1	16	45
C[C@H](NCc1ccc(C(=O)NCCN(C)C)cc1)c1cc(O)ccc1F	ZINC000872045393	FF	On-Demand	Anodyne	UTS2	41	32
C[C@H](NCc1ccc(C(=O)NCCN(C)C)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872045455	GF	On-Demand	Bother	COLA	57	32
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cccc(O)c1F	ZINC000872045515	GG	On-Demand	Anodyne	DRD2	18	43
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cccc(O)c1F	ZINC000872045515	GG	On-Demand	Anodyne	DRD4	46	36
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cccc(O)c1F	ZINC000872045515	GG	On-Demand	Anodyne	PLD1	58	36
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cccc(O)c1F	ZINC000872045515	GG	On-Demand	Anodyne	PLD2	73	37
C[C@@H](NCCCNC(=O)c1cccs1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872045535	FG	On-Demand	Bother	COLA	40	35
CC[C@@H](NCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872045557	FE	On-Demand	Anodyne	SIGMAR1	44	41
CC[C@@H](NCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872045558	FE	On-Demand	Anodyne	SIGMAR1	44	41
CC[C@@H](CCC(F)(F)F)NCCCNC(=O)c1ccc(F)cc1	ZINC000872045581	EH	On-Demand	Anodyne	FOLH1	26	43
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CS(C)(=O)=O)CCCC2	ZINC000872045583	EE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CS(C)(=O)=O)CCCC2	ZINC000872045586	EE	On-Demand	Anodyne	SLC18A2	47	35
C[C@@H](NCC1(N2CCCCC2)CCOCC1)c1cccc(O)c1F	ZINC000872045588	EG	On-Demand	Anodyne	HCN1	59	42
C[C@@H](NCC1(N2CCCCC2)CCOCC1)c1cccc(O)c1F	ZINC000872045588	EG	On-Demand	Anodyne	HCN4	50	35
C=C(Cl)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872045653	CG	On-Demand	Mild	COLA	71	32
C=C(Cl)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872045654	CG	On-Demand	Mild	COLA	71	32
C[C@@H](NCCCNC(=O)c1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872045669	EG	On-Demand	Anodyne	BCHE	21	42
C[C@@H](NCCCNC(=O)c1ccc(F)cc1)c1cc(O)ccc1F	ZINC000872045669	EG	On-Demand	Anodyne	ALPL	44	33
O=C(c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1)N1CCCCC1	ZINC000872045781	FH	On-Demand	Anodyne	L3MBTL3	71	39
O=C(c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCCCC1	ZINC000872045784	FH	On-Demand	Anodyne	L3MBTL3	71	39
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc(O)ccc1F	ZINC000872045860	GG	On-Demand	Anodyne	DRD4	46	37
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc(O)ccc1F	ZINC000872045860	GG	On-Demand	Anodyne	PLD1	69	39
C[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc(O)ccc1F	ZINC000872045860	GG	On-Demand	Anodyne	PLD2	83	39
OC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872045872	DE	On-Demand	Anodyne	SIGMAR1	25	40
OC[C@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872045873	DE	On-Demand	Anodyne	SIGMAR1	25	40
OC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872045874	DE	On-Demand	Anodyne	SIGMAR1	25	40
OC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1	ZINC000872045875	DE	On-Demand	Anodyne	SIGMAR1	25	40
NC(=O)c1cccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872045930	FF	On-Demand	Anodyne	DRD4	22	41
NC(=O)c1cccc(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872045930	FF	On-Demand	Anodyne	KCNH2	35	40
NC(=O)c1cccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872045932	FF	On-Demand	Anodyne	DRD4	22	41
NC(=O)c1cccc(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872045932	FF	On-Demand	Anodyne	KCNH2	35	40
CC[C@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045960	EH	On-Demand	Anodyne	MTNR1A	24	42
CC[C@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045960	EH	On-Demand	Anodyne	MTNR1B	22	42
CC[C@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045960	EH	On-Demand	Anodyne	KCNK3	46	35
CC[C@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045960	EH	On-Demand	Anodyne	KCNK9	40	35
CC[C@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045960	EH	On-Demand	Anodyne	PDS	57	39
CC[C@@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045962	EH	On-Demand	Anodyne	MTNR1A	24	42
CC[C@@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045962	EH	On-Demand	Anodyne	MTNR1B	22	42
CC[C@@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045962	EH	On-Demand	Anodyne	KCNK3	46	35
CC[C@@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045962	EH	On-Demand	Anodyne	KCNK9	40	35
CC[C@@H](CCC(F)(F)F)NCCOc1cccc(NC(C)=O)c1	ZINC000872045962	EH	On-Demand	Anodyne	PDS	57	39
CC(=O)Nc1cccc(OCCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872046000	FG	On-Demand	Bother	TAAR1	29	45
CC(=O)Nc1cccc(OCCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872046005	FG	On-Demand	Bother	TAAR1	29	45
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(C)C)CC1)CCCC2	ZINC000872046064	EH	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](NC1CCN(C(C)C)CC1)CCCC2	ZINC000872046064	EH	On-Demand	Anodyne	EHMT2	65	37
O=C(NCCN1CCCC1)c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872046096	GG	On-Demand	Anodyne	PLD1	44	36
O=C(NCCN1CCCC1)c1ccc(CN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872046096	GG	On-Demand	Anodyne	PLD2	68	38
O=C(NCCN1CCCC1)c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872046098	GG	On-Demand	Anodyne	PLD1	44	36
O=C(NCCN1CCCC1)c1ccc(CN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872046098	GG	On-Demand	Anodyne	PLD2	68	38
O=S(=O)(CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCOCC1	ZINC000872046111	GD	On-Demand	Anodyne	SIGMAR1	21	44
O=[N+]([O-])c1ccccc1CN[C@H](c1cccc(Br)c1)[C@@H]1CCOC1	ZINC000872046122	GI	On-Demand	Bother	COLA	78	35
O=[N+]([O-])c1ccccc1CN[C@H](c1cccc(Br)c1)[C@H]1CCOC1	ZINC000872046131	GI	On-Demand	Bother	COLA	78	35
O=[N+]([O-])c1ccccc1CN[C@@H](c1cccc(Br)c1)[C@@H]1CCOC1	ZINC000872046133	GI	On-Demand	Bother	COLA	78	35
O=[N+]([O-])c1ccccc1CN[C@@H](c1cccc(Br)c1)[C@H]1CCOC1	ZINC000872046135	GI	On-Demand	Bother	COLA	78	35
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CCCC1	ZINC000872046391	EF	On-Demand	Anodyne	DRD4	26	45
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CCCC1	ZINC000872046391	EF	On-Demand	Anodyne	SIGMAR1	30	51
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NC1CCCC1	ZINC000872046391	EF	On-Demand	Anodyne	CCR2	21	42
C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cc(O)ccc1F	ZINC000872046445	FI	On-Demand	Anodyne	DPP7	42	44
C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cc(O)ccc1F	ZINC000872046445	FI	On-Demand	Anodyne	L3MBTL3	43	36
C[C@@H](NCCCc1nc(-c2ccncc2)cs1)c1cccc(O)c1F	ZINC000872046536	FI	On-Demand	Anodyne	ROCK1	19	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCn1cccn1	ZINC000872046594	DF	On-Demand	Bother	F2RL3	48	35
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCn1cccn1	ZINC000872046595	DF	On-Demand	Bother	F2RL3	48	35
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046606	EG	On-Demand	Anodyne	DRD4	41	31
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046606	EG	On-Demand	Anodyne	GCGR	42	41
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046606	EG	On-Demand	Anodyne	NQO2	26	41
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046606	EG	On-Demand	Anodyne	CTSL	19	43
CC[C@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046606	EG	On-Demand	Anodyne	PPARD	15	40
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046607	EG	On-Demand	Anodyne	DRD4	41	31
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046607	EG	On-Demand	Anodyne	GCGR	42	41
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046607	EG	On-Demand	Anodyne	NQO2	26	41
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046607	EG	On-Demand	Anodyne	CTSL	19	43
CC[C@@H](CCC(F)(F)F)NCCNC(=O)c1ccc(OC)cc1	ZINC000872046607	EG	On-Demand	Anodyne	PPARD	15	40
CC[C@@H](NCCCc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872046623	CG	On-Demand	Anodyne	MTNR1B	15	44
CC[C@@H](NCCCc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872046624	CG	On-Demand	Anodyne	MTNR1B	15	44
CC[C@@H](NCCOc1cccc(NC(C)=O)c1)[C@@H]1CCCOC1	ZINC000872046669	DF	On-Demand	Anodyne	EPHX2	20	43
CC[C@@H](NCCOc1cccc(NC(C)=O)c1)[C@H]1CCCOC1	ZINC000872046670	DF	On-Demand	Anodyne	EPHX2	20	43
CCS(=O)(=O)C[C@H](C)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872046686	FF	On-Demand	Anodyne	SLC18A2	47	35
CCS(=O)(=O)C[C@@H](C)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872046687	FF	On-Demand	Anodyne	SLC18A2	47	35
CCS(=O)(=O)C[C@@H](C)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872046688	FF	On-Demand	Anodyne	SLC18A2	47	35
CCS(=O)(=O)C[C@H](C)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872046689	FF	On-Demand	Anodyne	SLC18A2	47	35
CC[C@@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872046704	FF	On-Demand	Anodyne	DRD4	40	31
CC[C@@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872046704	FF	On-Demand	Anodyne	PLD2	41	35
CC[C@@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872046705	FF	On-Demand	Anodyne	DRD4	40	31
CC[C@@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872046705	FF	On-Demand	Anodyne	PLD2	41	35
CC[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872046706	FF	On-Demand	Anodyne	DRD4	40	31
CC[C@H](NCc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872046706	FF	On-Demand	Anodyne	PLD2	41	35
C[C@@H](NCCC(=O)NC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872046778	DF	On-Demand	Bother	COLA	100	34
CC(=O)Nc1cccc(OCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872046785	EG	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872046785	EG	On-Demand	Anodyne	MTNR1B	17	40
CC(=O)Nc1cccc(OCCN[C@H](C)c2cc(O)ccc2F)c1	ZINC000872046785	EG	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872046786	EG	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872046786	EG	On-Demand	Anodyne	MTNR1B	17	40
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872046786	EG	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1cccc(OCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872046791	EG	On-Demand	Anodyne	MTNR1A	22	42
CC(=O)Nc1cccc(OCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872046791	EG	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)Nc1cccc(OCCN[C@H](C)c2cccc(O)c2F)c1	ZINC000872046791	EG	On-Demand	Anodyne	KCNK3	41	34
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872046792	EG	On-Demand	Anodyne	MTNR1A	22	42
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872046792	EG	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)Nc1cccc(OCCN[C@@H](C)c2cccc(O)c2F)c1	ZINC000872046792	EG	On-Demand	Anodyne	KCNK3	41	34
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1[N+](=O)[O-]	ZINC000872046811	EI	On-Demand	Bother	COLA	118	49
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1[N+](=O)[O-]	ZINC000872046812	EI	On-Demand	Bother	COLA	118	49
CC(=O)Nc1cccc(OCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872046911	EG	On-Demand	Anodyne	EPHX2	22	42
CC(=O)Nc1cccc(OCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872046912	EG	On-Demand	Anodyne	EPHX2	22	42
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(=O)NC(C)(C)C	ZINC000872046913	EG	On-Demand	Bother	TBXA2R	18	40
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(=O)NC(C)(C)C	ZINC000872046914	EG	On-Demand	Bother	TBXA2R	18	40
C[C@@H](O)CC(C)(C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047004	CG	On-Demand	Bother	COLA	55	32
C[C@H](NCC(C)(C)C[C@@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047005	CG	On-Demand	Bother	COLA	55	32
C[C@@H](NCC1(CS(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047150	EE	On-Demand	Bother	COLA	83	34
C[C@H](NC[C@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047158	EH	On-Demand	Bother	COLA	65	33
C[C@@H](NC[C@@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047159	EH	On-Demand	Bother	COLA	65	33
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CN(C)CCO1)CCCC2	ZINC000872047306	EE	On-Demand	Anodyne	SLC18A2	40	32
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CN(C)CCO1)CCCC2	ZINC000872047307	EE	On-Demand	Anodyne	SLC18A2	40	32
CN1CCO[C@@H](CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872047334	ED	On-Demand	Anodyne	DRD4	25	44
CN1CCO[C@@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872047335	ED	On-Demand	Anodyne	DRD4	25	44
CN1CCO[C@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872047336	ED	On-Demand	Anodyne	DRD4	25	44
O[C@@H]1CCC[C@@H]1N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872047400	DE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@H]1N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872047401	DE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@@H]1N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872047402	DE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@H]1N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872047403	DE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@H]1N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872047406	EG	On-Demand	Anodyne	SLC18A3	101	46
O[C@@H]1CCC[C@@H]1N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872047407	EG	On-Demand	Anodyne	SLC18A3	101	46
O[C@@H]1CCC[C@@H]1N1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872047408	EG	On-Demand	Anodyne	SLC18A3	101	46
O[C@@H]1CCC[C@H]1N1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872047409	EG	On-Demand	Anodyne	SLC18A3	101	46
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccc(O)c1F	ZINC000872047567	EH	On-Demand	Anodyne	ADRB2	16	45
C[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccc(O)c1F	ZINC000872047569	EH	On-Demand	Anodyne	ADRB2	16	45
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCNC(=O)C1CCC1	ZINC000872047643	FG	On-Demand	Bother	TBK1	64	34
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCNC(=O)C1CCC1	ZINC000872047644	FG	On-Demand	Bother	TBK1	64	34
CC(=O)Nc1cccc(OCCN[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872047753	EG	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCN[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872047755	EG	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCN[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872047763	EG	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCN[C@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872047764	EG	On-Demand	Anodyne	EPHX2	20	40
C[S@@](=O)c1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872047868	FG	On-Demand	Anodyne	SIGMAR1	17	44
C[S@@](=O)c1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872047870	FG	On-Demand	Anodyne	SIGMAR1	17	44
C[S@](=O)c1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872047873	FG	On-Demand	Anodyne	SIGMAR1	17	44
CC[C@@H](NCc1cccc(OCC(F)F)c1)[C@@H]1CCCOC1	ZINC000872047875	DH	On-Demand	Anodyne	PDS	49	35
CC[C@@H](NCc1cccc(OCC(F)F)c1)[C@H]1CCCOC1	ZINC000872047876	DH	On-Demand	Anodyne	PDS	49	35
C[S@](=O)c1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872047877	FG	On-Demand	Anodyne	SIGMAR1	17	44
CC[C@H](NCc1cccc(OCC(F)F)c1)[C@H]1CCCOC1	ZINC000872047878	DH	On-Demand	Anodyne	PDS	49	35
CC[C@H](NCc1cccc(OCC(F)F)c1)[C@@H]1CCCOC1	ZINC000872047879	DH	On-Demand	Anodyne	PDS	49	35
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)C1CCOCC1)CCCC2	ZINC000872047887	EF	On-Demand	Anodyne	SLC18A2	43	31
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)C1CCOCC1)CCCC2	ZINC000872047892	EF	On-Demand	Anodyne	SLC18A2	43	31
C[C@H](NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047927	FG	On-Demand	Bother	SLC18A3	34	46
C[C@H](NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047929	FG	On-Demand	Bother	SLC18A3	34	46
C[C@H](NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047931	FG	On-Demand	Bother	SLC18A3	34	46
C[C@H](NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872047932	FG	On-Demand	Bother	SLC18A3	34	46
C[C@H](NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048002	FF	On-Demand	Bother	SLC18A3	29	44
C[C@H](NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048003	FF	On-Demand	Bother	SLC18A3	29	44
C[C@H](NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048004	FF	On-Demand	Bother	SLC18A3	29	44
C[C@H](NC1CCN([C@H]2CCC[C@H]2O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048005	FF	On-Demand	Bother	SLC18A3	29	44
CC[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)[C@H]1CCCOC1	ZINC000872048043	EH	On-Demand	Anodyne	L3MBTL3	69	38
CC[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872048044	EH	On-Demand	Anodyne	L3MBTL3	69	38
CC[C@@H](NCc1ccc(C(=O)N2CCCCC2)cc1)[C@H]1CCCOC1	ZINC000872048045	EH	On-Demand	Anodyne	L3MBTL3	69	38
CC[C@@H](NCc1ccc(C(=O)N2CCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872048046	EH	On-Demand	Anodyne	L3MBTL3	69	38
CC[C@@H](C)C(=O)Nc1cccc(CN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872048067	EI	On-Demand	Anodyne	TIMP3	40	32
CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872048070	EI	On-Demand	Anodyne	TIMP3	40	32
O[C@@H]1CCCC[C@@H]1N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872048097	EF	On-Demand	Anodyne	SLC18A3	33	43
O[C@@H]1CCCC[C@@H]1N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872048099	EF	On-Demand	Anodyne	SLC18A3	33	43
O[C@@H]1CCCC[C@H]1N1CCC(N[C@@H]2CCOC3(CCCC3)C2)CC1	ZINC000872048102	EF	On-Demand	Anodyne	SLC18A3	33	43
O[C@@H]1CCCC[C@H]1N1CCC(N[C@H]2CCOC3(CCCC3)C2)CC1	ZINC000872048104	EF	On-Demand	Anodyne	SLC18A3	33	43
C[C@H](NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(O)c1F	ZINC000872048106	DF	On-Demand	Anodyne	SLC18A3	41	38
C[C@H](NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(O)c1F	ZINC000872048107	DF	On-Demand	Anodyne	SLC18A3	41	38
C[C@H](NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(O)c1F	ZINC000872048108	DF	On-Demand	Anodyne	SLC18A3	41	38
C[C@H](NC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(O)c1F	ZINC000872048109	DF	On-Demand	Anodyne	SLC18A3	41	38
C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(O)c1F	ZINC000872048113	FI	On-Demand	Anodyne	DPP7	50	40
C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(O)c1F	ZINC000872048113	FI	On-Demand	Anodyne	L3MBTL3	43	37
CC[C@H](N[C@H](C)C(=O)Nc1cccc(S(=O)(=O)NC)c1)[C@@H]1CCCOC1	ZINC000872048141	GD	On-Demand	Anodyne	ST14	41	34
CC[C@H](N[C@H](C)C(=O)Nc1cccc(S(=O)(=O)NC)c1)[C@H]1CCCOC1	ZINC000872048143	GD	On-Demand	Anodyne	ST14	41	34
CC[C@H](N[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)NC)c1)[C@@H]1CCCOC1	ZINC000872048145	GD	On-Demand	Anodyne	ST14	41	34
CC[C@H](N[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)NC)c1)[C@H]1CCCOC1	ZINC000872048148	GD	On-Demand	Anodyne	ST14	41	34
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048209	GG	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048209	GG	On-Demand	Anodyne	ADRB1	17	42
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048211	GG	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048211	GG	On-Demand	Anodyne	ADRB1	17	42
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048213	GG	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048213	GG	On-Demand	Anodyne	ADRB1	17	42
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048215	GG	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)COc1ccccc1Br	ZINC000872048215	GG	On-Demand	Anodyne	ADRB1	17	42
C[C@H](NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cc(O)ccc1F	ZINC000872048227	DF	On-Demand	Anodyne	SLC18A3	32	40
C[C@H](NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cc(O)ccc1F	ZINC000872048229	DF	On-Demand	Anodyne	SLC18A3	32	40
C[C@H](NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cc(O)ccc1F	ZINC000872048231	DF	On-Demand	Anodyne	SLC18A3	32	40
C[C@H](NC1CCN([C@H]2CCC[C@H]2O)CC1)c1cc(O)ccc1F	ZINC000872048233	DF	On-Demand	Anodyne	SLC18A3	32	40
CC[C@@H](NCCCNC(=O)C1CCC1)C(C)(C)CC	ZINC000872048296	CG	On-Demand	Anodyne	TBK1	76	38
C[C@H](NC[C@H](O)c1c(F)cccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048317	EG	On-Demand	Bother	COLA	89	33
C[C@@H](NC[C@@H](O)c1c(F)cccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048318	EG	On-Demand	Bother	COLA	89	33
CC[C@H](CCC(F)(F)F)NCc1ccccc1[N+](=O)[O-]	ZINC000872048392	CH	On-Demand	Bother	COLA	113	41
CC[C@@H](CCC(F)(F)F)NCc1ccccc1[N+](=O)[O-]	ZINC000872048393	CH	On-Demand	Bother	COLA	113	41
CON(C)C(=O)[C@H](CCSC)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048423	FF	On-Demand	Bother	COLA	55	32
CON(C)C(=O)[C@H](CCSC)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048424	FF	On-Demand	Bother	COLA	55	32
COc1cc2c(cc1OC)[C@@H](NCC(C)(C)C[C@@H](C)O)CCCC2	ZINC000872048570	EH	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](NCC(C)(C)C[C@H](C)O)CCCC2	ZINC000872048573	EH	On-Demand	Anodyne	SLC18A2	46	33
C[C@H](NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(O)c1F	ZINC000872048671	EF	On-Demand	Anodyne	SLC18A3	46	41
C[C@H](NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(O)c1F	ZINC000872048672	EF	On-Demand	Anodyne	SLC18A3	46	41
C[C@H](NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(O)c1F	ZINC000872048673	EF	On-Demand	Anodyne	SLC18A3	46	41
C[C@H](NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(O)c1F	ZINC000872048674	EF	On-Demand	Anodyne	SLC18A3	46	41
C[C@@H](NCCCNC(=O)C1CCC1)c1cccc(O)c1F	ZINC000872048778	CE	On-Demand	Anodyne	MTNR1A	16	40
C[C@@H](NCCCNC(=O)C1CCC1)c1cccc(O)c1F	ZINC000872048778	CE	On-Demand	Anodyne	MTNR1B	15	40
C[C@@H](NCCCNC(=O)C1CCC1)c1cccc(O)c1F	ZINC000872048778	CE	On-Demand	Anodyne	TBK1	80	41
C[C@@H](NCCOCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872048793	ED	On-Demand	Bother	COLA	44	32
CC[C@H](O)CCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872048808	DH	On-Demand	Anodyne	SLC18A2	50	39
CC[C@@H](O)CCCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872048809	DH	On-Demand	Anodyne	SLC18A2	50	39
CC[C@H](O)CCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872048810	DH	On-Demand	Anodyne	SLC18A2	50	39
CC[C@@H](O)CCCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872048911	DH	On-Demand	Anodyne	SLC18A2	50	39
O=C(CCCN[C@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872048998	GG	On-Demand	Anodyne	ADAM10	35	40
O=C(CCCN[C@@H]1CCOC2(CCCC2)C1)N1CCN(c2ccccc2)CC1	ZINC000872048999	GG	On-Demand	Anodyne	ADAM10	35	40
CC[C@@H](CCC(F)(F)F)NC1CCN(C(=O)CCOC)CC1	ZINC000872049033	DF	On-Demand	Anodyne	ETHR	54	35
C[C@@H](NCCCF)c1c(F)cccc1[N+](=O)[O-]	ZINC000872049048	BF	On-Demand	Bother	COLA	43	33
C[C@H]1C[C@H](NC2CCN([C@H]3CCC[C@@H]3O)CC2)CC(C)(C)C1	ZINC000872049059	DG	On-Demand	Anodyne	SLC18A3	32	40
C[C@H]1C[C@H](NC2CCN([C@@H]3CCC[C@H]3O)CC2)CC(C)(C)C1	ZINC000872049060	DG	On-Demand	Anodyne	SLC18A3	32	40
C[C@H]1C[C@H](NC2CCN([C@H]3CCC[C@H]3O)CC2)CC(C)(C)C1	ZINC000872049061	DG	On-Demand	Anodyne	SLC18A3	32	40
C[C@H]1C[C@H](NC2CCN([C@@H]3CCC[C@@H]3O)CC2)CC(C)(C)C1	ZINC000872049062	DG	On-Demand	Anodyne	SLC18A3	32	40
C[C@@H](NCCCNC(=O)C1CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872049162	DF	On-Demand	Bother	TBK1	66	38
CCOc1ccc([C@@H](C)NC(=O)CCCN[C@H]2CCOC3(CCCC3)C2)cc1	ZINC000872049251	GI	On-Demand	Anodyne	ACACB	17	41
CCOc1ccc([C@@H](C)NC(=O)CCCN[C@@H]2CCOC3(CCCC3)C2)cc1	ZINC000872049252	GI	On-Demand	Anodyne	ACACB	17	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000872049305	GH	On-Demand	Bother	SLC18A3	24	50
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000872049306	GH	On-Demand	Bother	SLC18A3	24	50
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000872049307	GH	On-Demand	Bother	SLC18A3	24	50
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000872049308	GH	On-Demand	Bother	SLC18A3	24	50
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)N(C)C	ZINC000872049323	CE	On-Demand	Anodyne	PDF	43	32
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)N(C)C	ZINC000872049324	CE	On-Demand	Anodyne	PDF	43	32
COc1cc2c(cc1OC)[C@@H](NCCCF)CCCC2	ZINC000872049501	CG	On-Demand	Anodyne	SLC18A2	51	47
O=C(NCCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872049585	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(NCCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872049585	FF	On-Demand	Anodyne	TBK1	67	34
O=C(NCCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872049586	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(NCCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872049586	FF	On-Demand	Anodyne	TBK1	67	34
C[C@H](N[C@H](C)C(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872049721	CD	On-Demand	Bother	COLA	97	34
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872049817	GG	On-Demand	Bother	SLC18A3	19	48
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872049820	GG	On-Demand	Bother	SLC18A3	19	48
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872049822	GG	On-Demand	Bother	SLC18A3	19	48
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872049824	GG	On-Demand	Bother	SLC18A3	19	48
C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872049973	GH	On-Demand	Bother	COLA	44	32
C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872049974	GH	On-Demand	Bother	COLA	44	32
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)N(C)C	ZINC000872050083	DD	On-Demand	Anodyne	CACNA1B	21	42
C[C@@H](NCC1(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872050084	CG	On-Demand	Bother	COLA	40	32
O[C@@H]1CCC[C@H]1N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872050183	GF	On-Demand	Anodyne	SLC18A3	72	45
O[C@@H]1CCC[C@H]1N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872050184	GF	On-Demand	Anodyne	SLC18A3	72	45
O[C@@H]1CCC[C@@H]1N1CCC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872050185	GF	On-Demand	Anodyne	SLC18A3	72	45
O[C@@H]1CCC[C@@H]1N1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872050186	GF	On-Demand	Anodyne	SLC18A3	72	45
C[C@H](NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cc(O)ccc1F	ZINC000872050205	EF	On-Demand	Anodyne	SLC18A3	35	43
C[C@H](NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cc(O)ccc1F	ZINC000872050206	EF	On-Demand	Anodyne	SLC18A3	35	43
C[C@H](NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cc(O)ccc1F	ZINC000872050207	EF	On-Demand	Anodyne	SLC18A3	35	43
C[C@H](NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cc(O)ccc1F	ZINC000872050208	EF	On-Demand	Anodyne	SLC18A3	35	43
Cc1ccoc1C(=O)NCCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872050212	EG	On-Demand	Bother	COLA	44	31
Cc1ccoc1C(=O)NCCCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872050213	EG	On-Demand	Bother	COLA	44	31
O=C(NCCCN[C@@H](c1cccc(Br)c1)[C@@H]1CCOC1)C1CCC1	ZINC000872050230	GG	On-Demand	Anodyne	TBK1	46	37
O=C(NCCCN[C@H](c1cccc(Br)c1)[C@H]1CCOC1)C1CCC1	ZINC000872050231	GG	On-Demand	Anodyne	TBK1	46	37
O=C(NCCCN[C@H](c1cccc(Br)c1)[C@@H]1CCOC1)C1CCC1	ZINC000872050232	GG	On-Demand	Anodyne	TBK1	46	37
O=C(NCCCN[C@@H](c1cccc(Br)c1)[C@H]1CCOC1)C1CCC1	ZINC000872050233	GG	On-Demand	Anodyne	TBK1	46	37
C[C@@H](NCCCNC(=O)C1CCC1)c1cc(O)ccc1F	ZINC000872050355	CE	On-Demand	Anodyne	TBK1	80	38
C[C@@H](NCC1CN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872050510	DG	On-Demand	Anodyne	GPR119	30	42
COc1cc2c(cc1OC)[C@@H](NCCCNC(=O)C(C)C)CCCC2	ZINC000872050712	EG	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](NCCCNC(=O)C(C)C)CCCC2	ZINC000872050712	EG	On-Demand	Anodyne	NQO2	18	46
C[C@@H](NCC1CN(C(=O)OC(C)(C)C)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872050772	FG	On-Demand	Bother	GPR119	26	42
C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1cccc(O)c1F	ZINC000872050784	DG	On-Demand	Bother	CACNA1D	49	35
C[C@@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cc(O)ccc1F	ZINC000872050928	EG	On-Demand	Anodyne	ACE	26	40
C[C@@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cc(O)ccc1F	ZINC000872050930	EG	On-Demand	Anodyne	ACE	26	40
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CCN(S(C)(=O)=O)C1)CCCC2	ZINC000872051033	GE	On-Demand	Anodyne	SLC18A2	40	33
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)CCCC2	ZINC000872051036	GE	On-Demand	Anodyne	SLC18A2	40	33
C[C@@H](N[C@@H](CO)CC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051075	CG	On-Demand	Bother	COLA	40	32
C[C@@H](N[C@H](CO)CC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051076	CG	On-Demand	Bother	COLA	40	32
CC(C)[C@H](O)C(C)(C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051142	DG	On-Demand	Bother	COLA	53	32
CC(C)[C@H](O)C(C)(C)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051144	DG	On-Demand	Bother	COLA	53	32
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)c1cc(O)ccc1F	ZINC000872051201	EH	On-Demand	Anodyne	ADRB2	16	49
C[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)c1cc(O)ccc1F	ZINC000872051202	EH	On-Demand	Anodyne	ADRB2	16	49
C[C@@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(O)c1F	ZINC000872051342	EG	On-Demand	Anodyne	ACE	34	42
C[C@@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(O)c1F	ZINC000872051343	EG	On-Demand	Anodyne	ACE	34	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	F2	34	47
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	HTR1A	26	50
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	DRD4	45	38
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	HTR2A	23	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	HTR2C	15	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	DRD3	21	50
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	F10	29	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	HTR7	49	56
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	BMP1	56	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP13	90	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	TRY2_BOVIN	98	47
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	CCKAR	26	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	HTR6	26	48
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	ADAM17	27	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP2	59	50
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP3	65	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP8	40	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP14	23	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	SSTR1	32	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP9	70	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP12	38	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP7	46	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1	ZINC000872051371	IE	On-Demand	Clean	MMP1	70	45
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000872051372	EI	On-Demand	Anodyne	RBP4	65	33
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000872051373	EI	On-Demand	Anodyne	RBP4	65	33
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000872051374	EI	On-Demand	Anodyne	RBP4	65	33
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000872051375	EI	On-Demand	Anodyne	RBP4	65	33
CCC(CC)(CO)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051530	CG	On-Demand	Bother	COLA	48	32
CCC(CC)(CO)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051531	CG	On-Demand	Bother	COLA	48	32
CC[C@H](CCC(F)(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000872051546	EH	On-Demand	Anodyne	ACE	30	42
CC[C@@H](CCC(F)(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000872051547	EH	On-Demand	Anodyne	ACE	30	42
CC[C@H](CCC(F)(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000872051548	EH	On-Demand	Anodyne	ACE	30	42
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000872051549	EH	On-Demand	Anodyne	ACE	30	42
C[C@H](N[C@@H](C)[C@@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051663	EG	On-Demand	Bother	COLA	75	34
C[C@H](N[C@@H](C)[C@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051664	EG	On-Demand	Bother	COLA	75	34
C[C@H](N[C@H](C)[C@@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051665	EG	On-Demand	Bother	COLA	75	34
C[C@H](N[C@H](C)[C@H](O)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051666	EG	On-Demand	Bother	COLA	75	34
COc1cc2c(cc1OC)[C@@H](NCCC[C@@H](C)CO)CCCC2	ZINC000872051751	DG	On-Demand	Anodyne	SLC18A2	51	39
COc1cc2c(cc1OC)[C@@H](NCCC[C@H](C)CO)CCCC2	ZINC000872051754	DG	On-Demand	Anodyne	SLC18A2	51	39
C[C@@H](NCCN(C)S(=O)(=O)c1cccs1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872051918	GF	On-Demand	Bother	COLA	70	45
C[C@@H](NCC(C)(C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872052000	CE	On-Demand	Bother	COLA	76	34
C[C@H](NCC(C)(C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872052001	CE	On-Demand	Bother	COLA	76	34
C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1cc(O)ccc1F	ZINC000872052231	DG	On-Demand	Bother	CACNA1D	48	37
CC(C)[C@H](O)C1(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872052321	DG	On-Demand	Bother	COLA	60	32
CC(C)[C@H](O)C1(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872052323	DG	On-Demand	Bother	COLA	60	32
C[C@@H](NCC1CN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872052431	DG	On-Demand	Anodyne	GPR119	22	43
C[C@@H](NCC1([C@@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872052591	EH	On-Demand	Bother	COLA	53	32
C[C@@H](NCC1([C@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872052592	EH	On-Demand	Bother	COLA	53	32
CC[C@H](N[C@@H](CC(C)C)C(=O)Nc1nccs1)[C@@H]1CCCOC1	ZINC000872052684	EG	On-Demand	Anodyne	MAP1	76	37
CC[C@H](N[C@@H](CC(C)C)C(=O)Nc1nccs1)[C@H]1CCCOC1	ZINC000872052685	EG	On-Demand	Anodyne	MAP1	76	37
CC[C@H](N[C@H](CC(C)C)C(=O)Nc1nccs1)[C@@H]1CCCOC1	ZINC000872052686	EG	On-Demand	Anodyne	MAP1	76	37
CC[C@H](N[C@H](CC(C)C)C(=O)Nc1nccs1)[C@H]1CCCOC1	ZINC000872052687	EG	On-Demand	Anodyne	MAP1	76	37
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCC1	ZINC000872052853	CF	On-Demand	Bother	KCNJ1	27	41
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCC1	ZINC000872052854	CF	On-Demand	Bother	KCNJ1	27	41
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCOCC1	ZINC000872053090	ED	On-Demand	Anodyne	TACR2	19	41
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCOCC1	ZINC000872053090	ED	On-Demand	Anodyne	SIGMAR1	38	40
C[C@@H](NCCc1ccc(CO)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053363	DG	On-Demand	Bother	COLA	98	34
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000872053373	EI	On-Demand	Bother	COLA	55	32
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000872053374	EI	On-Demand	Bother	COLA	55	32
C[C@@H](NCCCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053407	EH	On-Demand	Bother	COLA	51	33
C[C@@H](NCC(C)(C)C(N)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053409	CD	On-Demand	Bother	COLA	100	34
C[C@H](NCC(C)(C)C(N)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053410	CD	On-Demand	Bother	COLA	100	34
COc1cc2c(cc1OC)[C@@H](NCC(=O)N1CCOCC1)CCCC2	ZINC000872053411	ED	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@@H](NCC(=O)N1CCOCC1)CCCC2	ZINC000872053411	ED	On-Demand	Anodyne	MTNR1B	15	41
C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053526	EH	On-Demand	Bother	COLA	59	37
C=CC[C@H](CO)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872053691	DG	On-Demand	Mild	SLC18A2	46	33
C=CC[C@H](CO)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872053693	DG	On-Demand	Mild	SLC18A2	46	33
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000872053696	DD	On-Demand	Bother	COLA	88	36
C[C@H](NC[C@H](C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053698	DD	On-Demand	Bother	COLA	88	36
C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872053700	DD	On-Demand	Bother	COLA	88	36
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000872053705	GH	On-Demand	Bother	F2RL3	44	32
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000872053706	GH	On-Demand	Bother	F2RL3	44	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000872053707	GH	On-Demand	Bother	F2RL3	44	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000872053708	GH	On-Demand	Bother	F2RL3	44	32
COc1cc(NCCN[C@H]2CCOC3(CCCC3)C2)cc(OC)c1	ZINC000872053823	EG	On-Demand	Anodyne	ICMT	41	38
COc1cc(NCCN[C@@H]2CCOC3(CCCC3)C2)cc(OC)c1	ZINC000872053824	EG	On-Demand	Anodyne	ICMT	41	38
O=[N+]([O-])c1cccc(CCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872053942	DG	On-Demand	Bother	LUXR	16	42
O=[N+]([O-])c1cccc(CCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872053945	DG	On-Demand	Bother	LUXR	16	42
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C(C)=O)c3ccccc31)CCCC2	ZINC000872053965	GJ	On-Demand	Anodyne	HCRTR1	15	42
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C(C)=O)c3ccccc31)CCCC2	ZINC000872053965	GJ	On-Demand	Anodyne	MTNR1B	16	42
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCN(C(C)=O)c3ccccc31)CCCC2	ZINC000872053968	GJ	On-Demand	Anodyne	HCRTR1	15	42
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCN(C(C)=O)c3ccccc31)CCCC2	ZINC000872053968	GJ	On-Demand	Anodyne	MTNR1B	16	42
COc1cc2c(cc1OC)[C@@H](NCCN1CCC1)CCCC2	ZINC000872054020	DF	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](NCCN1CCC1)CCCC2	ZINC000872054020	DF	On-Demand	Anodyne	EHMT2	41	32
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1nnc(-c2ccccc2)o1	ZINC000872054048	GI	On-Demand	Bother	F2RL3	45	33
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1nnc(-c2ccccc2)o1	ZINC000872054052	GI	On-Demand	Bother	F2RL3	45	33
c1ccc(CN2C[C@H]3CC[C@@H](NCCN4CCC4)[C@H]3C2)cc1	ZINC000872054096	CE	On-Demand	Anodyne	HRH3	15	42
c1ccc(CN2C[C@H]3CC[C@@H](NCCN4CCC4)[C@H]3C2)cc1	ZINC000872054096	CE	On-Demand	Anodyne	SIGMAR1	54	40
c1ccc(CN2C[C@H]3CC[C@H](NCCN4CCC4)[C@H]3C2)cc1	ZINC000872054097	CE	On-Demand	Anodyne	HRH3	15	42
c1ccc(CN2C[C@H]3CC[C@H](NCCN4CCC4)[C@H]3C2)cc1	ZINC000872054097	CE	On-Demand	Anodyne	SIGMAR1	54	40
O=C(CN[C@H]1CCCCc2ccccc2C1)N1CCOCC1	ZINC000872054228	DD	On-Demand	Anodyne	CTSS	24	44
O=C(CN[C@@H]1CCCCc2ccccc2C1)N1CCOCC1	ZINC000872054229	DD	On-Demand	Anodyne	CTSS	24	44
COC[C@@H](O)CCN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872054280	DE	On-Demand	Anodyne	SLC18A2	48	34
COC[C@@H](O)CCN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872054281	DE	On-Demand	Anodyne	SLC18A2	48	34
C[C@H](NCC(=O)N1CCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054383	DD	On-Demand	Bother	COLA	42	31
C[C@@H](NCC(=O)N1CCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054384	DD	On-Demand	Bother	COLA	42	31
C[C@H](N[C@H](C)c1cc(O)ccc1F)c1ccccc1[N+](=O)[O-]	ZINC000872054413	DH	On-Demand	Bother	COLA	73	34
CC[C@H](CCC(F)(F)F)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872054426	DI	On-Demand	Bother	COLA	47	35
CC[C@@H](CCC(F)(F)F)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872054427	DI	On-Demand	Bother	COLA	47	35
CC[C@@H](CCC(F)(F)F)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872054428	DI	On-Demand	Bother	COLA	47	35
CC[C@H](CCC(F)(F)F)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872054429	DI	On-Demand	Bother	COLA	47	35
C[C@@H](NCCCCCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054496	CF	On-Demand	Bother	COLA	61	32
C[C@@H](NCCSCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054512	EH	On-Demand	Bother	COLA	41	34
COc1cc2c(cc1OC)[C@@H](NCCCCCCO)CCCC2	ZINC000872054518	DH	On-Demand	Anodyne	SLC18A2	46	35
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	HTR1A	15	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	DRD4	46	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	HTR7	27	46
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	BMP1	42	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP13	69	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	TRY2_BOVIN	66	37
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	ADAM17	25	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP2	38	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP3	50	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP8	31	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP14	19	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP9	60	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP12	31	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP7	40	38
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(Br)c3)CC2)cc1	ZINC000872054569	JE	On-Demand	Clean	MMP1	63	44
CC(=O)Nc1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1C	ZINC000872054712	DH	On-Demand	Anodyne	CSNK2A1	38	40
CC(=O)Nc1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1C	ZINC000872054713	DH	On-Demand	Anodyne	CSNK2A1	38	40
CC[C@H](Nc1cccc(NC(=O)OCCOC)c1)[C@@H]1CCCOC1	ZINC000872054718	EG	On-Demand	Anodyne	KCNK9	42	33
CC[C@@H](Nc1cccc(NC(=O)OCCOC)c1)[C@@H]1CCCOC1	ZINC000872054719	EG	On-Demand	Anodyne	KCNK9	42	33
CC[C@@H](Nc1cccc(NC(=O)OCCOC)c1)[C@H]1CCCOC1	ZINC000872054720	EG	On-Demand	Anodyne	KCNK9	42	33
CC[C@H](Nc1cccc(NC(=O)OCCOC)c1)[C@H]1CCCOC1	ZINC000872054721	EG	On-Demand	Anodyne	KCNK9	42	33
COc1cc2c(cc1OC)[C@@H](Nc1cccc(OCC(N)=O)c1)CCCC2	ZINC000872054725	FG	On-Demand	Anodyne	MTNR1B	19	40
NC(=O)COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054732	FF	On-Demand	Anodyne	LTA4H	50	43
NC(=O)COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054732	FF	On-Demand	Anodyne	SIGMAR1	32	40
NC(=O)COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054732	FF	On-Demand	Anodyne	FAAH	15	41
NC(=O)COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054733	FF	On-Demand	Anodyne	LTA4H	50	43
NC(=O)COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054733	FF	On-Demand	Anodyne	SIGMAR1	32	40
NC(=O)COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054733	FF	On-Demand	Anodyne	FAAH	15	41
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	TSHR	64	35
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	DRD4	32	42
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	ACHE	28	45
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	SIGMAR1	26	42
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	PLA2G2A	40	36
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	PLA2G2D	41	32
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054734	GF	On-Demand	Anodyne	ENPP1	40	32
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	TSHR	64	35
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	DRD4	32	42
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	ACHE	28	45
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	SIGMAR1	26	42
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	PLA2G2A	40	36
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	PLA2G2D	41	32
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1OCC(N)=O	ZINC000872054735	GF	On-Demand	Anodyne	ENPP1	40	32
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	DRD2	16	46
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	TSHR	49	32
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	DRD4	40	46
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	ACHE	32	46
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	SIGMAR1	41	48
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	CCR3	42	40
CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054782	EH	On-Demand	Anodyne	MCHR1	34	41
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	DRD2	16	46
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	TSHR	49	32
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	DRD4	40	46
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	ACHE	32	46
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	SIGMAR1	41	48
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	CCR3	42	40
CC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872054783	EH	On-Demand	Anodyne	MCHR1	34	41
C[C@@H](NCC(=O)NCCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054858	EF	On-Demand	Bother	COLA	85	37
C[C@H](NCC(=O)NCCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872054859	EF	On-Demand	Bother	COLA	85	37
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2cccc(O)c2F)c1	ZINC000872054942	EH	On-Demand	Anodyne	KCNK3	58	40
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2cccc(O)c2F)c1	ZINC000872054942	EH	On-Demand	Anodyne	KCNK9	56	40
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2cccc(O)c2F)c1	ZINC000872054944	EH	On-Demand	Anodyne	KCNK3	58	40
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2cccc(O)c2F)c1	ZINC000872054944	EH	On-Demand	Anodyne	KCNK9	56	40
CNC(=O)Cc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054962	FG	On-Demand	Anodyne	DRD4	34	41
CNC(=O)Cc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054962	FG	On-Demand	Anodyne	LTA4H	28	41
CNC(=O)Cc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054962	FG	On-Demand	Anodyne	SIGMAR1	39	46
CNC(=O)Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054963	FG	On-Demand	Anodyne	DRD4	34	41
CNC(=O)Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054963	FG	On-Demand	Anodyne	LTA4H	28	41
CNC(=O)Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872054963	FG	On-Demand	Anodyne	SIGMAR1	39	46
C[C@@H](Nc1ccc(N2CCOCC2)cn1)c1cccc(O)c1F	ZINC000872055000	DF	On-Demand	Anodyne	STAT6	54	35
OC[C@@]1(N[C@H]2CCOC3(CCCC3)C2)CCCN(Cc2ccccc2)C1	ZINC000872055089	FG	On-Demand	Anodyne	NPFFR1	18	40
OC[C@@]1(N[C@@H]2CCOC3(CCCC3)C2)CCCN(Cc2ccccc2)C1	ZINC000872055090	FG	On-Demand	Anodyne	NPFFR1	18	40
OC[C@]1(N[C@@H]2CCOC3(CCCC3)C2)CCCN(Cc2ccccc2)C1	ZINC000872055091	FG	On-Demand	Anodyne	NPFFR1	18	40
OC[C@]1(N[C@H]2CCOC3(CCCC3)C2)CCCN(Cc2ccccc2)C1	ZINC000872055092	FG	On-Demand	Anodyne	NPFFR1	18	40
OCCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872055095	ED	On-Demand	Anodyne	DRD4	36	43
OCCN1CCC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872055095	ED	On-Demand	Anodyne	SIGMAR1	48	43
C[C@@H](NCC(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872055096	DF	On-Demand	Anodyne	OPRM1	17	43
C[C@H](NCC(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872055097	DF	On-Demand	Anodyne	OPRM1	17	43
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872055186	FH	On-Demand	Bother	COLA	61	36
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872055186	FH	On-Demand	Bother	TAAR1	25	43
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872055188	FH	On-Demand	Bother	COLA	61	36
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872055188	FH	On-Demand	Bother	TAAR1	25	43
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	TSHR	77	39
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	DRD4	31	45
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	ACHE	31	41
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	SIGMAR1	27	44
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	CCR3	17	40
COc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055262	GH	On-Demand	Anodyne	MCHR1	15	42
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	TSHR	77	39
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	DRD4	31	45
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	ACHE	31	41
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	SIGMAR1	27	44
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	CCR3	17	40
COc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1NC(C)=O	ZINC000872055263	GH	On-Demand	Anodyne	MCHR1	15	42
C[C@@H](NC1(c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872055270	DI	On-Demand	Bother	COLA	41	34
C[C@H](NC1(c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872055271	DI	On-Demand	Bother	COLA	41	34
O=C(COc1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCCC1	ZINC000872055272	FH	On-Demand	Anodyne	CPT1A	93	39
O=C(COc1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCCC1	ZINC000872055272	FH	On-Demand	Anodyne	CPT2	48	36
O=C(COc1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCCC1	ZINC000872055273	FH	On-Demand	Anodyne	CPT1A	93	39
O=C(COc1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCCC1	ZINC000872055273	FH	On-Demand	Anodyne	CPT2	48	36
NC(=O)COc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055322	FF	On-Demand	Anodyne	DRD4	22	40
NC(=O)COc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055322	FF	On-Demand	Anodyne	HRH2	40	41
NC(=O)COc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055322	FF	On-Demand	Anodyne	SIGMAR1	28	41
NC(=O)COc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055322	FF	On-Demand	Anodyne	FAAH	22	42
NC(=O)COc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055323	FF	On-Demand	Anodyne	DRD4	22	40
NC(=O)COc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055323	FF	On-Demand	Anodyne	HRH2	40	41
NC(=O)COc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055323	FF	On-Demand	Anodyne	SIGMAR1	28	41
NC(=O)COc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872055323	FF	On-Demand	Anodyne	FAAH	22	42
C[C@@H](Nc1ccc(N2CCOCC2)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872055334	EH	On-Demand	Bother	STAT6	45	36
O=C(Cc1ccc(N[C@H]2CCOC3(CCCC3)C2)cc1)N1CCOCC1	ZINC000872055394	FF	On-Demand	Anodyne	MLNR	24	43
O=C(Cc1ccc(N[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCOCC1	ZINC000872055395	FF	On-Demand	Anodyne	MLNR	24	43
CC[C@H](Nc1ccc(N2CCOCC2)cc1C)[C@@H]1CCCOC1	ZINC000872055406	DG	On-Demand	Anodyne	TTK	20	42
CC[C@@H](Nc1ccc(N2CCOCC2)cc1C)[C@H]1CCCOC1	ZINC000872055407	DG	On-Demand	Anodyne	TTK	20	42
CC[C@@H](Nc1ccc(N2CCOCC2)cc1C)[C@@H]1CCCOC1	ZINC000872055408	DG	On-Demand	Anodyne	TTK	20	42
CC[C@H](Nc1ccc(N2CCOCC2)cc1C)[C@H]1CCCOC1	ZINC000872055409	DG	On-Demand	Anodyne	TTK	20	42
COc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)cc1NC(C)=O	ZINC000872055470	GI	On-Demand	Bother	KCNMA1	20	45
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872055496	FG	On-Demand	Anodyne	LRRK2	23	40
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872055497	FG	On-Demand	Anodyne	LRRK2	23	40
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872055498	FG	On-Demand	Anodyne	LRRK2	23	40
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872055499	FG	On-Demand	Anodyne	LRRK2	23	40
C[C@@H](Nc1ccc(OCC(=O)N(C)C)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872055540	FG	On-Demand	Bother	COLA	73	35
CC[C@H](Nc1cccc(NC(C)=O)c1)[C@H]1CCCOC1	ZINC000872055558	CG	On-Demand	Anodyne	KCNK3	45	34
CC[C@H](Nc1cccc(NC(C)=O)c1)[C@@H]1CCCOC1	ZINC000872055559	CG	On-Demand	Anodyne	KCNK3	45	34
CC[C@@H](Nc1cccc(NC(C)=O)c1)[C@@H]1CCCOC1	ZINC000872055560	CG	On-Demand	Anodyne	KCNK3	45	34
CC[C@@H](Nc1cccc(NC(C)=O)c1)[C@H]1CCCOC1	ZINC000872055561	CG	On-Demand	Anodyne	KCNK3	45	34
CC[C@H](CCC(F)(F)F)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000872055600	EK	On-Demand	Anodyne	KISS1R	55	37
CC[C@@H](CCC(F)(F)F)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000872055601	EK	On-Demand	Anodyne	KISS1R	55	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)C(C)C)c1	ZINC000872055602	DJ	On-Demand	Anodyne	KCNK3	71	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)C(C)C)c1	ZINC000872055602	DJ	On-Demand	Anodyne	KCNK9	60	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)C(C)C)c1	ZINC000872055603	DJ	On-Demand	Anodyne	KCNK3	71	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)C(C)C)c1	ZINC000872055603	DJ	On-Demand	Anodyne	KCNK9	60	37
COc1ccc(N[C@@H]2CCOC(C)(C)C2)cc1OCC(N)=O	ZINC000872055608	DD	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(N[C@H]2CCOC(C)(C)C2)cc1OCC(N)=O	ZINC000872055609	DD	On-Demand	Anodyne	DRTS_TRYCR	47	33
C[C@@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055650	DF	On-Demand	Anodyne	ANPEP	16	41
C[C@@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055650	DF	On-Demand	Anodyne	CA5B	20	41
C[C@@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055650	DF	On-Demand	Anodyne	CA5A	18	41
C[C@@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055650	DF	On-Demand	Anodyne	AMP1_PLAFQ	20	41
C[C@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055651	DF	On-Demand	Anodyne	ANPEP	16	41
C[C@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055651	DF	On-Demand	Anodyne	CA5B	20	41
C[C@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055651	DF	On-Demand	Anodyne	CA5A	18	41
C[C@H](NCC(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872055651	DF	On-Demand	Anodyne	AMP1_PLAFQ	20	41
C[C@@H](NCCCn1cncn1)c1cccc(O)c1F	ZINC000872055671	CD	On-Demand	Anodyne	HIS3	48	32
CCOc1cc(N2CCN(C)CC2)ccc1N[C@H]1CCOC(C)(C)C1	ZINC000872055688	EG	On-Demand	Anodyne	TTK	21	41
CCOc1cc(N2CCN(C)CC2)ccc1N[C@@H]1CCOC(C)(C)C1	ZINC000872055689	EG	On-Demand	Anodyne	TTK	21	41
CC[C@@H](CCC(F)(F)F)Nc1ccc(CC(=O)N2CCOCC2)cc1	ZINC000872055720	FH	On-Demand	Anodyne	CTSS	27	46
CC[C@H](CCC(F)(F)F)Nc1ccc(CC(=O)N2CCOCC2)cc1	ZINC000872055721	FH	On-Demand	Anodyne	CTSS	27	46
CC[C@H](CCC(F)(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000872055722	DI	On-Demand	Anodyne	STAT6	56	35
CC[C@@H](CCC(F)(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000872055723	DI	On-Demand	Anodyne	STAT6	56	35
c1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1CCN1CCOCC1	ZINC000872055724	EG	On-Demand	Anodyne	L3MBTL3	25	44
c1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1CCN1CCOCC1	ZINC000872055725	EG	On-Demand	Anodyne	L3MBTL3	25	44
C[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1cc(O)ccc1F	ZINC000872055811	FG	On-Demand	Anodyne	SIGMAR1	22	41
C[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1cc(O)ccc1F	ZINC000872055811	FG	On-Demand	Anodyne	MCHR1	30	41
COc1cc2c(cc1OC)[C@@H](NC1CCN(CCO)CC1)CCCC2	ZINC000872055893	EF	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](NC1CCN(CCO)CC1)CCCC2	ZINC000872055893	EF	On-Demand	Anodyne	HTR4	29	42
CC[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)[C@H]1CCCOC1	ZINC000872056020	FJ	On-Demand	Anodyne	EPHX2	28	40
CC[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)[C@H]1CCCOC1	ZINC000872056021	FJ	On-Demand	Anodyne	EPHX2	28	40
CC[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872056022	FJ	On-Demand	Anodyne	EPHX2	28	40
CC[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)[C@@H]1CCCOC1	ZINC000872056023	FJ	On-Demand	Anodyne	EPHX2	28	40
O=C(CCc1ccc(N[C@H]2CCOC3(CCCC3)C2)cc1)N1CCCC1	ZINC000872056074	FI	On-Demand	Anodyne	MLNR	16	46
O=C(CCc1ccc(N[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCCC1	ZINC000872056075	FI	On-Demand	Anodyne	MLNR	16	46
c1cc(N[C@H]2CCOC3(CCCC3)C2)ncc1N1CCOCC1	ZINC000872056114	DF	On-Demand	Anodyne	STAT6	52	32
c1cc(N[C@@H]2CCOC3(CCCC3)C2)ncc1N1CCOCC1	ZINC000872056115	DF	On-Demand	Anodyne	STAT6	52	32
CC[C@H](Nc1ccc(OC)c(OCc2ccncc2)c1)[C@H]1CCCOC1	ZINC000872056160	FI	On-Demand	Anodyne	PDE4A	26	40
CC[C@@H](Nc1ccc(OC)c(OCc2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872056161	FI	On-Demand	Anodyne	PDE4A	26	40
CC[C@H](Nc1ccc(OC)c(OCc2ccncc2)c1)[C@@H]1CCCOC1	ZINC000872056162	FI	On-Demand	Anodyne	PDE4A	26	40
CC[C@@H](Nc1ccc(OC)c(OCc2ccncc2)c1)[C@H]1CCCOC1	ZINC000872056163	FI	On-Demand	Anodyne	PDE4A	26	40
CC[C@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056176	EI	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056176	EI	On-Demand	Anodyne	SSTR5	47	33
CC[C@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056176	EI	On-Demand	Anodyne	CACNA1G	36	42
CC[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056177	EI	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056177	EI	On-Demand	Anodyne	SSTR5	47	33
CC[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)C(C)(C)CC	ZINC000872056177	EI	On-Demand	Anodyne	CACNA1G	36	42
CC[C@@H](CCC(F)(F)F)Nc1cccc(OCC(N)=O)c1	ZINC000872056328	DG	On-Demand	Anodyne	PDS	65	39
CC[C@H](CCC(F)(F)F)Nc1cccc(OCC(N)=O)c1	ZINC000872056329	DG	On-Demand	Anodyne	PDS	65	39
COc1ccc(N[C@H]2CCO[C@H](C(C)(C)C)C2)cc1OCC(N)=O	ZINC000872056336	EF	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(N[C@@H]2CCO[C@H](C(C)(C)C)C2)cc1OCC(N)=O	ZINC000872056337	EF	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(N[C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1OCC(N)=O	ZINC000872056338	EF	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(N[C@H]2CCO[C@@H](C(C)(C)C)C2)cc1OCC(N)=O	ZINC000872056339	EF	On-Demand	Anodyne	DRTS_TRYCR	47	33
C[C@@H](Nc1cccc(N2CCOCC2)c1)c1cccc(O)c1F	ZINC000872056352	DH	On-Demand	Anodyne	PIK3CD	15	42
C[C@@H](Nc1cccc(N2CCOCC2)c1)c1cccc(O)c1F	ZINC000872056352	DH	On-Demand	Anodyne	PIK3CB	39	42
CCC(=O)Nc1ccc(C)c(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872056360	EJ	On-Demand	Bother	COLA	56	34
CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872056365	EJ	On-Demand	Bother	COLA	56	34
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@@H](C)OC)c1	ZINC000872056381	EI	On-Demand	Anodyne	KCNK3	62	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@@H](C)OC)c1	ZINC000872056381	EI	On-Demand	Anodyne	KCNK9	61	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@H](C)OC)c1	ZINC000872056382	EI	On-Demand	Anodyne	KCNK3	62	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@H](C)OC)c1	ZINC000872056382	EI	On-Demand	Anodyne	KCNK9	61	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@H](C)OC)c1	ZINC000872056383	EI	On-Demand	Anodyne	KCNK3	62	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@H](C)OC)c1	ZINC000872056383	EI	On-Demand	Anodyne	KCNK9	61	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@@H](C)OC)c1	ZINC000872056384	EI	On-Demand	Anodyne	KCNK3	62	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(=O)[C@@H](C)OC)c1	ZINC000872056384	EI	On-Demand	Anodyne	KCNK9	61	37
CC[C@@H](CCC(F)(F)F)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000872056393	FJ	On-Demand	Anodyne	ETHR	46	33
CC[C@H](CCC(F)(F)F)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000872056397	FJ	On-Demand	Anodyne	ETHR	46	33
O=C(c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCSCC1	ZINC000872056417	FH	On-Demand	Anodyne	EPHX2	15	45
O=C(c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCSCC1	ZINC000872056419	FH	On-Demand	Anodyne	EPHX2	15	45
CC[C@H](CCC(F)(F)F)Nc1ccc2c(c1)NC(=O)CO2	ZINC000872056473	DH	On-Demand	Anodyne	NR3C2	30	45
CC[C@@H](CCC(F)(F)F)Nc1ccc2c(c1)NC(=O)CO2	ZINC000872056477	DH	On-Demand	Anodyne	NR3C2	30	45
COCC[S@](=O)Cc1cccc(N[C@H]2CCOC(C)(C)C2)c1	ZINC000872056489	EF	On-Demand	Anodyne	ICMT	45	33
COCC[S@@](=O)Cc1cccc(N[C@H]2CCOC(C)(C)C2)c1	ZINC000872056490	EF	On-Demand	Anodyne	ICMT	45	33
COCC[S@@](=O)Cc1cccc(N[C@@H]2CCOC(C)(C)C2)c1	ZINC000872056491	EF	On-Demand	Anodyne	ICMT	45	33
COCC[S@](=O)Cc1cccc(N[C@@H]2CCOC(C)(C)C2)c1	ZINC000872056492	EF	On-Demand	Anodyne	ICMT	45	33
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000872056499	FG	On-Demand	Anodyne	L3MBTL3	43	32
Cc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000872056500	FG	On-Demand	Anodyne	L3MBTL3	43	32
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(C)=O)c1	ZINC000872056516	CI	On-Demand	Anodyne	KCNK3	97	37
CC[C@H](CCC(F)(F)F)Nc1cccc(NC(C)=O)c1	ZINC000872056516	CI	On-Demand	Anodyne	KCNK9	70	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(C)=O)c1	ZINC000872056518	CI	On-Demand	Anodyne	KCNK3	97	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(NC(C)=O)c1	ZINC000872056518	CI	On-Demand	Anodyne	KCNK9	70	37
C[C@@H](Nc1cccc(N2CCOCC2)c1)c1cc(O)ccc1F	ZINC000872056614	DH	On-Demand	Anodyne	PIK3CD	18	42
C[C@@H](Nc1cccc(N2CCOCC2)c1)c1cc(O)ccc1F	ZINC000872056614	DH	On-Demand	Anodyne	PIK3CB	42	43
C[C@@H](Nc1ccc(N2CCOCC2)cn1)c1cc(O)ccc1F	ZINC000872056627	DF	On-Demand	Anodyne	STAT6	46	36
CC[C@H](CCC(F)(F)F)Nc1ccc(N2CCOCC2)cn1	ZINC000872056642	DG	On-Demand	Anodyne	STAT6	54	33
CC[C@@H](CCC(F)(F)F)Nc1ccc(N2CCOCC2)cn1	ZINC000872056644	DG	On-Demand	Anodyne	STAT6	54	33
NC(=O)C1CCN(Cc2cccc(N[C@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056676	FG	On-Demand	Anodyne	SIGMAR1	16	40
NC(=O)C1CCN(Cc2cccc(N[C@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056676	FG	On-Demand	Anodyne	MCHR1	18	40
NC(=O)C1CCN(Cc2cccc(N[C@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056676	FG	On-Demand	Anodyne	CACNA1G	19	40
NC(=O)C1CCN(Cc2cccc(N[C@@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056680	FG	On-Demand	Anodyne	SIGMAR1	16	40
NC(=O)C1CCN(Cc2cccc(N[C@@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056680	FG	On-Demand	Anodyne	MCHR1	18	40
NC(=O)C1CCN(Cc2cccc(N[C@@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872056680	FG	On-Demand	Anodyne	CACNA1G	19	40
CC[C@@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056713	FH	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056713	FH	On-Demand	Anodyne	MCHR1	27	40
CC[C@@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056713	FH	On-Demand	Anodyne	CACNA1G	43	44
CC[C@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056714	FH	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056714	FH	On-Demand	Anodyne	MCHR1	27	40
CC[C@H](CCC(F)(F)F)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000872056714	FH	On-Demand	Anodyne	CACNA1G	43	44
COc1ccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c(OC)c1	ZINC000872056877	DH	On-Demand	Bother	TAAR1	19	42
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	CHRM2	15	40
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	DRD2	17	46
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	TSHR	55	33
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	DRD4	44	46
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	ACHE	34	46
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	CHRM3	16	41
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	LTA4H	25	41
CC(=O)Nc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056944	EH	On-Demand	Anodyne	SIGMAR1	46	48
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	CHRM2	15	40
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	DRD2	17	46
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	TSHR	55	33
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	DRD4	44	46
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	ACHE	34	46
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	CHRM3	16	41
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	LTA4H	25	41
CC(=O)Nc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872056946	EH	On-Demand	Anodyne	SIGMAR1	46	48
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2cc(O)ccc2F)c1	ZINC000872057026	EH	On-Demand	Anodyne	KCNK3	56	36
CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C)c2cc(O)ccc2F)c1	ZINC000872057026	EH	On-Demand	Anodyne	KCNK9	62	36
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872057030	EH	On-Demand	Anodyne	KCNK3	56	36
CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C)c2cc(O)ccc2F)c1	ZINC000872057030	EH	On-Demand	Anodyne	KCNK9	62	36
O=C(Nc1ccc(N[C@H]2CCOC3(CCCC3)C2)cc1)N1CCCCCC1	ZINC000872057066	FJ	On-Demand	Anodyne	EPHX2	29	44
O=C(Nc1ccc(N[C@@H]2CCOC3(CCCC3)C2)cc1)N1CCCCCC1	ZINC000872057101	FJ	On-Demand	Anodyne	EPHX2	29	44
c1ccc(N2CCCC2)c(N[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872057113	DI	On-Demand	Anodyne	KCNQ2	60	36
CC[C@H](Nc1ccc(F)cc1OC)[C@H]1CCCOC1	ZINC000872057118	CG	On-Demand	Anodyne	GRIN2B	15	46
CC[C@@H](Nc1ccc(F)cc1OC)[C@@H]1CCCOC1	ZINC000872057119	CG	On-Demand	Anodyne	GRIN2B	15	46
CC[C@@H](Nc1ccc(F)cc1OC)[C@H]1CCCOC1	ZINC000872057121	CG	On-Demand	Anodyne	GRIN2B	15	46
CC[C@H](Nc1ccc(F)cc1OC)[C@@H]1CCCOC1	ZINC000872057122	CG	On-Demand	Anodyne	GRIN2B	15	46
c1ccc(N2CCCC2)c(N[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872057135	DI	On-Demand	Anodyne	KCNQ2	60	36
C[C@@H](Nc1ccc(CC(=O)N2CCOCC2)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057149	GG	On-Demand	Bother	COLA	48	32
CC(=O)Nc1cccc(N[C@H](COC(C)C)Cc2ccc(F)cc2)c1	ZINC000872057151	EI	On-Demand	Anodyne	KCNK3	93	42
CC(=O)Nc1cccc(N[C@H](COC(C)C)Cc2ccc(F)cc2)c1	ZINC000872057151	EI	On-Demand	Anodyne	KCNK9	80	37
CC(=O)Nc1cccc(N[C@@H](COC(C)C)Cc2ccc(F)cc2)c1	ZINC000872057157	EI	On-Demand	Anodyne	KCNK3	93	42
CC(=O)Nc1cccc(N[C@@H](COC(C)C)Cc2ccc(F)cc2)c1	ZINC000872057157	EI	On-Demand	Anodyne	KCNK9	80	37
C[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1cccc(O)c1F	ZINC000872057207	FG	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1cccc(O)c1F	ZINC000872057207	FG	On-Demand	Anodyne	MCHR1	26	42
C[C@@H](Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1cccc(O)c1F	ZINC000872057207	FG	On-Demand	Anodyne	CACNA1G	34	40
COc1cc2c(cc1OC)[C@@H](Nc1ccc(OCC(N)=O)cc1)CCCC2	ZINC000872057209	FG	On-Demand	Anodyne	HCRTR1	16	41
CC[C@@H](CCC(F)(F)F)NCC(=O)NCCc1ccccc1	ZINC000872057282	DG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CC[C@@H](CCC(F)(F)F)NCC(=O)NCCc1ccccc1	ZINC000872057282	DG	On-Demand	Anodyne	PDS	23	40
CC[C@H](Nc1cnn(Cc2ccccc2)c1)[C@@H]1CCCOC1	ZINC000872057283	CH	On-Demand	Anodyne	PANC	54	41
CC[C@@H](Nc1cnn(Cc2ccccc2)c1)[C@H]1CCCOC1	ZINC000872057285	CH	On-Demand	Anodyne	PANC	54	41
CC[C@@H](Nc1cnn(Cc2ccccc2)c1)[C@@H]1CCCOC1	ZINC000872057287	CH	On-Demand	Anodyne	PANC	54	41
CC[C@H](Nc1cnn(Cc2ccccc2)c1)[C@H]1CCCOC1	ZINC000872057289	CH	On-Demand	Anodyne	PANC	54	41
C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(O)c1F	ZINC000872057340	EI	On-Demand	Anodyne	CHRNA10	40	35
C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(O)c1F	ZINC000872057341	EI	On-Demand	Anodyne	CHRNA10	40	35
C[C@@H](Nc1ccc(CS(C)(=O)=O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057465	FG	On-Demand	Bother	COLA	56	34
OCCN1CCC(N[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872057471	DE	On-Demand	Anodyne	SIGMAR1	20	43
OCCN1CCC(N[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872057474	DE	On-Demand	Anodyne	SIGMAR1	20	43
NC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057482	EG	On-Demand	Anodyne	DRD4	32	44
NC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057482	EG	On-Demand	Anodyne	ACHE	31	41
NC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057482	EG	On-Demand	Anodyne	KCNH2	37	43
NC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057482	EG	On-Demand	Anodyne	SIGMAR1	36	45
NC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057482	EG	On-Demand	Anodyne	NPFFR1	43	37
NC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057484	EG	On-Demand	Anodyne	DRD4	32	44
NC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057484	EG	On-Demand	Anodyne	ACHE	31	41
NC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057484	EG	On-Demand	Anodyne	KCNH2	37	43
NC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057484	EG	On-Demand	Anodyne	SIGMAR1	36	45
NC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872057484	EG	On-Demand	Anodyne	NPFFR1	43	37
CC[C@H](Nc1cccc(OCC(N)=O)c1)C(C)(C)CC	ZINC000872057497	CG	On-Demand	Anodyne	PDS	70	37
CC[C@@H](Nc1cccc(OCC(N)=O)c1)C(C)(C)CC	ZINC000872057498	CG	On-Demand	Anodyne	PDS	70	37
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCc3nnc(C(C)C)n3C1)CCCC2	ZINC000872057499	GH	On-Demand	Anodyne	SLC18A2	40	33
C=CCNC(=O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057506	CD	On-Demand	Mild	COLA	57	33
C=CCNC(=O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057507	CD	On-Demand	Mild	COLA	57	33
COc1cc2c(cc1OC)[C@@H](N[C@H]1CCc3nnc(C(C)C)n3C1)CCCC2	ZINC000872057508	GH	On-Demand	Anodyne	SLC18A2	40	33
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	MME	71	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	TIMP3	70	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	GRIA1	40	32
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	REN	54	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	ACE2	44	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	NPR	41	33
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057520	EE	On-Demand	Anodyne	PSMB8	43	35
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	MME	71	43
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	TIMP3	70	36
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	GRIA1	40	32
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	REN	54	37
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	NPR	41	33
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@H]1CCCOC1	ZINC000872057522	EE	On-Demand	Anodyne	PSMB8	43	35
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	MME	71	43
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	TIMP3	70	36
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	GRIA1	40	32
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	REN	54	37
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	NPR	41	33
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057524	EE	On-Demand	Anodyne	PSMB8	43	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	MME	71	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	TIMP3	70	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	GRIA1	40	32
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	REN	54	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	ACE2	44	35
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	NPR	41	33
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCOC)[C@@H]1CCCOC1	ZINC000872057526	EE	On-Demand	Anodyne	PSMB8	43	35
CC[C@H](N[C@@]1(CO)CCCN(Cc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872057563	EF	On-Demand	Anodyne	NPFFR1	29	40
CC[C@H](N[C@@]1(CO)CCCN(Cc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872057565	EF	On-Demand	Anodyne	NPFFR1	29	40
CC[C@H](N[C@]1(CO)CCCN(Cc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872057567	EF	On-Demand	Anodyne	NPFFR1	29	40
CC[C@H](N[C@]1(CO)CCCN(Cc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872057568	EF	On-Demand	Anodyne	NPFFR1	29	40
C[C@@H](Nc1ccc(N2CCOCC2)cn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057618	EG	On-Demand	Bother	STAT6	44	35
COc1cccc(C2(N[C@H](C)c3c(F)cccc3[N+](=O)[O-])CC2)c1	ZINC000872057680	EI	On-Demand	Bother	TAAR1	20	40
COc1cccc(C2(N[C@@H](C)c3c(F)cccc3[N+](=O)[O-])CC2)c1	ZINC000872057681	EI	On-Demand	Bother	TAAR1	20	40
C[C@@H](NCCCn1cncn1)c1cc(O)ccc1F	ZINC000872057685	CD	On-Demand	Anodyne	HIS3	62	31
Fc1ccccc1-n1cc(N[C@H]2CCOC3(CCCC3)C2)cn1	ZINC000872057724	DH	On-Demand	Anodyne	NPY5R	29	44
Fc1ccccc1-n1cc(N[C@@H]2CCOC3(CCCC3)C2)cn1	ZINC000872057725	DH	On-Demand	Anodyne	NPY5R	29	44
COCC1(N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872057762	CG	On-Demand	Bother	CACNA1C	42	35
COCC1(N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872057762	CG	On-Demand	Bother	CACNA1D	61	33
COCC1(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872057763	CG	On-Demand	Bother	CACNA1C	42	35
COCC1(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000872057763	CG	On-Demand	Bother	CACNA1D	61	33
OCCn1cc(N[C@H]2CCCCc3ccccc3C2)cn1	ZINC000872057950	CF	On-Demand	Anodyne	PANC	40	31
OCCn1cc(N[C@@H]2CCCCc3ccccc3C2)cn1	ZINC000872057951	CF	On-Demand	Anodyne	PANC	40	31
OCCc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872057968	EH	On-Demand	Anodyne	SIGMAR1	42	39
C[C@@H](Nc1cccc(CN2CCC(CO)CC2)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872057996	GI	On-Demand	Bother	ACHE	22	44
CCNC(=O)C(C)(C)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872058031	DF	On-Demand	Bother	COLA	68	33
CCNC(=O)C(C)(C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872058032	DF	On-Demand	Bother	COLA	68	33
CC[C@H](CCC(F)(F)F)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000872058093	FH	On-Demand	Anodyne	LGMN	58	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000872058094	FH	On-Demand	Anodyne	LGMN	58	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000872058095	FH	On-Demand	Anodyne	LGMN	58	33
CC[C@H](CCC(F)(F)F)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000872058096	FH	On-Demand	Anodyne	LGMN	58	33
CCNC(=O)C(C)(C)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872058143	EG	On-Demand	Anodyne	NQO2	15	42
CCNC(=O)C(C)(C)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872058144	EG	On-Demand	Anodyne	NQO2	15	42
C[C@@H](Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(O)c1F	ZINC000872058224	FH	On-Demand	Anodyne	SIGMAR1	26	40
CC(=O)Nc1ccc(N[C@H](COC(C)C)Cc2ccc(F)cc2)cc1	ZINC000872058364	EI	On-Demand	Anodyne	NPY5R	20	45
CC(=O)Nc1ccc(N[C@@H](COC(C)C)Cc2ccc(F)cc2)cc1	ZINC000872058365	EI	On-Demand	Anodyne	NPY5R	20	45
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	MME	88	45
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	ANPEP	41	32
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	FCER2	40	32
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	PAPA1_CARPA	47	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	CAPNS1	51	32
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	CAPN1	29	43
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cccc(O)c1F	ZINC000872058392	FE	On-Demand	Anodyne	ACE2	45	36
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058514	DI	On-Demand	Anodyne	MAPK14	42	39
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058514	DI	On-Demand	Anodyne	MAPK13	41	32
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058514	DI	On-Demand	Anodyne	CCR2	52	42
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058514	DI	On-Demand	Anodyne	KCNK3	41	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058515	DI	On-Demand	Anodyne	MAPK14	42	39
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058515	DI	On-Demand	Anodyne	MAPK13	41	32
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058515	DI	On-Demand	Anodyne	CCR2	52	42
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872058515	DI	On-Demand	Anodyne	KCNK3	41	33
COc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872058577	GG	On-Demand	Anodyne	LRRK2	35	45
COc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872058578	GG	On-Demand	Anodyne	LRRK2	35	45
COc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872058579	GG	On-Demand	Anodyne	LRRK2	35	45
COc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872058580	GG	On-Demand	Anodyne	LRRK2	35	45
C[C@H]1C[C@H](Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC(C)(C)C1	ZINC000872058610	EH	On-Demand	Anodyne	EPHX2	15	45
C[C@H]1C[C@H](Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC(C)(C)C1	ZINC000872058610	EH	On-Demand	Anodyne	L3MBTL3	44	39
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)[C@@H]1CCCOC1	ZINC000872058770	FE	On-Demand	Anodyne	MME	59	43
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)[C@@H]1CCCOC1	ZINC000872058772	FE	On-Demand	Anodyne	MME	59	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)[C@H]1CCCOC1	ZINC000872058774	FE	On-Demand	Anodyne	MME	59	43
CC[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)[C@H]1CCCOC1	ZINC000872058776	FE	On-Demand	Anodyne	MME	59	43
CCCNC(=O)c1cccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872058856	EI	On-Demand	Bother	TAAR1	19	40
CCCNC(=O)c1cccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872058857	EI	On-Demand	Bother	TAAR1	19	40
O=C(c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCCCC1	ZINC000872058986	EI	On-Demand	Anodyne	PREP	21	41
O=C(c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCCCC1	ZINC000872058986	EI	On-Demand	Anodyne	L3MBTL3	55	41
O=C(c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCCCC1	ZINC000872058987	EI	On-Demand	Anodyne	PREP	21	41
O=C(c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCCCC1	ZINC000872058987	EI	On-Demand	Anodyne	L3MBTL3	55	41
CC[C@@H](Nc1cc(C(=O)N2CCCC2)ccc1OC)[C@H]1CCCOC1	ZINC000872059020	EH	On-Demand	Anodyne	L3MBTL3	56	33
CC[C@@H](Nc1cc(C(=O)N2CCCC2)ccc1OC)[C@@H]1CCCOC1	ZINC000872059021	EH	On-Demand	Anodyne	L3MBTL3	56	33
CC[C@H](Nc1cc(C(=O)N2CCCC2)ccc1OC)[C@H]1CCCOC1	ZINC000872059022	EH	On-Demand	Anodyne	L3MBTL3	56	33
CC[C@H](Nc1cc(C(=O)N2CCCC2)ccc1OC)[C@@H]1CCCOC1	ZINC000872059023	EH	On-Demand	Anodyne	L3MBTL3	56	33
COc1ccc(N[C@H]2CCOC3(CCCC3)C2)cc1CO	ZINC000872059024	CG	On-Demand	Anodyne	QRFPR	42	34
COc1ccc(N[C@@H]2CCOC3(CCCC3)C2)cc1CO	ZINC000872059025	CG	On-Demand	Anodyne	QRFPR	42	34
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cc(O)ccc1F	ZINC000872059166	EG	On-Demand	Anodyne	PIK3CA	15	42
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cc(O)ccc1F	ZINC000872059166	EG	On-Demand	Anodyne	PIK3CD	22	42
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cc(O)ccc1F	ZINC000872059166	EG	On-Demand	Anodyne	PIK3CB	54	43
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cc(O)ccc1F	ZINC000872059167	EG	On-Demand	Anodyne	PIK3CA	15	42
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cc(O)ccc1F	ZINC000872059167	EG	On-Demand	Anodyne	PIK3CD	22	42
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cc(O)ccc1F	ZINC000872059167	EG	On-Demand	Anodyne	PIK3CB	54	43
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872059176	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872059176	FH	On-Demand	Anodyne	L3MBTL3	47	34
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872059177	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCO[C@H](C(C)(C)C)C1	ZINC000872059177	FH	On-Demand	Anodyne	L3MBTL3	47	34
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872059178	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872059178	FH	On-Demand	Anodyne	L3MBTL3	47	34
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872059179	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000872059179	FH	On-Demand	Anodyne	L3MBTL3	47	34
C[C@@H](NCC(=O)NCC1CC1)c1cc(O)ccc1F	ZINC000872059230	CD	On-Demand	Anodyne	CACNA1I	53	33
C[C@H](NCC(=O)NCC1CC1)c1cc(O)ccc1F	ZINC000872059231	CD	On-Demand	Anodyne	CACNA1I	53	33
C=CCS(=O)(=O)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059254	DD	On-Demand	Mild	COLA	44	31
C=CCS(=O)(=O)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059255	DD	On-Demand	Mild	COLA	44	31
Cc1ccc(C(=O)N(C)C)cc1N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059342	EH	On-Demand	Bother	COLA	40	33
Cc1ccc(C(=O)N(C)C)cc1N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059343	EH	On-Demand	Bother	COLA	40	33
Cn1nnnc1-c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872059352	DF	On-Demand	Anodyne	CCR3	56	38
Cn1nnnc1-c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872059353	DF	On-Demand	Anodyne	CCR3	56	38
CC[C@H](CCC(F)(F)F)Nc1ccc(C)c(C(=O)N(C)C)c1	ZINC000872059358	DI	On-Demand	Anodyne	CXCR2	47	36
CC[C@H](CCC(F)(F)F)Nc1ccc(C)c(C(=O)N(C)C)c1	ZINC000872059358	DI	On-Demand	Anodyne	CXCR1	49	36
CC[C@@H](CCC(F)(F)F)Nc1ccc(C)c(C(=O)N(C)C)c1	ZINC000872059359	DI	On-Demand	Anodyne	CXCR2	47	36
CC[C@@H](CCC(F)(F)F)Nc1ccc(C)c(C(=O)N(C)C)c1	ZINC000872059359	DI	On-Demand	Anodyne	CXCR1	49	36
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cccc(O)c1F	ZINC000872059371	FF	On-Demand	Anodyne	EPHX2	22	40
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cccc(O)c1F	ZINC000872059371	FF	On-Demand	Anodyne	PIK3CB	41	36
CC[C@H](Nc1cccc(C(=O)N2CCCCC2)c1)[C@H]1CCCOC1	ZINC000872059376	EH	On-Demand	Anodyne	L3MBTL3	50	39
CC[C@@H](Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1CCCOC1	ZINC000872059377	EH	On-Demand	Anodyne	L3MBTL3	50	39
CC[C@H](Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1CCCOC1	ZINC000872059378	EH	On-Demand	Anodyne	L3MBTL3	50	39
CC[C@@H](Nc1cccc(C(=O)N2CCCCC2)c1)[C@H]1CCCOC1	ZINC000872059379	EH	On-Demand	Anodyne	L3MBTL3	50	39
NC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059568	FG	On-Demand	Anodyne	DRD4	29	46
NC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059568	FG	On-Demand	Anodyne	SIGMAR1	32	47
NC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059568	FG	On-Demand	Anodyne	NPFFR1	43	36
NC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059569	FG	On-Demand	Anodyne	DRD4	29	46
NC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059569	FG	On-Demand	Anodyne	SIGMAR1	32	47
NC(=O)Nc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872059569	FG	On-Demand	Anodyne	NPFFR1	43	36
CC[C@@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)[C@H]1CCCOC1	ZINC000872059580	GD	On-Demand	Anodyne	DGAT1	21	40
CC[C@@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)[C@@H]1CCCOC1	ZINC000872059581	GD	On-Demand	Anodyne	DGAT1	21	40
CC[C@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)[C@H]1CCCOC1	ZINC000872059582	GD	On-Demand	Anodyne	DGAT1	21	40
CC[C@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)[C@@H]1CCCOC1	ZINC000872059583	GD	On-Demand	Anodyne	DGAT1	21	40
Cn1nnnc1-c1cccc(N[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872059600	DF	On-Demand	Anodyne	CCR3	56	38
Cn1nnnc1-c1cccc(N[C@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872059601	DF	On-Demand	Anodyne	CCR3	56	38
Cn1nnnc1-c1cccc(N[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872059602	DF	On-Demand	Anodyne	CCR3	56	38
Cn1nnnc1-c1cccc(N[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872059603	DF	On-Demand	Anodyne	CCR3	56	38
COc1ccc(C(=O)N2CCOCC2)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000872059604	FG	On-Demand	Anodyne	LRRK2	33	46
COc1ccc(C(=O)N2CCOCC2)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000872059605	FG	On-Demand	Anodyne	LRRK2	33	46
C[C@@H](NCC(=O)NCC1CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059694	CD	On-Demand	Bother	COLA	42	31
C[C@H](NCC(=O)NCC1CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872059695	CD	On-Demand	Bother	COLA	42	31
CC[C@@H](CCC(F)(F)F)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000872059732	FG	On-Demand	Anodyne	EPHX2	26	40
CC[C@H](CCC(F)(F)F)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000872059733	FG	On-Demand	Anodyne	EPHX2	26	40
CC[C@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872059838	FF	On-Demand	Anodyne	MTOR	80	36
CC[C@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872059839	FF	On-Demand	Anodyne	MTOR	80	36
CC[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872059842	FF	On-Demand	Anodyne	MTOR	80	36
CC[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872059843	FF	On-Demand	Anodyne	MTOR	80	36
CC[C@H](Nc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCOC1	ZINC000872059845	DG	On-Demand	Anodyne	NPY2R	63	46
CC[C@@H](Nc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCOC1	ZINC000872059847	DG	On-Demand	Anodyne	NPY2R	63	46
CC[C@@H](Nc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCOC1	ZINC000872059848	DG	On-Demand	Anodyne	NPY2R	63	46
CC[C@H](Nc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCOC1	ZINC000872059850	DG	On-Demand	Anodyne	NPY2R	63	46
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000872059883	GF	On-Demand	Clean	MMP3	17	44
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000872059883	GF	On-Demand	Clean	MMP1	16	44
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000872059884	GF	On-Demand	Clean	MMP3	17	44
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000872059884	GF	On-Demand	Clean	MMP1	16	44
COc1ccc(N[C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1CO	ZINC000872059942	CG	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(N[C@H]2CCO[C@@H](C(C)(C)C)C2)cc1CO	ZINC000872059943	CG	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(N[C@H]2CCO[C@H](C(C)(C)C)C2)cc1CO	ZINC000872059944	CG	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(N[C@@H]2CCO[C@H](C(C)(C)C)C2)cc1CO	ZINC000872059945	CG	On-Demand	Anodyne	QRFPR	40	33
COC[C@@H](CN[C@@H]1CCCCc2cc(OC)c(OC)cc21)OC	ZINC000872059964	DF	On-Demand	Anodyne	SLC18A2	45	33
COC[C@@H](CN[C@H]1CCCCc2cc(OC)c(OC)cc21)OC	ZINC000872059967	DF	On-Demand	Anodyne	SLC18A2	45	33
C[S@@](=O)Cc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060284	FH	On-Demand	Anodyne	SIGMAR1	26	40
C[S@@](=O)Cc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060285	FH	On-Demand	Anodyne	SIGMAR1	26	40
C[S@](=O)Cc1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060286	FH	On-Demand	Anodyne	SIGMAR1	26	40
C[S@](=O)Cc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060287	FH	On-Demand	Anodyne	SIGMAR1	26	40
NC(=O)CNC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060310	GE	On-Demand	Anodyne	DRD4	23	41
NC(=O)CNC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060310	GE	On-Demand	Anodyne	ACHE	23	43
NC(=O)CNC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060310	GE	On-Demand	Anodyne	SIGMAR1	22	44
NC(=O)CNC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060310	GE	On-Demand	Anodyne	CCR2	31	43
NC(=O)CNC(=O)c1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060310	GE	On-Demand	Anodyne	NPFFR1	49	37
NC(=O)CNC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060311	GE	On-Demand	Anodyne	DRD4	23	41
NC(=O)CNC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060311	GE	On-Demand	Anodyne	ACHE	23	43
NC(=O)CNC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060311	GE	On-Demand	Anodyne	SIGMAR1	22	44
NC(=O)CNC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060311	GE	On-Demand	Anodyne	CCR2	31	43
NC(=O)CNC(=O)c1cccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872060311	GE	On-Demand	Anodyne	NPFFR1	49	37
O=C(NCCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1cc[nH]n1	ZINC000872060378	FD	On-Demand	Anodyne	ACHE	18	45
O=C(NCCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1cc[nH]n1	ZINC000872060379	FD	On-Demand	Anodyne	ACHE	18	45
COc1ccc(N[C@@H]2CCOC(C)(C)C2)cc1CO	ZINC000872060410	CF	On-Demand	Anodyne	QRFPR	41	34
COc1ccc(N[C@H]2CCOC(C)(C)C2)cc1CO	ZINC000872060411	CF	On-Demand	Anodyne	QRFPR	41	34
C[C@@H](Nc1cccc(C(=O)NC2CC2)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872060462	EH	On-Demand	Bother	MAPK13	53	34
COc1cc2c(cc1OC)[C@@H](NCCCOCCO)CCCC2	ZINC000872060534	DE	On-Demand	Anodyne	SLC18A2	45	34
COc1ccc(N2CCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1	ZINC000872060548	GE	On-Demand	Clean	MMP13	16	40
COc1ccc(N2CCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1	ZINC000872060548	GE	On-Demand	Clean	SSTR1	40	35
COc1ccc(N2CCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1	ZINC000872060548	GE	On-Demand	Clean	MMP1	15	40
COc1cc2c(cc1OC)[C@@H](NCCCC#N)CCCC2	ZINC000872060553	CG	On-Demand	Mild	SLC18A2	46	36
O=C(Cn1cc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060581	GE	On-Demand	Anodyne	DRD4	18	44
O=C(Cn1cc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060581	GE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(Cn1cc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060581	GE	On-Demand	Anodyne	PANC	41	35
O=C(Cn1cc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060582	GE	On-Demand	Anodyne	DRD4	18	44
O=C(Cn1cc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060582	GE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(Cn1cc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cn1)NC1CC1	ZINC000872060582	GE	On-Demand	Anodyne	PANC	41	35
O=C(CCCCN[C@H]1CCOC2(CCCC2)C1)OCc1ccccc1	ZINC000872060587	EH	On-Demand	Anodyne	SLC12A5	49	34
O=C(CCCCN[C@@H]1CCOC2(CCCC2)C1)OCc1ccccc1	ZINC000872060588	EH	On-Demand	Anodyne	SLC12A5	49	34
CC[C@H](Nc1ccc(N2CCOC[C@@H]2C)cc1)[C@H]1CCCOC1	ZINC000872060646	DH	On-Demand	Anodyne	MTOR	42	36
CC[C@H](Nc1ccc(N2CCOC[C@@H]2C)cc1)[C@@H]1CCCOC1	ZINC000872060647	DH	On-Demand	Anodyne	MTOR	42	36
CC[C@H](Nc1ccc(N2CCOC[C@H]2C)cc1)[C@H]1CCCOC1	ZINC000872060648	DH	On-Demand	Anodyne	MTOR	42	36
CC[C@H](Nc1ccc(N2CCOC[C@H]2C)cc1)[C@@H]1CCCOC1	ZINC000872060649	DH	On-Demand	Anodyne	MTOR	42	36
C[C@@H](Nc1ccc(CN(C)C)c(F)c1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872060680	EI	On-Demand	Bother	COLA	100	36
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cc(O)ccc1F	ZINC000872060695	FF	On-Demand	Anodyne	PIK3CA	19	40
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cc(O)ccc1F	ZINC000872060695	FF	On-Demand	Anodyne	PIK3CD	20	40
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cc(O)ccc1F	ZINC000872060695	FF	On-Demand	Anodyne	EPHX2	23	42
C[C@@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cc(O)ccc1F	ZINC000872060695	FF	On-Demand	Anodyne	PIK3CB	43	40
C[C@@H](Nc1cccc(OCCN(C)C)c1)c1cccc(O)c1F	ZINC000872060718	DH	On-Demand	Anodyne	ESRRG	43	34
CC[C@H](Nc1cnn(CC(=O)NC2CC2)c1)C(C)(C)CC	ZINC000872060764	CF	On-Demand	Anodyne	PANC	50	32
CC[C@@H](Nc1cnn(CC(=O)NC2CC2)c1)C(C)(C)CC	ZINC000872060765	CF	On-Demand	Anodyne	PANC	50	32
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	OPRM1	19	41
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	GHRHR	62	33
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	MC4R	45	39
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	TACR2	40	40
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	CTSS	21	40
O=C([C@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060810	FF	On-Demand	Anodyne	PGA5	42	32
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	OPRM1	19	41
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	GHRHR	62	33
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	MC4R	45	39
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	TACR2	40	40
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	CTSS	21	40
O=C([C@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060811	FF	On-Demand	Anodyne	PGA5	42	32
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	OPRM1	19	41
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	GHRHR	62	33
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	MC4R	45	39
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	TACR2	40	40
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	CTSS	21	40
O=C([C@@H](Cc1ccccc1)N[C@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060812	FF	On-Demand	Anodyne	PGA5	42	32
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	OPRM1	19	41
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	GHRHR	62	33
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	MC4R	45	39
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	TACR2	40	40
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	CTSS	21	40
O=C([C@@H](Cc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1)N1CCOCC1	ZINC000872060813	FF	On-Demand	Anodyne	PGA5	42	32
C[C@@H](NCCNC(=O)c1cc[nH]n1)c1cc(O)ccc1F	ZINC000872060816	CD	On-Demand	Anodyne	ALPL	44	33
Fc1cccc(NCCCN[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872060869	DH	On-Demand	Anodyne	ICMT	55	42
Fc1cccc(NCCCN[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872060870	DH	On-Demand	Anodyne	ICMT	55	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	ACE	43	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	MME	57	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	MC4R	40	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	TRY2_BOVIN	83	43
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	CYSP_TRYCR	33	45
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	CTSS	19	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060877	FF	On-Demand	Anodyne	ACE2	52	35
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	ACE	43	38
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	MME	57	38
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	MC4R	40	38
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	TRY2_BOVIN	83	43
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	CYSP_TRYCR	33	45
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	CTSS	19	42
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccc(O)c1F	ZINC000872060879	FF	On-Demand	Anodyne	ACE2	52	35
N#Cc1cccc(NC2CCN(C=O)CC2)c1	ZINC000872060895	BD	On-Demand	Mild	CCR3	17	42
N#Cc1cccc(NC2CCN(C=O)CC2)c1	ZINC000872060895	BD	On-Demand	Mild	MLNR	15	47
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000872060958	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000872060958	FH	On-Demand	Anodyne	L3MBTL3	52	34
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000872060959	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000872060959	FH	On-Demand	Anodyne	L3MBTL3	52	34
O=C(c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)N1CCC(O)CC1	ZINC000872060974	FG	On-Demand	Anodyne	L3MBTL3	50	40
O=C(c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)N1CCC(O)CC1	ZINC000872060975	FG	On-Demand	Anodyne	L3MBTL3	50	40
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)N(C)C)c1	ZINC000872060986	DH	On-Demand	Anodyne	CXCR2	44	33
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)N(C)C)c1	ZINC000872060986	DH	On-Demand	Anodyne	CXCR1	44	37
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)N(C)C)c1	ZINC000872060987	DH	On-Demand	Anodyne	CXCR2	44	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)N(C)C)c1	ZINC000872060987	DH	On-Demand	Anodyne	CXCR1	44	37
CC[C@H](NCc1ccccc1N1CCCCC1)[C@@H]1CCCOC1	ZINC000872061051	DH	On-Demand	Anodyne	KCNQ2	52	35
CC[C@H](NCc1ccccc1N1CCCCC1)[C@H]1CCCOC1	ZINC000872061052	DH	On-Demand	Anodyne	KCNQ2	52	35
CC[C@@H](NCc1ccccc1N1CCCCC1)[C@H]1CCCOC1	ZINC000872061053	DH	On-Demand	Anodyne	KCNQ2	52	35
CC[C@@H](NCc1ccccc1N1CCCCC1)[C@@H]1CCCOC1	ZINC000872061054	DH	On-Demand	Anodyne	KCNQ2	52	35
Cc1nc(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])n[nH]1	ZINC000872061079	CE	On-Demand	Bother	COLA	65	35
Cc1nc(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])n[nH]1	ZINC000872061080	CE	On-Demand	Bother	COLA	65	35
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC1CC1	ZINC000872061127	EE	On-Demand	Anodyne	DRD4	20	42
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC1CC1	ZINC000872061127	EE	On-Demand	Anodyne	ACHE	23	44
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC1CC1	ZINC000872061127	EE	On-Demand	Anodyne	AVPR1B	17	40
O=C(CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)NCC1CC1	ZINC000872061127	EE	On-Demand	Anodyne	SIGMAR1	31	40
O=C(Cc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1)NCCO	ZINC000872061230	GF	On-Demand	Anodyne	ACHE	21	40
O=C(Cc1ccc(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1)NCCO	ZINC000872061230	GF	On-Demand	Anodyne	SIGMAR1	30	44
O=C(Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1)NCCO	ZINC000872061231	GF	On-Demand	Anodyne	ACHE	21	40
O=C(Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1)NCCO	ZINC000872061231	GF	On-Demand	Anodyne	SIGMAR1	30	44
Cc1ccc(C(=O)N(C)C)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000872061270	DH	On-Demand	Anodyne	MAPK11	21	41
Cc1ccc(C(=O)N(C)C)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000872061271	DH	On-Demand	Anodyne	MAPK11	21	41
CC[C@@H](CCC(F)(F)F)NC1CCC(O)(c2ccccc2)CC1	ZINC000872061467	EJ	On-Demand	Anodyne	OPRL1	20	40
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	ACE	41	37
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	GHRHR	51	32
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	MME	62	37
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CTSB	21	43
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	TRY2_BOVIN	67	39
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CYSP_TRYCR	53	48
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CTSF	46	43
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CTSL	22	43
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	REN	31	44
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CTSS	32	48
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	ACE2	57	35
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	PGA5	43	34
CC[C@@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061491	FG	On-Demand	Anodyne	CTRB_BOVIN	43	30
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	ACE	41	37
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	GHRHR	51	32
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	MME	62	37
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CTSB	21	43
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	TRY2_BOVIN	67	39
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CYSP_TRYCR	53	48
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CTSF	46	43
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CTSL	22	43
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	REN	31	44
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CTSS	32	48
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	ACE2	57	35
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](CCC(F)(F)F)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061492	FG	On-Demand	Anodyne	CTRB_BOVIN	43	30
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	ACE	41	37
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	GHRHR	51	32
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	MME	62	37
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CTSB	21	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	TRY2_BOVIN	67	39
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CYSP_TRYCR	53	48
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CTSF	46	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CTSL	22	43
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	REN	31	44
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CTSS	32	48
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	ACE2	57	35
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	PGA5	43	34
CC[C@@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061493	FG	On-Demand	Anodyne	CTRB_BOVIN	43	30
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	ACE	41	37
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	GHRHR	51	32
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	MME	62	37
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CTSB	21	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	TRY2_BOVIN	67	39
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CYSP_TRYCR	53	48
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CTSF	46	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CTSL	22	43
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	REN	31	44
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CTSS	32	48
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	ACE2	57	35
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	PGA5	43	34
CC[C@H](CCC(F)(F)F)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000872061494	FG	On-Demand	Anodyne	CTRB_BOVIN	43	30
O=C(Nc1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1)c1ccoc1	ZINC000872061629	EI	On-Demand	Anodyne	KCNK3	73	52
O=C(Nc1cccc(N[C@H]2CCOC3(CCCC3)C2)c1)c1ccoc1	ZINC000872061630	EI	On-Demand	Anodyne	KCNK3	73	52
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cccc(O)c1F	ZINC000872061637	EG	On-Demand	Anodyne	PIK3CA	15	41
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cccc(O)c1F	ZINC000872061637	EG	On-Demand	Anodyne	PIK3CD	18	41
Cc1nc(N2CCOCC2)ccc1N[C@H](C)c1cccc(O)c1F	ZINC000872061637	EG	On-Demand	Anodyne	PIK3CB	52	43
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cccc(O)c1F	ZINC000872061638	EG	On-Demand	Anodyne	PIK3CA	15	41
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cccc(O)c1F	ZINC000872061638	EG	On-Demand	Anodyne	PIK3CD	18	41
Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1cccc(O)c1F	ZINC000872061638	EG	On-Demand	Anodyne	PIK3CB	52	43
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	ACE	49	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	OPRM1	40	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	OPRD1	33	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	MME	65	38
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	MC4R	87	41
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	CTSB	17	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	TRY2_BOVIN	96	44
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	CYSP_TRYCR	40	44
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	CTSS	21	42
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	ACE2	59	34
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061713	FF	On-Demand	Anodyne	ST14	65	37
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	ACE	49	38
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	OPRM1	40	42
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	OPRD1	33	42
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	MME	65	38
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	MC4R	87	41
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	CTSB	17	42
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	TRY2_BOVIN	96	44
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	CYSP_TRYCR	40	44
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	CTSS	21	42
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	ACE2	59	34
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(O)ccc1F	ZINC000872061718	FF	On-Demand	Anodyne	ST14	65	37
COc1cc2c(cc1OC)[C@@H](NCc1ccc3c(c1)C(=O)NCC3)CCCC2	ZINC000872061720	GH	On-Demand	Anodyne	CSNK1G2	65	34
C[C@@H](Nc1cccc(OCCN(C)C)c1)c1cc(O)ccc1F	ZINC000872061768	DH	On-Demand	Anodyne	ESRRG	47	37
COc1ccc(N[C@H]2CCOC(C)(C)C2)cc1NC(=O)C1CCCCC1	ZINC000872061831	FJ	On-Demand	Anodyne	STK17B	44	43
COc1ccc(N[C@H]2CCOC(C)(C)C2)cc1NC(=O)C1CCCCC1	ZINC000872061831	FJ	On-Demand	Anodyne	STK17A	15	40
COc1ccc(N[C@@H]2CCOC(C)(C)C2)cc1NC(=O)C1CCCCC1	ZINC000872061832	FJ	On-Demand	Anodyne	STK17B	44	43
COc1ccc(N[C@@H]2CCOC(C)(C)C2)cc1NC(=O)C1CCCCC1	ZINC000872061832	FJ	On-Demand	Anodyne	STK17A	15	40
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1nn(C)c2ccccc12	ZINC000872062022	FI	On-Demand	Bother	F2RL3	51	38
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1nn(C)c2ccccc12	ZINC000872062023	FI	On-Demand	Bother	F2RL3	51	38
C=CC[C@H](CO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062028	CE	On-Demand	Mild	COLA	62	32
C=CC[C@H](CO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062030	CE	On-Demand	Mild	COLA	62	32
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872062171	EG	On-Demand	Anodyne	CACNA1I	51	32
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(O)c1F	ZINC000872062171	EG	On-Demand	Anodyne	GPR119	39	49
C[C@@H](NCC1(CO)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062272	CF	On-Demand	Bother	COLA	42	33
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	ACE	66	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	GHRHR	51	30
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	MME	61	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	CTSD	30	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	TRY2_BOVIN	56	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	CYSP_TRYCR	20	46
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	REN	54	50
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	CTSS	27	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	ACE2	59	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062298	FE	On-Demand	Anodyne	PGA5	47	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	ACE	66	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	GHRHR	51	30
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	MME	61	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	CTSD	30	43
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	TRY2_BOVIN	56	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	CYSP_TRYCR	20	46
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	REN	54	50
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	CTSS	27	43
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	ACE2	59	36
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCOC1	ZINC000872062299	FE	On-Demand	Anodyne	PGA5	47	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	ACE	66	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	GHRHR	51	30
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	MME	61	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	CTSD	30	43
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	TRY2_BOVIN	56	37
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	CYSP_TRYCR	20	46
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	REN	54	50
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	CTSS	27	43
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	ACE2	59	36
CC[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062300	FE	On-Demand	Anodyne	PGA5	47	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	ACE	66	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	GHRHR	51	30
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	MME	61	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	CTSD	30	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	TRY2_BOVIN	56	37
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	CYSP_TRYCR	20	46
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	REN	54	50
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	CTSS	27	43
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	ACE2	59	36
CC[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCOC1	ZINC000872062302	FE	On-Demand	Anodyne	PGA5	47	37
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CCCOC1	ZINC000872062451	GI	On-Demand	Anodyne	RBP4	64	41
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CCCOC1	ZINC000872062451	GI	On-Demand	Anodyne	SCD1	21	41
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CCCOC1	ZINC000872062451	GI	On-Demand	Anodyne	SFRP1	102	38
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CCCOC1	ZINC000872062451	GI	On-Demand	Anodyne	WNT3	76	34
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CCCOC1	ZINC000872062452	GI	On-Demand	Anodyne	RBP4	64	41
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CCCOC1	ZINC000872062452	GI	On-Demand	Anodyne	SCD1	21	41
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CCCOC1	ZINC000872062452	GI	On-Demand	Anodyne	SFRP1	102	38
CC[C@@H](NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CCCOC1	ZINC000872062452	GI	On-Demand	Anodyne	WNT3	76	34
CCOC(=O)N1CCC([C@@H](C)N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872062486	EG	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CCC([C@@H](C)N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872062487	EG	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CCC([C@H](C)N[C@H](C)c2cccc(O)c2F)CC1	ZINC000872062488	EG	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CCC([C@H](C)N[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872062489	EG	On-Demand	Anodyne	GPR119	28	42
COc1cc2c(cc1OC)[C@@H](NC[C@@]1(O)CCN(C)C1)CCCC2	ZINC000872062725	EE	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)[C@@H](NC[C@]1(O)CCN(C)C1)CCCC2	ZINC000872062726	EE	On-Demand	Anodyne	SLC18A2	40	35
CC[C@H](CCC(F)(F)F)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000872062750	EH	On-Demand	Anodyne	EIF2AK3	47	37
CC[C@@H](CCC(F)(F)F)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000872062753	EH	On-Demand	Anodyne	EIF2AK3	47	37
C[C@H](NC[C@H](O)CCc1ccccc1)c1cccc(O)c1F	ZINC000872062817	DG	On-Demand	Anodyne	ADRB2	16	41
C[C@@H](NC[C@@H](O)CCc1ccccc1)c1cccc(O)c1F	ZINC000872062818	DG	On-Demand	Anodyne	ADRB2	16	41
C[C@@H](NCC(F)(F)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062864	CE	On-Demand	Bother	COLA	61	35
C[C@@H](NCCC(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062922	CF	On-Demand	Bother	COLA	74	33
C[C@H](NC[C@H](O)CCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062951	EG	On-Demand	Bother	COLA	100	36
C[C@@H](NC[C@@H](O)CCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062952	EG	On-Demand	Bother	COLA	100	36
CC[C@H](Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1)[C@@H]1CCCOC1	ZINC000872062973	GI	On-Demand	Anodyne	MTOR	30	43
CC[C@H](Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1)[C@H]1CCCOC1	ZINC000872062974	GI	On-Demand	Anodyne	MTOR	30	43
CC[C@@H](Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1)[C@H]1CCCOC1	ZINC000872062975	GI	On-Demand	Anodyne	MTOR	30	43
CC[C@@H](Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1)[C@@H]1CCCOC1	ZINC000872062976	GI	On-Demand	Anodyne	MTOR	30	43
C[C@@H](NCC1(CO)CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063001	CF	On-Demand	Bother	COLA	42	33
C[C@H](NC1CCC(O)(c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872063026	EI	On-Demand	Anodyne	OPRL1	17	40
C[C@@H](NC1CCC(O)(c2ccccc2)CC1)c1cccc(O)c1F	ZINC000872063027	EI	On-Demand	Anodyne	OPRL1	17	40
CCN(C)C(=O)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063074	CD	On-Demand	Bother	COLA	101	35
CCN(C)C(=O)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063075	CD	On-Demand	Bother	COLA	101	35
COc1cc2c(cc1OC)[C@@H](NCC(F)(F)CO)CCCC2	ZINC000872063313	DF	On-Demand	Anodyne	SLC18A2	44	31
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872063364	EG	On-Demand	Anodyne	CACNA1I	66	35
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1F	ZINC000872063364	EG	On-Demand	Anodyne	GPR119	44	48
C/C=C\C[C@H](CO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063662	CF	On-Demand	Bother	COLA	53	31
C/C=C\C[C@H](CO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063663	CF	On-Demand	Bother	COLA	53	31
C/C=C/C[C@H](CO)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063664	CF	On-Demand	Bother	COLA	53	31
C/C=C/C[C@H](CO)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063665	CF	On-Demand	Bother	COLA	53	31
C[C@H](NC1CCC(O)(c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872063780	EI	On-Demand	Anodyne	OPRL1	15	41
C[C@@H](NC1CCC(O)(c2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872063781	EI	On-Demand	Anodyne	OPRL1	15	41
C[C@H](N[C@H](C)CNC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063838	EG	On-Demand	Bother	COLA	59	37
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CCN1CCN(C)CC1	ZINC000872063839	FF	On-Demand	Bother	KCNJ1	25	42
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CCN1CCN(C)CC1	ZINC000872063840	FF	On-Demand	Bother	KCNJ1	25	42
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CCN1CCN(C)CC1	ZINC000872063841	FF	On-Demand	Bother	KCNJ1	25	42
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CCN1CCN(C)CC1	ZINC000872063842	FF	On-Demand	Bother	KCNJ1	25	42
C[C@@H](NCCCCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872063888	EF	On-Demand	Bother	COLA	60	33
C[C@H](N[C@H](C)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872064014	CH	On-Demand	Bother	COLA	41	34
CCOC(=O)N1CCC([C@@H](C)N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872064080	EG	On-Demand	Anodyne	GPR119	33	43
CCOC(=O)N1CCC([C@@H](C)N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872064081	EG	On-Demand	Anodyne	GPR119	33	43
CCOC(=O)N1CCC([C@H](C)N[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872064082	EG	On-Demand	Anodyne	GPR119	33	43
CCOC(=O)N1CCC([C@H](C)N[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872064083	EG	On-Demand	Anodyne	GPR119	33	43
CC[C@@H](CCC(F)(F)F)NC1(C(=O)Nc2ccccc2)CC1	ZINC000872064116	DH	On-Demand	Anodyne	TIMP3	40	31
CC[C@@H](CCC(F)(F)F)NC1(C(=O)Nc2ccccc2)CC1	ZINC000872064116	DH	On-Demand	Anodyne	NPPA	42	33
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064213	EH	On-Demand	Anodyne	MAPK11	30	45
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064213	EH	On-Demand	Anodyne	MAPK14	27	47
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064213	EH	On-Demand	Anodyne	CACNA1I	42	34
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064214	EH	On-Demand	Anodyne	MAPK11	30	45
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064214	EH	On-Demand	Anodyne	MAPK14	27	47
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@@H]1CCCOC1	ZINC000872064214	EH	On-Demand	Anodyne	CACNA1I	42	34
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064215	EH	On-Demand	Anodyne	MAPK11	30	45
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064215	EH	On-Demand	Anodyne	MAPK14	27	47
CC[C@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064215	EH	On-Demand	Anodyne	CACNA1I	42	34
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064216	EH	On-Demand	Anodyne	MAPK11	30	45
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064216	EH	On-Demand	Anodyne	MAPK14	27	47
CC[C@@H](Nc1cc(C(=O)NCC2CC2)ccc1C)[C@H]1CCCOC1	ZINC000872064216	EH	On-Demand	Anodyne	CACNA1I	42	34
CC[C@H](CCC(F)(F)F)Nc1cccc2c1CCN2C(C)=O	ZINC000872064285	DI	On-Demand	Anodyne	KCNQ2	40	34
CC[C@@H](CCC(F)(F)F)Nc1cccc2c1CCN2C(C)=O	ZINC000872064286	DI	On-Demand	Anodyne	KCNQ2	40	34
C[C@@H](NCC[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872064604	EH	On-Demand	Bother	COLA	90	34
C[C@@H](NCC[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872064605	EH	On-Demand	Bother	COLA	90	34
CC(=O)N1CCN(c2cccc(N[C@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872064898	FG	On-Demand	Anodyne	ITGAL	40	31
CC(=O)N1CCN(c2cccc(N[C@@H]3CCOC4(CCCC4)C3)c2)CC1	ZINC000872064899	FG	On-Demand	Anodyne	ITGAL	40	31
CC(=O)N1CCN(c2cccc(N[C@H]3CCO[C@@H](C(C)(C)C)C3)c2)CC1	ZINC000872064924	FG	On-Demand	Anodyne	ITGAL	42	33
CC(=O)N1CCN(c2cccc(N[C@H]3CCO[C@H](C(C)(C)C)C3)c2)CC1	ZINC000872064925	FG	On-Demand	Anodyne	ITGAL	42	33
CC(=O)N1CCN(c2cccc(N[C@@H]3CCO[C@H](C(C)(C)C)C3)c2)CC1	ZINC000872064926	FG	On-Demand	Anodyne	ITGAL	42	33
CC(=O)N1CCN(c2cccc(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)c2)CC1	ZINC000872064927	FG	On-Demand	Anodyne	ITGAL	42	33
CO[C@@H](C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872064945	CE	On-Demand	Bother	COLA	65	33
CO[C@@H](C)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872064946	CE	On-Demand	Bother	COLA	65	33
C[C@@H](NCC1CCN(CC(F)(F)F)CC1)c1cc(O)ccc1F	ZINC000872064982	EG	On-Demand	Anodyne	CACNA1I	56	33
COc1cc2c(cc1OC)[C@@H](NCCOCC(F)F)CCCC2	ZINC000872065095	EG	On-Demand	Anodyne	SLC18A2	45	34
C[C@@H](NC1(C(=O)Nc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872065101	EH	On-Demand	Bother	COLA	52	36
C[C@H](NC1(C(=O)Nc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872065102	EH	On-Demand	Bother	COLA	52	36
CC[C@@H](NC1(C(=O)Nc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872065153	DF	On-Demand	Anodyne	TIMP3	62	33
CC[C@@H](NC1(C(=O)Nc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872065154	DF	On-Demand	Anodyne	TIMP3	62	33
CC[C@@H](Nc1cccc(N2CCN(C(C)=O)CC2)c1)[C@H]1CCCOC1	ZINC000872065195	EF	On-Demand	Anodyne	ITGAL	41	32
CC[C@H](Nc1cccc(N2CCN(C(C)=O)CC2)c1)[C@H]1CCCOC1	ZINC000872065196	EF	On-Demand	Anodyne	ITGAL	41	32
CC[C@H](Nc1cccc(N2CCN(C(C)=O)CC2)c1)[C@@H]1CCCOC1	ZINC000872065197	EF	On-Demand	Anodyne	ITGAL	41	32
CC[C@@H](Nc1cccc(N2CCN(C(C)=O)CC2)c1)[C@@H]1CCCOC1	ZINC000872065198	EF	On-Demand	Anodyne	ITGAL	41	32
C[C@@H](NCC1(N(C)C)CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872065238	CF	On-Demand	Bother	COLA	43	32
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)OC)CCCC2	ZINC000872065281	CG	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)OC)CCCC2	ZINC000872065284	CG	On-Demand	Anodyne	SLC18A2	49	37
CC[C@H](CCC(F)(F)F)Nc1cccc(S(=O)(=O)N2CCC(O)CC2)c1	ZINC000872065288	GG	On-Demand	Anodyne	AKR1C3	46	33
CC[C@H](CCC(F)(F)F)Nc1cccc(S(=O)(=O)N2CCC(O)CC2)c1	ZINC000872065288	GG	On-Demand	Anodyne	GCKR	42	30
CC[C@@H](CCC(F)(F)F)Nc1cccc(S(=O)(=O)N2CCC(O)CC2)c1	ZINC000872065289	GG	On-Demand	Anodyne	AKR1C3	46	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(S(=O)(=O)N2CCC(O)CC2)c1	ZINC000872065289	GG	On-Demand	Anodyne	GCKR	42	30
CCOC(=O)c1csc(CCN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)n1	ZINC000872065330	GH	On-Demand	Bother	CACNA1C	26	43
CCOC(=O)c1csc(CCN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)n1	ZINC000872065331	GH	On-Demand	Bother	CACNA1C	26	43
O=S1(=O)CC(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872065344	ED	On-Demand	Anodyne	ACHE	23	41
O=S1(=O)CC(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872065345	ED	On-Demand	Anodyne	ACHE	23	41
CCOCCOC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872065574	DE	On-Demand	Anodyne	ADRB2	17	40
CCOCCOC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872065574	DE	On-Demand	Anodyne	ADRB1	21	40
CCOCCOC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872065574	DE	On-Demand	Anodyne	ADRB3	18	44
CCOCCOC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872065575	DE	On-Demand	Anodyne	ADRB2	17	40
CCOCCOC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872065575	DE	On-Demand	Anodyne	ADRB1	21	40
CCOCCOC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872065575	DE	On-Demand	Anodyne	ADRB3	18	44
CCOCCOC[C@@H](O)CN[C@H](C)c1cccc(O)c1F	ZINC000872065602	DD	On-Demand	Anodyne	ADRB2	17	41
CCOCCOC[C@@H](O)CN[C@@H](C)c1cccc(O)c1F	ZINC000872065604	DD	On-Demand	Anodyne	ADRB2	17	41
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872065758	EH	On-Demand	Anodyne	DRD2	15	43
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872065758	EH	On-Demand	Anodyne	DRD4	45	45
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872065758	EH	On-Demand	Anodyne	ACHE	44	40
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872065758	EH	On-Demand	Anodyne	SLC6A3	17	42
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872065758	EH	On-Demand	Anodyne	SIGMAR1	48	42
CCN(C)C(=O)[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872066031	EE	On-Demand	Anodyne	CACNA1B	21	41
CCN(C)C(=O)[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872066032	EE	On-Demand	Anodyne	CACNA1B	21	41
CCN(C)C(=O)[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872066033	EE	On-Demand	Anodyne	CACNA1B	21	41
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(O)c1F	ZINC000872066094	EH	On-Demand	Anodyne	DRD4	41	42
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(O)c1F	ZINC000872066094	EH	On-Demand	Anodyne	ACHE	43	40
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(O)c1F	ZINC000872066094	EH	On-Demand	Anodyne	SLC6A3	18	46
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(O)c1F	ZINC000872066094	EH	On-Demand	Anodyne	HTR4	25	41
C[C@@H](NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(O)c1F	ZINC000872066094	EH	On-Demand	Anodyne	SIGMAR1	50	43
COc1cc2c(cc1OC)[C@@H](NCCCCCO)CCCC2	ZINC000872066135	DG	On-Demand	Anodyne	SLC18A2	46	35
C[C@@H](NCCCCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066168	CF	On-Demand	Bother	COLA	61	32
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066301	EI	On-Demand	Anodyne	DRD4	34	44
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066301	EI	On-Demand	Anodyne	ACHE	47	43
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066301	EI	On-Demand	Anodyne	SLC6A3	17	45
CC[C@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066301	EI	On-Demand	Anodyne	SIGMAR1	49	42
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066302	EI	On-Demand	Anodyne	DRD4	34	44
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066302	EI	On-Demand	Anodyne	ACHE	47	43
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066302	EI	On-Demand	Anodyne	SLC6A3	17	45
CC[C@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066302	EI	On-Demand	Anodyne	SIGMAR1	49	42
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066303	EI	On-Demand	Anodyne	DRD4	34	44
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066303	EI	On-Demand	Anodyne	ACHE	47	43
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066303	EI	On-Demand	Anodyne	SLC6A3	17	45
CC[C@@H](CCC(F)(F)F)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872066303	EI	On-Demand	Anodyne	SIGMAR1	49	42
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066304	EI	On-Demand	Anodyne	DRD4	34	44
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066304	EI	On-Demand	Anodyne	ACHE	47	43
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066304	EI	On-Demand	Anodyne	SLC6A3	17	45
CC[C@@H](CCC(F)(F)F)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000872066304	EI	On-Demand	Anodyne	SIGMAR1	49	42
COCCS(=O)(=O)c1ccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872066656	GG	On-Demand	Bother	COLA	49	32
COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872066657	GG	On-Demand	Bother	COLA	49	32
C[C@@H](NCCCCO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066686	CE	On-Demand	Bother	COLA	71	32
COc1cc2c(cc1OC)[C@@H](N1CCO[C@H](c3nncn3C)C1)CCCC2	ZINC000872066783	FF	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@@H](N1CCO[C@@H](c3nncn3C)C1)CCCC2	ZINC000872066784	FF	On-Demand	Anodyne	SLC18A2	50	38
CCN(C)C(=O)[C@@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066810	CE	On-Demand	Bother	COLA	98	34
CCN(C)C(=O)[C@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066811	CE	On-Demand	Bother	COLA	98	34
CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066812	CE	On-Demand	Bother	COLA	98	34
CCN(C)C(=O)[C@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872066813	CE	On-Demand	Bother	COLA	98	34
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)N(C)C	ZINC000872066814	CE	On-Demand	Anodyne	PDF	43	32
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)N(C)C	ZINC000872066815	CE	On-Demand	Anodyne	PDF	43	32
C[C@@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872066840	FF	On-Demand	Anodyne	SFRP1	67	33
C[C@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1cc(O)ccc1F	ZINC000872066841	FF	On-Demand	Anodyne	SFRP1	67	33
COc1cc2c(cc1OC)[C@@H](NCCC1CC(O)C1)CCCC2	ZINC000872066853	DG	On-Demand	Anodyne	SLC18A2	47	34
C[C@@H](NCC1(N2CCOCC2)CC1)c1cccc(O)c1F	ZINC000872067007	CE	On-Demand	Anodyne	HCN1	44	40
C[C@@H](CNC(=O)OC(C)(C)C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872067029	EG	On-Demand	Bother	COLA	59	37
C[C@@H](CNC(=O)OC(C)(C)C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872067030	EG	On-Demand	Bother	COLA	59	37
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N(C)C	ZINC000872067062	CD	On-Demand	Bother	COLA	97	34
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N(C)C	ZINC000872067063	CD	On-Demand	Bother	COLA	97	34
COc1cc2c(cc1OC)[C@@H](NCCCCO)CCCC2	ZINC000872067299	CF	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(C)=O)nc1)CCCC2	ZINC000872067457	FH	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(C)=O)nc1)CCCC2	ZINC000872067457	FH	On-Demand	Anodyne	HCRTR1	23	40
OC1CC(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872067608	DF	On-Demand	Anodyne	ACHE	22	41
C[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(O)ccc1F	ZINC000872067611	EG	On-Demand	Anodyne	CCR1	29	40
C[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(O)ccc1F	ZINC000872067614	EG	On-Demand	Anodyne	CCR1	29	40
COc1cc2c(cc1OC)[C@@H](NCCC[C@H](C)O)CCCC2	ZINC000872067634	DG	On-Demand	Anodyne	SLC18A2	52	40
COc1cc2c(cc1OC)[C@@H](NCCC[C@@H](C)O)CCCC2	ZINC000872067635	DG	On-Demand	Anodyne	SLC18A2	52	40
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CCCN(C(C)=O)C1)CCCC2	ZINC000872067712	FG	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CCCN(C(C)=O)C1)CCCC2	ZINC000872067714	FG	On-Demand	Anodyne	SLC18A2	47	34
C[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])NC(=O)OC(C)(C)C	ZINC000872067799	EG	On-Demand	Bother	COLA	61	37
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])NC(=O)OC(C)(C)C	ZINC000872067800	EG	On-Demand	Bother	COLA	61	37
COc1cc2c(cc1OC)[C@@H](N[C@H](C)C(=O)NCCF)CCCC2	ZINC000872067896	EF	On-Demand	Anodyne	SLC18A2	49	39
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)C(=O)NCCF)CCCC2	ZINC000872067899	EF	On-Demand	Anodyne	SLC18A2	49	39
C[C@@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1cccc(O)c1F	ZINC000872068053	FF	On-Demand	Anodyne	CPT1A	105	42
C[C@@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1cccc(O)c1F	ZINC000872068053	FF	On-Demand	Anodyne	CPT2	44	35
C[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1cccc(O)c1F	ZINC000872068056	FF	On-Demand	Anodyne	CPT1A	105	42
C[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1cccc(O)c1F	ZINC000872068056	FF	On-Demand	Anodyne	CPT2	44	35
C[C@@H](NCC(=O)NCC(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068079	DD	On-Demand	Bother	COLA	75	32
C[C@H](NCC(=O)NCC(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068095	DD	On-Demand	Bother	COLA	75	32
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	EPHX2	50	44
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	RBP4	73	35
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	CCR8	62	39
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	SFRP1	97	38
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	TRPM8	53	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068207	EI	On-Demand	Anodyne	WNT3	72	38
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	EPHX2	50	44
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	RBP4	73	35
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	CCR8	62	39
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	SFRP1	97	38
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	TRPM8	53	36
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068209	EI	On-Demand	Anodyne	WNT3	72	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	EPHX2	50	44
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	RBP4	73	35
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	CCR8	62	39
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	SFRP1	97	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	TRPM8	53	36
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068211	EI	On-Demand	Anodyne	WNT3	72	38
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	EPHX2	50	44
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	RBP4	73	35
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	CCR8	62	39
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	SFRP1	97	38
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	TRPM8	53	36
CC[C@@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000872068212	EI	On-Demand	Anodyne	WNT3	72	38
O=C(COc1ccccc1)N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872068357	FF	On-Demand	Anodyne	CPT1A	117	43
O=C(COc1ccccc1)N1CC[C@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872068357	FF	On-Demand	Anodyne	CPT2	47	37
O=C(COc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872068358	FF	On-Demand	Anodyne	CPT1A	117	43
O=C(COc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872068358	FF	On-Demand	Anodyne	CPT2	47	37
O=C(COc1ccccc1)N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872068363	FF	On-Demand	Anodyne	CPT1A	117	43
O=C(COc1ccccc1)N1CC[C@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872068363	FF	On-Demand	Anodyne	CPT2	47	37
O=C(COc1ccccc1)N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872068367	FF	On-Demand	Anodyne	CPT1A	117	43
O=C(COc1ccccc1)N1CC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872068367	FF	On-Demand	Anodyne	CPT2	47	37
COC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872068392	CD	On-Demand	Anodyne	ADRB2	31	44
COC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872068392	CD	On-Demand	Anodyne	ADRB1	33	44
COC[C@@H](O)CN[C@@H]1CCCCc2ccccc2C1	ZINC000872068392	CD	On-Demand	Anodyne	ADRB3	28	45
COC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872068394	CD	On-Demand	Anodyne	ADRB2	31	44
COC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872068394	CD	On-Demand	Anodyne	ADRB1	33	44
COC[C@@H](O)CN[C@H]1CCCCc2ccccc2C1	ZINC000872068394	CD	On-Demand	Anodyne	ADRB3	28	45
CC(=O)Nc1ccc(CN[C@H](COC(C)C)Cc2ccc(F)cc2)cn1	ZINC000872068401	FG	On-Demand	Anodyne	GCK	15	44
CC(=O)Nc1ccc(CN[C@@H](COC(C)C)Cc2ccc(F)cc2)cn1	ZINC000872068404	FG	On-Demand	Anodyne	GCK	15	44
CC[C@@H](NCC(=O)NCCc1ccccc1OC)[C@H]1CCCOC1	ZINC000872068419	EE	On-Demand	Anodyne	MBTPS1	51	33
C[C@@H](O)CCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068422	CF	On-Demand	Bother	COLA	59	33
COc1cc2c(cc1OC)[C@@H](NCCCOC(F)F)CCCC2	ZINC000872068448	EH	On-Demand	Anodyne	SLC18A2	40	37
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NCCF	ZINC000872068508	ED	On-Demand	Anodyne	CACNA1B	19	46
CC[C@@H](NCC(=O)NCCc1ccccc1OC)[C@@H]1CCCOC1	ZINC000872068529	EE	On-Demand	Anodyne	MBTPS1	51	33
C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NCCF	ZINC000872068647	DD	On-Demand	Bother	COLA	101	34
C[C@H](N[C@H](C)C(=O)NCCF)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068648	DD	On-Demand	Bother	COLA	101	34
C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NCCF	ZINC000872068650	DD	On-Demand	Bother	COLA	101	34
CC(=O)N1CCC[C@@H](CN[C@@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872068654	FG	On-Demand	Anodyne	CCR3	106	38
CC(=O)N1CCC[C@@H](CN[C@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872068661	FG	On-Demand	Anodyne	CCR3	106	38
CC(=O)N1CCC[C@H](CN[C@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872068665	FG	On-Demand	Anodyne	CCR3	106	38
CC(=O)N1CCC[C@H](CN[C@@H](COC(C)C)Cc2ccc(F)cc2)C1	ZINC000872068670	FG	On-Demand	Anodyne	CCR3	106	38
C[C@@H](N[C@@H](CCO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068762	EG	On-Demand	Bother	COLA	53	33
C[C@@H](N[C@H](CCO)Cc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068764	EG	On-Demand	Bother	COLA	53	33
CC[C@H](CCC(F)(F)F)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872068823	DH	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC[C@H](CCC(F)(F)F)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872068823	DH	On-Demand	Anodyne	CTSK	18	49
CC[C@@H](CCC(F)(F)F)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872068824	DH	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC[C@@H](CCC(F)(F)F)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872068824	DH	On-Demand	Anodyne	CTSK	18	49
CC[C@@H](CCC(F)(F)F)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000872068825	DH	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC[C@@H](CCC(F)(F)F)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000872068825	DH	On-Demand	Anodyne	CTSK	18	49
CC[C@H](CCC(F)(F)F)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000872068826	DH	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC[C@H](CCC(F)(F)F)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000872068826	DH	On-Demand	Anodyne	CTSK	18	49
C[C@@H](NCC1(S(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068874	DD	On-Demand	Bother	COLA	91	35
COc1cc2c(cc1OC)[C@@H](NCC(=O)NCC(F)F)CCCC2	ZINC000872068899	EE	On-Demand	Anodyne	SLC18A2	44	31
Fc1ccc2[nH]cc(CCCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069149	EI	On-Demand	Anodyne	HTR1A	19	52
Fc1ccc2[nH]cc(CCCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069149	EI	On-Demand	Anodyne	HTR1D	40	37
Fc1ccc2[nH]cc(CCCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069149	EI	On-Demand	Anodyne	SLC6A4	30	52
Fc1ccc2[nH]cc(CCCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069149	EI	On-Demand	Anodyne	MPO	107	55
Fc1ccc2[nH]cc(CCCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069150	EI	On-Demand	Anodyne	HTR1A	19	52
Fc1ccc2[nH]cc(CCCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069150	EI	On-Demand	Anodyne	HTR1D	40	37
Fc1ccc2[nH]cc(CCCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069150	EI	On-Demand	Anodyne	SLC6A4	30	52
Fc1ccc2[nH]cc(CCCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872069150	EI	On-Demand	Anodyne	MPO	107	55
CCSCCCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069155	CH	On-Demand	Bother	COLA	42	31
CCSCCCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069156	CH	On-Demand	Bother	COLA	42	31
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872069175	DI	On-Demand	Anodyne	HTR1A	18	46
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872069175	DI	On-Demand	Anodyne	HTR1D	41	38
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872069175	DI	On-Demand	Anodyne	SLC6A4	27	49
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCOC1	ZINC000872069175	DI	On-Demand	Anodyne	MPO	107	53
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872069176	DI	On-Demand	Anodyne	HTR1A	18	46
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872069176	DI	On-Demand	Anodyne	HTR1D	41	38
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872069176	DI	On-Demand	Anodyne	SLC6A4	27	49
CC[C@@H](NCCCc1c[nH]c2ccc(F)cc12)[C@H]1CCCOC1	ZINC000872069176	DI	On-Demand	Anodyne	MPO	107	53
CC[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872069328	EE	On-Demand	Anodyne	CPT1A	117	43
CC[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872069328	EE	On-Demand	Anodyne	CPT2	50	40
CC[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872069329	EE	On-Demand	Anodyne	CPT1A	117	43
CC[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872069329	EE	On-Demand	Anodyne	CPT2	50	40
CC[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872069330	EE	On-Demand	Anodyne	CPT1A	117	43
CC[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872069330	EE	On-Demand	Anodyne	CPT2	50	40
CC[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872069331	EE	On-Demand	Anodyne	CPT1A	117	43
CC[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872069331	EE	On-Demand	Anodyne	CPT2	50	40
COc1cc2c(cc1OC)[C@@H](NCc1cnc3n1CCCC3)CCCC2	ZINC000872069366	FH	On-Demand	Anodyne	SLC18A2	47	34
CC(=O)N1CCC[C@@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872069491	DF	On-Demand	Bother	COLA	46	32
CC(=O)N1CCC[C@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872069492	DF	On-Demand	Bother	COLA	46	32
CC(=O)N1CCC[C@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872069493	DF	On-Demand	Bother	COLA	46	32
CC(=O)N1CCC[C@@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872069494	DF	On-Demand	Bother	COLA	46	32
C[C@@H](NCC(C)(C)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069582	DH	On-Demand	Bother	COLA	77	36
C[C@H](NCC(C)(C)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069583	DH	On-Demand	Bother	COLA	77	36
COC[C@@H](O)CN[C@H](C)c1cc(O)ccc1F	ZINC000872069621	BD	On-Demand	Anodyne	ADRB2	20	40
COC[C@@H](O)CN[C@@H](C)c1cc(O)ccc1F	ZINC000872069623	BD	On-Demand	Anodyne	ADRB2	20	40
CNC(=O)C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872069685	EG	On-Demand	Bother	COLA	87	35
CNC(=O)C[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872069686	EG	On-Demand	Bother	COLA	87	35
CNC(=O)C[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872069687	EG	On-Demand	Bother	COLA	87	35
CNC(=O)C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000872069688	EG	On-Demand	Bother	COLA	87	35
COCCCC[C@@H](N[C@H](C)c1cccc(O)c1F)c1ccccc1	ZINC000872069791	EJ	On-Demand	Anodyne	SOAT1	17	40
COCCCC[C@@H](N[C@@H](C)c1cccc(O)c1F)c1ccccc1	ZINC000872069793	EJ	On-Demand	Anodyne	SOAT1	17	40
COCCCC[C@H](N[C@H](C)c1cccc(O)c1F)c1ccccc1	ZINC000872069795	EJ	On-Demand	Anodyne	SOAT1	17	40
COCCCC[C@H](N[C@@H](C)c1cccc(O)c1F)c1ccccc1	ZINC000872069797	EJ	On-Demand	Anodyne	SOAT1	17	40
C[C@@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069954	GH	On-Demand	Bother	ETHR	42	35
C[C@@H](NCC1(S(C)(=O)=O)CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069966	EF	On-Demand	Bother	COLA	46	32
COCCNC(=O)c1cccc(N[C@H]2CCOC3(CCCC3)C2)c1	ZINC000872069987	EF	On-Demand	Anodyne	DRD4	40	30
COCCNC(=O)c1cccc(N[C@@H]2CCOC3(CCCC3)C2)c1	ZINC000872069988	EF	On-Demand	Anodyne	DRD4	40	30
C[C@H](N[C@@H](C)[C@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070023	CE	On-Demand	Bother	COLA	53	32
C[C@H](N[C@H](C)[C@@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070024	CE	On-Demand	Bother	COLA	53	32
C[C@H](N[C@H](C)[C@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070025	CE	On-Demand	Bother	COLA	53	32
C[C@H](N[C@@H](C)[C@@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070026	CE	On-Demand	Bother	COLA	53	32
C[C@@H](NCC1(S(C)(=O)=O)CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070038	EE	On-Demand	Bother	COLA	46	32
COc1cc2c(cc1OC)[C@@H](NCCF)CCCC2	ZINC000872070132	CG	On-Demand	Anodyne	SLC18A2	51	45
CC[C@@H](CCC(F)(F)F)N[C@@H](CC(=O)NC)c1ccccc1	ZINC000872070266	DH	On-Demand	Anodyne	MMP3	17	40
CC[C@H](CCC(F)(F)F)N[C@@H](CC(=O)NC)c1ccccc1	ZINC000872070271	DH	On-Demand	Anodyne	MMP3	17	40
CC[C@@H](CCC(F)(F)F)N[C@H](CC(=O)NC)c1ccccc1	ZINC000872070272	DH	On-Demand	Anodyne	MMP3	17	40
CC[C@H](CCC(F)(F)F)N[C@H](CC(=O)NC)c1ccccc1	ZINC000872070273	DH	On-Demand	Anodyne	MMP3	17	40
CC(=O)N1CCC[C@@H](CN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872070320	DG	On-Demand	Anodyne	PREP	49	40
CC(=O)N1CCC[C@@H](CN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872070323	DG	On-Demand	Anodyne	PREP	49	40
CC(=O)N1CCC[C@H](CN[C@H]2CCCCc3ccccc3C2)C1	ZINC000872070325	DG	On-Demand	Anodyne	PREP	49	40
CC(=O)N1CCC[C@H](CN[C@@H]2CCCCc3ccccc3C2)C1	ZINC000872070327	DG	On-Demand	Anodyne	PREP	49	40
C[C@@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)c1cccc(O)c1F	ZINC000872070376	FH	On-Demand	Anodyne	ETHR	51	37
C[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070407	EG	On-Demand	Anodyne	CACNA1H	40	36
C[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070407	EG	On-Demand	Anodyne	CCR1	25	40
C[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070407	EG	On-Demand	Anodyne	RBP4	57	34
C[C@@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070409	EG	On-Demand	Anodyne	CACNA1H	40	36
C[C@@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070409	EG	On-Demand	Anodyne	CCR1	25	40
C[C@@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cc(O)ccc1F	ZINC000872070409	EG	On-Demand	Anodyne	RBP4	57	34
C[C@@H](NCCF)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070442	BE	On-Demand	Bother	COLA	64	32
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070547	EH	On-Demand	Anodyne	DRD4	41	31
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070547	EH	On-Demand	Anodyne	KCNK3	53	33
CC[C@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070547	EH	On-Demand	Anodyne	KCNK9	47	31
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070548	EH	On-Demand	Anodyne	DRD4	41	31
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070548	EH	On-Demand	Anodyne	KCNK3	53	33
CC[C@@H](CCC(F)(F)F)Nc1cccc(C(=O)NCCOC)c1	ZINC000872070548	EH	On-Demand	Anodyne	KCNK9	47	31
CC[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872070576	EG	On-Demand	Anodyne	EPHX2	27	43
CC[C@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872070577	EG	On-Demand	Anodyne	EPHX2	27	43
CC[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872070578	EG	On-Demand	Anodyne	EPHX2	27	43
CC[C@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872070579	EG	On-Demand	Anodyne	EPHX2	27	43
COC[C@@H](O)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872070594	DE	On-Demand	Anodyne	SLC18A2	46	33
COC[C@@H](O)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872070597	DE	On-Demand	Anodyne	SLC18A2	46	33
O=C(/C=C/c1ccccc1)NCCCN[C@@H]1CCOC2(CCCC2)C1	ZINC000872070604	EG	On-Demand	Anodyne	HDAC7	22	41
O=C(/C=C\c1ccccc1)NCCCN[C@H]1CCOC2(CCCC2)C1	ZINC000872070605	EG	On-Demand	Anodyne	HDAC7	22	41
O=C(/C=C/c1ccccc1)NCCCN[C@H]1CCOC2(CCCC2)C1	ZINC000872070606	EG	On-Demand	Anodyne	HDAC7	22	41
O=C(/C=C\c1ccccc1)NCCCN[C@@H]1CCOC2(CCCC2)C1	ZINC000872070607	EG	On-Demand	Anodyne	HDAC7	22	41
CC[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872070620	EG	On-Demand	Anodyne	BIRC2	22	51
CC[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872070621	EG	On-Demand	Anodyne	BIRC2	22	51
CC[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872070622	EG	On-Demand	Anodyne	BIRC2	22	51
CC[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872070623	EG	On-Demand	Anodyne	BIRC2	22	51
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)OC)c1	ZINC000872070729	DI	On-Demand	Anodyne	KCNK3	40	32
CC[C@H](CCC(F)(F)F)NCc1cccc(NC(=O)OC)c1	ZINC000872070729	DI	On-Demand	Anodyne	PDS	54	36
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)OC)c1	ZINC000872070730	DI	On-Demand	Anodyne	KCNK3	40	32
CC[C@@H](CCC(F)(F)F)NCc1cccc(NC(=O)OC)c1	ZINC000872070730	DI	On-Demand	Anodyne	PDS	54	36
COC[C@@H](O)CN[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872070813	CD	On-Demand	Anodyne	ADRB2	25	44
COC[C@@H](O)CN[C@@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872070813	CD	On-Demand	Anodyne	ADRB1	25	44
COC[C@@H](O)CN[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872070814	CD	On-Demand	Anodyne	ADRB2	25	44
COC[C@@H](O)CN[C@H](COC(C)C)Cc1ccc(F)cc1	ZINC000872070814	CD	On-Demand	Anodyne	ADRB1	25	44
C[C@@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)c1cc(O)ccc1F	ZINC000872070926	FH	On-Demand	Anodyne	ETHR	53	35
C[C@@H](NCCS(=O)(=O)CCc1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872070986	GG	On-Demand	Bother	COLA	83	35
COC[C@@H](O)CN[C@H](C)c1cccc(O)c1F	ZINC000872071003	BD	On-Demand	Anodyne	ADRB2	24	41
COC[C@@H](O)CN[C@H](C)c1cccc(O)c1F	ZINC000872071003	BD	On-Demand	Anodyne	ADRB1	18	41
COC[C@@H](O)CN[C@@H](C)c1cccc(O)c1F	ZINC000872071005	BD	On-Demand	Anodyne	ADRB2	24	41
COC[C@@H](O)CN[C@@H](C)c1cccc(O)c1F	ZINC000872071005	BD	On-Demand	Anodyne	ADRB1	18	41
COCCNC(=O)c1cccc(N[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872071165	EG	On-Demand	Anodyne	DRD4	40	31
C[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(O)c1F	ZINC000872071210	EG	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(O)c1F	ZINC000872071211	EG	On-Demand	Anodyne	EPHX2	25	41
COCCNC(=O)c1cccc(N[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	ZINC000872071226	EG	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1cccc(N[C@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872071227	EG	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1cccc(N[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	ZINC000872071228	EG	On-Demand	Anodyne	DRD4	40	31
COC(=O)Nc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)c1	ZINC000872071349	GI	On-Demand	Bother	CACNA1D	55	33
COC(=O)Nc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)c1	ZINC000872071350	GI	On-Demand	Bother	CACNA1D	55	33
C[C@@H](NCCN(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872071398	CD	On-Demand	Bother	COLA	94	33
COCCNC(=O)c1cccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872071484	FG	On-Demand	Bother	TAAR1	25	42
COCCNC(=O)c1cccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872071485	FG	On-Demand	Bother	TAAR1	25	42
O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872071504	FG	On-Demand	Anodyne	ETHR	43	36
O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872071505	FG	On-Demand	Anodyne	ETHR	43	36
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000872071506	FI	On-Demand	Anodyne	ETHR	54	38
CC[C@H](CCC(F)(F)F)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000872071507	FI	On-Demand	Anodyne	ETHR	54	38
CCN(C)C(=O)c1cccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872071575	EH	On-Demand	Bother	COLA	71	33
CCN(C)C(=O)c1cccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1	ZINC000872071576	EH	On-Demand	Bother	COLA	71	33
COC(=O)N1CCC(CN[C@H](C)c2cccc(O)c2F)CC1	ZINC000872071613	DF	On-Demand	Anodyne	HTR4	24	42
COC(=O)N1CCC(CN[C@H](C)c2cccc(O)c2F)CC1	ZINC000872071613	DF	On-Demand	Anodyne	CACNA1I	40	31
COC(=O)N1CCC(CN[C@H](C)c2cccc(O)c2F)CC1	ZINC000872071613	DF	On-Demand	Anodyne	GPR119	20	42
COC(=O)N1CCC(CN[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872071614	DF	On-Demand	Anodyne	HTR4	24	42
COC(=O)N1CCC(CN[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872071614	DF	On-Demand	Anodyne	CACNA1I	40	31
COC(=O)N1CCC(CN[C@@H](C)c2cccc(O)c2F)CC1	ZINC000872071614	DF	On-Demand	Anodyne	GPR119	20	42
C[C@@H](N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1)c1cccc(O)c1F	ZINC000872071661	FF	On-Demand	Anodyne	SFRP1	53	36
COC(=O)N1CCC(CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872071666	DF	On-Demand	Anodyne	GRIN2B	41	38
COC(=O)N1CCC(CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872071666	DF	On-Demand	Anodyne	CACNA1I	57	33
COC(=O)N1CCC(CN[C@H](C)c2cc(O)ccc2F)CC1	ZINC000872071666	DF	On-Demand	Anodyne	GPR119	24	43
COC(=O)N1CCC(CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872071667	DF	On-Demand	Anodyne	GRIN2B	41	38
COC(=O)N1CCC(CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872071667	DF	On-Demand	Anodyne	CACNA1I	57	33
COC(=O)N1CCC(CN[C@@H](C)c2cc(O)ccc2F)CC1	ZINC000872071667	DF	On-Demand	Anodyne	GPR119	24	43
CC[C@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)C(C)(C)CC	ZINC000872071833	EI	On-Demand	Anodyne	ETHR	42	36
CC[C@@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)C(C)(C)CC	ZINC000872071834	EI	On-Demand	Anodyne	ETHR	42	36
C[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(F)(F)F	ZINC000872071852	DG	On-Demand	Anodyne	CACNA1B	15	45
C[C@@H](NCCCCCN1CCCC1)c1cc(O)ccc1F	ZINC000872072000	CG	On-Demand	Anodyne	HNMT	68	39
C[C@@H](NCCS(=O)(=O)N(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072178	DD	On-Demand	Bother	COLA	113	39
C[C@@H](NCCCCCN1CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072256	DH	On-Demand	Bother	HNMT	44	35
C[C@@H](F)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072262	CG	On-Demand	Bother	COLA	42	31
C[C@@H](NCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072316	CG	On-Demand	Bother	COLA	54	35
C[C@H](NCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072317	CG	On-Demand	Bother	COLA	54	35
O=S(=O)(CCCN[C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872072322	FH	On-Demand	Anodyne	PSEN2	40	30
O=S(=O)(CCCN[C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1	ZINC000872072323	FH	On-Demand	Anodyne	PSEN2	40	30
COC[C@H](N[C@H](C)c1cccc(O)c1F)c1cccc(Cl)c1	ZINC000872072354	DI	On-Demand	Anodyne	PDS	23	40
COC[C@@H](N[C@H](C)c1cccc(O)c1F)c1cccc(Cl)c1	ZINC000872072355	DI	On-Demand	Anodyne	PDS	23	40
COC[C@H](N[C@@H](C)c1cccc(O)c1F)c1cccc(Cl)c1	ZINC000872072356	DI	On-Demand	Anodyne	PDS	23	40
COC[C@@H](N[C@@H](C)c1cccc(O)c1F)c1cccc(Cl)c1	ZINC000872072357	DI	On-Demand	Anodyne	PDS	23	40
C[C@@H](NCCCCCN1CCCC1)c1cccc(O)c1F	ZINC000872072520	CG	On-Demand	Anodyne	HNMT	57	38
O=[N+]([O-])c1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872072565	EH	On-Demand	Bother	MPO	40	34
O=[N+]([O-])c1ccc2[nH]cc(CCN[C@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872072565	EH	On-Demand	Bother	NMBR	46	30
O=[N+]([O-])c1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872072566	EH	On-Demand	Bother	MPO	40	34
O=[N+]([O-])c1ccc2[nH]cc(CCN[C@@H]3CCOC4(CCCC4)C3)c2c1	ZINC000872072566	EH	On-Demand	Bother	NMBR	46	30
CSCC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N(C)C	ZINC000872072687	EF	On-Demand	Bother	COLA	98	35
CSCC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N(C)C	ZINC000872072688	EF	On-Demand	Bother	COLA	98	35
COc1cccc(C2(CN[C@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872072802	DH	On-Demand	Anodyne	ICMT	47	43
COc1cccc(C2(CN[C@@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872072803	DH	On-Demand	Anodyne	ICMT	47	43
C[C@@H](NCCCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872072845	CH	On-Demand	Bother	COLA	56	35
NC(=O)Cc1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872072937	FF	On-Demand	Anodyne	SIGMAR1	26	42
NC(=O)Cc1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872072938	FF	On-Demand	Anodyne	SIGMAR1	26	42
C[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])CN(C)C	ZINC000872073066	CF	On-Demand	Bother	COLA	60	33
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])CN(C)C	ZINC000872073067	CF	On-Demand	Bother	COLA	60	33
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	HTR7	16	51
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP13	72	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP2	46	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP3	57	47
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP8	38	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	SLC6A9	15	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP14	21	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP9	59	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP12	29	49
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP7	45	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872073165	ID	On-Demand	Clean	MMP1	59	49
COc1cccc(C2(CN[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)c1	ZINC000872073224	DH	On-Demand	Anodyne	ICMT	31	40
COc1cccc(C2(CN[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)c1	ZINC000872073225	DH	On-Demand	Anodyne	ICMT	31	40
COc1cccc(C2(CN[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)c1	ZINC000872073226	DH	On-Demand	Anodyne	ICMT	31	40
COc1cccc(C2(CN[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)c1	ZINC000872073227	DH	On-Demand	Anodyne	ICMT	31	40
CC[C@H](O)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872073768	CF	On-Demand	Anodyne	SLC18A2	47	34
CC[C@H](O)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872073769	CF	On-Demand	Anodyne	SLC18A2	47	34
C[C@H](N[C@H](C)[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872073851	DH	On-Demand	Bother	COLA	58	32
C[C@H](N[C@@H](C)[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872073852	DH	On-Demand	Bother	COLA	58	32
C[C@H](N[C@@H](C)[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872073853	DH	On-Demand	Bother	COLA	58	32
C[C@H](N[C@H](C)[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872073854	DH	On-Demand	Bother	COLA	58	32
COc1cc2c(cc1OC)[C@@H](NCCS(=O)(=O)C(C)C)CCCC2	ZINC000872073873	FF	On-Demand	Anodyne	SLC18A2	48	36
CC[C@@H](Nc1ccc(N2CCN(C(=O)OC)CC2)nc1)[C@H]1CCCOC1	ZINC000872074051	FF	On-Demand	Anodyne	DGAT1	40	43
CC[C@@H](Nc1ccc(N2CCN(C(=O)OC)CC2)nc1)[C@@H]1CCCOC1	ZINC000872074052	FF	On-Demand	Anodyne	DGAT1	40	43
CC[C@H](Nc1ccc(N2CCN(C(=O)OC)CC2)nc1)[C@H]1CCCOC1	ZINC000872074055	FF	On-Demand	Anodyne	DGAT1	40	43
CC[C@H](Nc1ccc(N2CCN(C(=O)OC)CC2)nc1)[C@@H]1CCCOC1	ZINC000872074057	FF	On-Demand	Anodyne	DGAT1	40	43
C[C@@H](NCCC(C)(C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074119	CF	On-Demand	Bother	COLA	55	32
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCN(CCCO)C1	ZINC000872074120	FF	On-Demand	Bother	BIRC2	27	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCCN(CCCO)C1	ZINC000872074121	FF	On-Demand	Bother	BIRC2	27	43
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCN(CCCO)C1	ZINC000872074122	FF	On-Demand	Bother	BIRC2	27	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCN(CCCO)C1	ZINC000872074123	FF	On-Demand	Bother	BIRC2	27	43
C[C@H](N[C@@H]1COc2ccccc2[C@@H]1O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074258	EF	On-Demand	Bother	COLA	55	32
C[C@H](N[C@@H]1COc2ccccc2[C@H]1O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074266	EF	On-Demand	Bother	COLA	55	32
C[C@@H](CCCCO)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872074293	DG	On-Demand	Anodyne	SIGMAR1	18	44
C[C@@H](CCCCO)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872074296	DG	On-Demand	Anodyne	SIGMAR1	18	44
CC[C@@H](NCc1cc2ccccc2n(C)c1=O)[C@H]1CCCOC1	ZINC000872074436	DF	On-Demand	Anodyne	NPSR1	32	43
CC[C@@H](NCc1cc2ccccc2n(C)c1=O)[C@@H]1CCCOC1	ZINC000872074438	DF	On-Demand	Anodyne	NPSR1	32	43
CC[C@H](NCc1cc2ccccc2n(C)c1=O)[C@H]1CCCOC1	ZINC000872074440	DF	On-Demand	Anodyne	NPSR1	32	43
CC[C@H](NCc1cc2ccccc2n(C)c1=O)[C@@H]1CCCOC1	ZINC000872074442	DF	On-Demand	Anodyne	NPSR1	32	43
C=C(C)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074446	CG	On-Demand	Mild	COLA	64	33
C=C(C)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074448	CG	On-Demand	Mild	COLA	64	33
COc1cc2c(cc1OC)[C@@H](NCc1cc(C)nc(N3CCCC3)n1)CCCC2	ZINC000872074623	GH	On-Demand	Anodyne	EHMT2	50	38
C[C@@H](NCCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074669	CG	On-Demand	Bother	COLA	43	34
CC[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)(C)O	ZINC000872074681	CF	On-Demand	Bother	COLA	59	32
CC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)(C)O	ZINC000872074682	CF	On-Demand	Bother	COLA	59	32
CC[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)(C)O	ZINC000872074683	CF	On-Demand	Bother	COLA	59	32
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)(C)O	ZINC000872074684	CF	On-Demand	Bother	COLA	59	32
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CCCCO)CCCC2	ZINC000872074788	DH	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CCCCO)CCCC2	ZINC000872074791	DH	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](NC[C@H](C)CCCO)CCCC2	ZINC000872074816	DG	On-Demand	Anodyne	SLC18A2	50	35
COc1cc2c(cc1OC)[C@@H](NC[C@@H](C)CCCO)CCCC2	ZINC000872074819	DG	On-Demand	Anodyne	SLC18A2	50	35
CC[C@H](CCC(F)(F)F)N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000872074823	EH	On-Demand	Anodyne	CTSK	18	50
CC[C@H](CCC(F)(F)F)N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872074824	EH	On-Demand	Anodyne	CTSK	18	50
CC[C@H](CCC(F)(F)F)N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872074825	EH	On-Demand	Anodyne	CTSK	18	50
CC[C@H](CCC(F)(F)F)N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000872074826	EH	On-Demand	Anodyne	CTSK	18	50
COc1cc2c(cc1OC)[C@@H](NCC[C@@H](C)CCO)CCCC2	ZINC000872074851	DG	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](NCC[C@H](C)CCO)CCCC2	ZINC000872074854	DG	On-Demand	Anodyne	SLC18A2	50	36
C[C@H](N[C@H](C)CC(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872074891	CF	On-Demand	Bother	COLA	71	33
C[C@@H](CCO)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075064	CF	On-Demand	Bother	COLA	40	31
C[C@H](CCO)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075066	CF	On-Demand	Bother	COLA	40	31
C[C@H](CCO)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075067	CF	On-Demand	Bother	COLA	40	31
C[C@@H](NCC(C)(C)c1ccccn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075107	DH	On-Demand	Bother	COLA	49	33
C[C@H](NCC(C)(C)c1ccccn1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075108	DH	On-Demand	Bother	COLA	49	33
CNC(=O)C[C@@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075229	CD	On-Demand	Bother	COLA	88	33
CNC(=O)C[C@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075230	CD	On-Demand	Bother	COLA	88	33
CNC(=O)C[C@H](C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075231	CD	On-Demand	Bother	COLA	88	33
CNC(=O)C[C@@H](C)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872075232	CD	On-Demand	Bother	COLA	88	33
CCN(C)C(=O)[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000872075314	EF	On-Demand	Bother	COLA	107	35
CCN(C)C(=O)[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000872075315	EF	On-Demand	Bother	COLA	107	35
CNC(=O)C[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075404	DE	On-Demand	Anodyne	SIGMAR1	24	41
CNC(=O)C[C@@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075404	DE	On-Demand	Anodyne	CACNA1B	16	42
CNC(=O)C[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075408	DE	On-Demand	Anodyne	SIGMAR1	24	41
CNC(=O)C[C@@H](C)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075408	DE	On-Demand	Anodyne	CACNA1B	16	42
CNC(=O)C[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075412	DE	On-Demand	Anodyne	SIGMAR1	24	41
CNC(=O)C[C@H](C)N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872075412	DE	On-Demand	Anodyne	CACNA1B	16	42
C[C@@H](NC1C[C@@H]2CC[C@H](C1)N2C)c1cc(O)ccc1F	ZINC000872075433	CF	On-Demand	Anodyne	SLC6A3	21	50
C[C@H](NC1C[C@@H]2CC[C@H](C1)N2C)c1cc(O)ccc1F	ZINC000872075436	CF	On-Demand	Anodyne	SLC6A3	21	50
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	ACE	38	40
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	MME	63	40
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	ANPEP	35	44
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	MMP3	48	38
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	CAPN2	45	38
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	ACE2	41	35
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	NPR	47	40
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	44
CC[C@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075451	EG	On-Demand	Anodyne	PDS	27	40
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	ACE	38	40
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	MME	63	40
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	ANPEP	35	44
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	MMP3	48	38
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	CAPN2	45	38
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	ACE2	41	35
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	NPR	47	40
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	44
CC[C@@H](CCC(F)(F)F)N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000872075453	EG	On-Demand	Anodyne	PDS	27	40
C[C@H](N[C@@H]1CCO[C@H](C(C)(C)C)C1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872075518	EH	On-Demand	Anodyne	TPP2	54	34
C[C@H](N[C@@H]1CCO[C@H](C(C)(C)C)C1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872075519	EH	On-Demand	Anodyne	TPP2	54	34
C[C@H](N[C@@H]1CCO[C@@H](C(C)(C)C)C1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872075521	EH	On-Demand	Anodyne	TPP2	54	34
C[C@H](N[C@@H]1CCO[C@@H](C(C)(C)C)C1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872075523	EH	On-Demand	Anodyne	TPP2	54	34
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075576	GH	On-Demand	Anodyne	LTA4H	26	42
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075576	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075576	GH	On-Demand	Anodyne	SSTR5	37	40
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075579	GH	On-Demand	Anodyne	LTA4H	26	42
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075579	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075579	GH	On-Demand	Anodyne	SSTR5	37	40
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075580	GH	On-Demand	Anodyne	LTA4H	26	42
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075580	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075580	GH	On-Demand	Anodyne	SSTR5	37	40
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075582	GH	On-Demand	Anodyne	LTA4H	26	42
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075582	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1	ZINC000872075582	GH	On-Demand	Anodyne	SSTR5	37	40
CN1[C@H]2CC[C@H]1CC(N[C@H]1CC[C@@H]3CN(Cc4ccccc4)C[C@@H]31)C2	ZINC000872076184	EG	On-Demand	Anodyne	SLC6A3	19	45
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	DRD4	28	44
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	KCNH2	15	49
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	CHRM3	17	40
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	SIGMAR1	31	48
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	SSTR5	41	34
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	CCR3	56	39
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	MLNR	47	42
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	MCHR1	54	43
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076225	GH	On-Demand	Anodyne	NOD2	40	36
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	DRD4	28	44
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	KCNH2	15	49
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	CHRM3	17	40
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	SIGMAR1	31	48
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	SSTR5	41	34
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	CCR3	56	39
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	MLNR	47	42
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	MCHR1	54	43
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cccc(O)c3F)CC2)cc1	ZINC000872076226	GH	On-Demand	Anodyne	NOD2	40	36
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)CC(C)(C)O)CCCC2	ZINC000872076271	DH	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](N[C@H](C)CC(C)(C)O)CCCC2	ZINC000872076272	DH	On-Demand	Anodyne	SLC18A2	47	35
C[C@@H](CCCO)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872076293	CF	On-Demand	Bother	COLA	40	32
C[C@@H](CCCO)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872076294	CF	On-Demand	Bother	COLA	40	32
CC[C@@H](NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@@H]1CCCOC1	ZINC000872076383	FG	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@@H](NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@@H]1CCCOC1	ZINC000872076383	FG	On-Demand	Anodyne	NOD2	40	36
CC[C@@H](NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@H]1CCCOC1	ZINC000872076385	FG	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@@H](NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@H]1CCCOC1	ZINC000872076385	FG	On-Demand	Anodyne	NOD2	40	36
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872076396	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872076396	GH	On-Demand	Anodyne	CXCR3	19	42
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872076397	GH	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)cc1	ZINC000872076397	GH	On-Demand	Anodyne	CXCR3	19	42
C[C@H](N[C@@H]1CCO[C@@H](C(C)(C)C)C1)C(=O)NCCc1ccccc1	ZINC000872076410	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
C[C@H](N[C@@H]1CCO[C@H](C(C)(C)C)C1)C(=O)NCCc1ccccc1	ZINC000872076411	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CHRM2	19	43
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	DRD4	29	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	KCNH2	17	50
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CHRM3	23	43
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	SIGMAR1	26	44
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	SSTR5	47	38
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CCR1	40	48
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CCR3	53	38
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CCR2	15	42
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CXCR3	42	41
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	MCHR1	65	43
CC(=O)Nc1ccc(CN2CCC(N[C@@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076460	GH	On-Demand	Anodyne	CACNA1G	24	40
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CHRM2	19	43
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	DRD4	29	41
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	KCNH2	17	50
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CHRM3	23	43
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	SIGMAR1	26	44
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	SSTR5	47	38
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CCR1	40	48
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CCR3	53	38
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CCR2	15	42
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CXCR3	42	41
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	MCHR1	65	43
CC(=O)Nc1ccc(CN2CCC(N[C@H](C)c3cc(O)ccc3F)CC2)cc1	ZINC000872076461	GH	On-Demand	Anodyne	CACNA1G	24	40
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076660	EF	On-Demand	Anodyne	OPRM1	17	42
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076660	EF	On-Demand	Anodyne	OPRD1	16	42
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076660	EF	On-Demand	Anodyne	MME	43	36
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076660	EF	On-Demand	Anodyne	ANPEP	22	43
C[C@H](N[C@@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076660	EF	On-Demand	Anodyne	AMP1_PLAFQ	30	43
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076661	EF	On-Demand	Anodyne	OPRM1	17	42
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076661	EF	On-Demand	Anodyne	OPRD1	16	42
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076661	EF	On-Demand	Anodyne	MME	43	36
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076661	EF	On-Demand	Anodyne	ANPEP	22	43
C[C@H](N[C@H](C)c1cc(O)ccc1F)C(=O)NCCc1ccccc1	ZINC000872076661	EF	On-Demand	Anodyne	AMP1_PLAFQ	30	43
CNC(=O)C[C@@H](C)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872076754	DF	On-Demand	Anodyne	SLC18A2	46	33
CNC(=O)C[C@@H](C)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872076755	DF	On-Demand	Anodyne	SLC18A2	46	33
CNC(=O)C[C@H](C)N[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872076756	DF	On-Demand	Anodyne	SLC18A2	46	33
CNC(=O)C[C@H](C)N[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872076757	DF	On-Demand	Anodyne	SLC18A2	46	33
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872076758	DF	On-Demand	Anodyne	ACE	43	38
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872076758	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872076759	DF	On-Demand	Anodyne	ACE	43	38
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872076759	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872076760	DF	On-Demand	Anodyne	ACE	43	38
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872076760	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872076761	DF	On-Demand	Anodyne	ACE	43	38
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872076761	DF	On-Demand	Anodyne	MMP3	17	40
COc1cc2c(cc1OC)[C@@H](NC1C[C@@H]3CC[C@H](C1)N3C)CCCC2	ZINC000872076816	EH	On-Demand	Anodyne	SLC18A2	46	33
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	ACHE	18	43
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	LTA4H	18	40
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	SIGMAR1	26	42
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	SSTR5	44	39
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	MLNR	51	43
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	CCR2	20	47
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	EPHX2	27	42
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	MCHR1	43	39
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000872076892	GI	On-Demand	Anodyne	NOD2	41	35
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)[C@H](C)O	ZINC000872076938	DF	On-Demand	Anodyne	GALR1	47	35
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)[C@H](C)O	ZINC000872076938	DF	On-Demand	Anodyne	SIGMAR1	24	40
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)[C@@H](C)O	ZINC000872076939	DF	On-Demand	Anodyne	GALR1	47	35
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)[C@@H](C)O	ZINC000872076939	DF	On-Demand	Anodyne	SIGMAR1	24	40
C[C@@H](NC1C[C@@H]2CC[C@H](C1)N2C)c1cccc(O)c1F	ZINC000872077109	CF	On-Demand	Anodyne	SLC6A3	15	48
C[C@H](NC1C[C@@H]2CC[C@H](C1)N2C)c1cccc(O)c1F	ZINC000872077110	CF	On-Demand	Anodyne	SLC6A3	15	48
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	ACE	38	40
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	MME	63	40
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	ANPEP	35	44
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	MMP3	48	38
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	CAPN2	45	38
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	ACE2	41	35
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	NPR	47	40
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	44
CC[C@@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077216	EG	On-Demand	Anodyne	PDS	27	40
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	ACE	38	40
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	MME	63	40
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	ANPEP	35	44
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	MMP3	48	38
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	CAPN2	45	38
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	ACE2	41	35
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	NPR	47	40
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	44
CC[C@H](CCC(F)(F)F)N[C@H](C)C(=O)NCCc1ccccc1	ZINC000872077217	EG	On-Demand	Anodyne	PDS	27	40
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077267	DE	On-Demand	Anodyne	SIGMAR1	24	40
CC[C@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077267	DE	On-Demand	Anodyne	CACNA1B	19	44
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077268	DE	On-Demand	Anodyne	SIGMAR1	24	40
CC[C@@H](N[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077268	DE	On-Demand	Anodyne	CACNA1B	19	44
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077269	DE	On-Demand	Anodyne	SIGMAR1	24	40
CC[C@@H](N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(=O)NC	ZINC000872077269	DE	On-Demand	Anodyne	CACNA1B	19	44
OCCc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872077274	EH	On-Demand	Anodyne	DRD4	19	40
OCCc1cccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC000872077274	EH	On-Demand	Anodyne	SIGMAR1	35	42
O[C@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872077401	DF	On-Demand	Anodyne	SIGMAR1	20	44
O[C@@H](CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872077402	DF	On-Demand	Anodyne	SIGMAR1	20	44
O[C@@H](CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CCC1	ZINC000872077403	DF	On-Demand	Anodyne	SIGMAR1	20	44
C[C@H](NCC(C)(C)C(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872077428	CG	On-Demand	Bother	COLA	69	33
C[C@@H](NCC(C)(C)C(C)(C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872077429	CG	On-Demand	Bother	COLA	69	33
COc1cc2c(cc1OC)[C@@H](N[C@@H]1C[C@H](O)C1)CCCC2	ZINC000872077476	CF	On-Demand	Anodyne	SLC18A2	46	35
OC1CCN(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872077478	ED	On-Demand	Anodyne	SIGMAR1	48	40
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)C1CCC1)CCCC2	ZINC000872077521	DG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)C1CCC1)CCCC2	ZINC000872077523	DG	On-Demand	Anodyne	SLC18A2	46	33
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872077549	EF	On-Demand	Anodyne	MME	41	37
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cccc(O)c1F	ZINC000872077549	EF	On-Demand	Anodyne	AMP1_PLAFQ	34	44
CC[C@H](N[C@@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077631	DE	On-Demand	Anodyne	MME	20	40
CC[C@H](N[C@@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077631	DE	On-Demand	Anodyne	ACE2	37	40
CC[C@H](N[C@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077632	DE	On-Demand	Anodyne	MME	20	40
CC[C@H](N[C@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077632	DE	On-Demand	Anodyne	ACE2	37	40
CC[C@@H](N[C@@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077633	DE	On-Demand	Anodyne	MME	20	40
CC[C@@H](N[C@@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077633	DE	On-Demand	Anodyne	ACE2	37	40
CC[C@@H](N[C@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077634	DE	On-Demand	Anodyne	MME	20	40
CC[C@@H](N[C@H](COC(C)C)Cc1ccc(F)cc1)C(=O)NC	ZINC000872077634	DE	On-Demand	Anodyne	ACE2	37	40
CC[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NC	ZINC000872077639	CD	On-Demand	Bother	COLA	105	36
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NC	ZINC000872077640	CD	On-Demand	Bother	COLA	105	36
CC[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)NC	ZINC000872077641	CD	On-Demand	Bother	COLA	105	36
C[C@@H](N[C@H]1CCO[C@@H](C(C)(C)C)C1)C(=O)NCCc1ccccc1	ZINC000872077677	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
C[C@@H](N[C@H]1CCO[C@H](C(C)(C)C)C1)C(=O)NCCc1ccccc1	ZINC000872077679	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
COc1cc2c(cc1OC)[C@@H](NCCN1CCC(O)CC1)CCCC2	ZINC000872077700	EF	On-Demand	Anodyne	SLC18A2	50	36
C[C@@H](NCCS(=O)(=O)C1CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872077754	DD	On-Demand	Bother	COLA	61	32
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	CHRM2	20	40
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	HTR7	20	54
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	BMP1	24	40
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP13	54	46
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP2	31	42
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP3	43	46
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP8	27	42
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP9	42	42
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP12	15	42
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP7	40	39
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1	ZINC000872078107	ID	On-Demand	Clean	MMP1	45	42
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCC[C@H]1O)CCCC2	ZINC000872078108	DF	On-Demand	Anodyne	SLC18A2	44	33
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872078125	EF	On-Demand	Anodyne	OPRM1	17	42
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872078125	EF	On-Demand	Anodyne	OPRD1	16	42
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872078125	EF	On-Demand	Anodyne	MME	43	36
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872078125	EF	On-Demand	Anodyne	ANPEP	22	43
C[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cc(O)ccc1F	ZINC000872078125	EF	On-Demand	Anodyne	AMP1_PLAFQ	30	43
C[C@@H](CCCc1cccnc1)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872078186	EI	On-Demand	Bother	PTAFR	31	47
C[C@H](N[C@H](C)CCCc1cccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872078187	EI	On-Demand	Bother	PTAFR	31	47
C[C@@H](CCCc1cccnc1)N[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872078188	EI	On-Demand	Bother	PTAFR	31	47
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@@H]1CCCOC1	ZINC000872078200	CH	On-Demand	Anodyne	PTAFR	21	43
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@H]1CCCOC1	ZINC000872078201	CH	On-Demand	Anodyne	PTAFR	21	43
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@@H]1CCCOC1	ZINC000872078202	CH	On-Demand	Anodyne	PTAFR	21	43
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@H]1CCCOC1	ZINC000872078204	CH	On-Demand	Anodyne	PTAFR	21	43
CC[C@@H](CCC(F)(F)F)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872078245	FH	On-Demand	Anodyne	SIGMAR1	54	41
CC[C@@H](CCC(F)(F)F)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872078245	FH	On-Demand	Anodyne	NPFFR1	40	37
NC(=O)[C@@H]1CC[C@@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872078281	FF	On-Demand	Anodyne	SIGMAR1	25	40
NC(=O)[C@@H]1CC[C@@H](CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872078281	FF	On-Demand	Anodyne	VCP	48	40
COCC[C@@H](C)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872078498	DH	On-Demand	Anodyne	SLC18A2	49	35
COCC[C@@H](C)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872078500	DH	On-Demand	Anodyne	SLC18A2	49	35
COCC[C@H](C)CN[C@@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872078501	DH	On-Demand	Anodyne	SLC18A2	49	35
COCC[C@H](C)CN[C@H]1CCCCc2cc(OC)c(OC)cc21	ZINC000872078502	DH	On-Demand	Anodyne	SLC18A2	49	35
NC(=O)[C@@H]1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872078568	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872078577	DF	On-Demand	Anodyne	ACE	43	38
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872078577	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872078578	DF	On-Demand	Anodyne	ACE	43	38
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872078578	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872078579	DF	On-Demand	Anodyne	ACE	43	38
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@H]1CCCOC1	ZINC000872078579	DF	On-Demand	Anodyne	MMP3	17	40
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872078580	DF	On-Demand	Anodyne	ACE	43	38
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872078580	DF	On-Demand	Anodyne	MMP3	17	40
C[C@@H](NCC1(N2CCOCC2)CCN(C)CC1)c1cccc(O)c1F	ZINC000872078755	FD	On-Demand	Anodyne	HCN1	45	38
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CCC[C@H]1O)CCCC2	ZINC000872079148	DG	On-Demand	Anodyne	SLC18A2	47	35
CCS(=O)(=O)Cc1ccc(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872079190	FH	On-Demand	Bother	COLA	58	34
CCS(=O)(=O)Cc1ccc(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872079191	FH	On-Demand	Bother	COLA	58	34
C=C(CC)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872079215	CG	On-Demand	Mild	COLA	57	32
C=C(CC)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872079216	CG	On-Demand	Mild	COLA	57	32
CC[C@@H](CCC(F)(F)F)Nc1cccc2c1CCNC2=O	ZINC000872079263	DH	On-Demand	Anodyne	PARP1	18	48
CC[C@H](CCC(F)(F)F)Nc1cccc2c1CCNC2=O	ZINC000872079264	DH	On-Demand	Anodyne	PARP1	18	48
C[C@@H](NC[C@@H]1CC[C@@H](C(N)=O)CC1)c1cccc(O)c1F	ZINC000872079329	CE	On-Demand	Anodyne	VCP	40	37
OC1CCN(CCN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872079347	DE	On-Demand	Anodyne	SIGMAR1	18	51
OC1CCN(CCN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872079348	DE	On-Demand	Anodyne	SIGMAR1	18	51
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C)[C@@H]1CCCOC1	ZINC000872079371	EG	On-Demand	Anodyne	ACE	29	41
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C)[C@@H]1CCCOC1	ZINC000872079371	EG	On-Demand	Anodyne	TPP2	62	39
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C)[C@@H]1CCCOC1	ZINC000872079372	EG	On-Demand	Anodyne	ACE	29	41
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C)[C@@H]1CCCOC1	ZINC000872079372	EG	On-Demand	Anodyne	TPP2	62	39
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C)[C@H]1CCCOC1	ZINC000872079373	EG	On-Demand	Anodyne	ACE	29	41
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C)[C@H]1CCCOC1	ZINC000872079373	EG	On-Demand	Anodyne	TPP2	62	39
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C)[C@H]1CCCOC1	ZINC000872079375	EG	On-Demand	Anodyne	ACE	29	41
CC[C@H](N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C)[C@H]1CCCOC1	ZINC000872079375	EG	On-Demand	Anodyne	TPP2	62	39
NC(=O)C1CCN(Cc2ccc(CN[C@H]3CCOC4(CCCC4)C3)cc2)CC1	ZINC000872079545	GF	On-Demand	Anodyne	SIGMAR1	19	40
NC(=O)C1CCN(Cc2ccc(CN[C@@H]3CCOC4(CCCC4)C3)cc2)CC1	ZINC000872079546	GF	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000872079603	CG	On-Demand	Bother	COLA	77	33
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)C(C)C	ZINC000872079605	CG	On-Demand	Bother	COLA	77	33
CC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)C(C)C	ZINC000872079607	CG	On-Demand	Bother	COLA	77	33
CC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000872079610	CG	On-Demand	Bother	COLA	77	33
C[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)c1cc(O)ccc1F	ZINC000872079623	FG	On-Demand	Anodyne	SIGMAR1	56	39
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000872079624	FG	On-Demand	Bother	VCP	41	38
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000872079626	FG	On-Demand	Bother	VCP	41	38
CCS(=O)(=O)Cc1ccc(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872079670	GH	On-Demand	Anodyne	SIGMAR1	41	44
C[C@@H](NCCC(C)(C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872079708	EF	On-Demand	Bother	COLA	78	34
COc1cc2c(cc1OC)[C@@H](NC[C@H](O)Cn1ccnn1)CCCC2	ZINC000872079775	ED	On-Demand	Anodyne	SLC18A2	43	31
C[C@@H](NCC1(CS(C)(=O)=O)CCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872079798	EF	On-Demand	Bother	COLA	75	33
CC[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872079842	EF	On-Demand	Anodyne	SIGMAR1	53	36
CC[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872079843	EF	On-Demand	Anodyne	SIGMAR1	53	36
COc1cc2c(cc1OC)[C@@H](NC[C@@H](O)Cn1ccnn1)CCCC2	ZINC000872079869	ED	On-Demand	Anodyne	SLC18A2	43	31
COc1cc2c(cc1OC)[C@@H](NCc1ccccc1S(C)(=O)=O)CCCC2	ZINC000872079873	GH	On-Demand	Anodyne	TACR1	19	42
C[C@@H](CCCc1cccnc1)N[C@@H](C)c1cc(O)ccc1F	ZINC000872079905	DH	On-Demand	Anodyne	PTAFR	32	45
C[C@H](N[C@H](C)CCCc1cccnc1)c1cc(O)ccc1F	ZINC000872079906	DH	On-Demand	Anodyne	PTAFR	32	45
C[C@@H](CCCc1cccnc1)N[C@H](C)c1cc(O)ccc1F	ZINC000872079907	DH	On-Demand	Anodyne	PTAFR	32	45
C[C@@H](NCC1(CC(N)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872079998	CE	On-Demand	Bother	COLA	55	31
NC(=O)[C@@H]1CC[C@@H](CN[C@H]2CCCCc3ccccc3C2)CC1	ZINC000872080133	DG	On-Demand	Anodyne	VCP	47	38
NC(=O)[C@@H]1CC[C@@H](CN[C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872080135	DG	On-Demand	Anodyne	VCP	47	38
CC[C@H](CCC(F)(F)F)N[C@@H](C)CCCc1cccnc1	ZINC000872080136	DJ	On-Demand	Anodyne	PTAFR	28	44
CC[C@@H](CCC(F)(F)F)N[C@H](C)CCCc1cccnc1	ZINC000872080144	DJ	On-Demand	Anodyne	PTAFR	28	44
CC[C@H](CCC(F)(F)F)N[C@H](C)CCCc1cccnc1	ZINC000872080146	DJ	On-Demand	Anodyne	PTAFR	28	44
CC[C@@H](CCC(F)(F)F)N[C@@H](C)CCCc1cccnc1	ZINC000872080148	DJ	On-Demand	Anodyne	PTAFR	28	44
COc1cc2c(cc1OC)[C@@H](NC1CCN(OC)CC1)CCCC2	ZINC000872080231	EG	On-Demand	Anodyne	SLC18A2	40	33
FC(F)CN1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080247	EF	On-Demand	Anodyne	DRD4	26	41
FC(F)CN1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080247	EF	On-Demand	Anodyne	SIGMAR1	34	40
FC(F)CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080253	EF	On-Demand	Anodyne	DRD4	26	41
FC(F)CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080253	EF	On-Demand	Anodyne	SIGMAR1	34	40
FC(F)CN1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080256	EF	On-Demand	Anodyne	DRD4	26	41
FC(F)CN1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872080256	EF	On-Demand	Anodyne	SIGMAR1	34	40
C[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872080285	GG	On-Demand	Bother	SIGMAR1	45	38
C[C@@H](CCCc1cccnc1)N[C@@H](C)c1cccc(O)c1F	ZINC000872080286	DH	On-Demand	Anodyne	PTAFR	31	46
C[C@H](N[C@H](C)CCCc1cccnc1)c1cccc(O)c1F	ZINC000872080287	DH	On-Demand	Anodyne	PTAFR	31	46
C[C@@H](CCCc1cccnc1)N[C@H](C)c1cccc(O)c1F	ZINC000872080289	DH	On-Demand	Anodyne	PTAFR	31	46
C[C@@H](NCC1(N2CCOCC2)CCOCC1)c1cccc(O)c1F	ZINC000872080349	EE	On-Demand	Anodyne	HCN1	36	43
C[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)c1cccc(O)c1F	ZINC000872080527	FG	On-Demand	Anodyne	SIGMAR1	63	39
C[C@H](NCc1ccc(CN2CCC(C(N)=O)CC2)cc1)c1cccc(O)c1F	ZINC000872080570	GG	On-Demand	Anodyne	SIGMAR1	28	44
C[C@@H](N[C@@H](CCO)c1ccccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872080780	EH	On-Demand	Bother	COLA	62	32
C[C@@H](N[C@H](CCO)c1ccccc1F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872080781	EH	On-Demand	Bother	COLA	62	32
NC(=O)CC1(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872080802	EE	On-Demand	Anodyne	SIGMAR1	23	40
NC(=O)CC1(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872080802	EE	On-Demand	Anodyne	NPFFR1	41	38
C[C@@H](NCC1(N(C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872080844	CE	On-Demand	Bother	COLA	49	31
C[C@@H](NCCCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872080961	DE	On-Demand	Bother	COLA	73	34
CC[C@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081185	GH	On-Demand	Anodyne	SIGMAR1	22	42
CC[C@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081185	GH	On-Demand	Anodyne	DPP7	27	42
CC[C@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081185	GH	On-Demand	Anodyne	CACNA1G	38	43
CC[C@@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081186	GH	On-Demand	Anodyne	SIGMAR1	22	42
CC[C@@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081186	GH	On-Demand	Anodyne	DPP7	27	42
CC[C@@H](CCC(F)(F)F)NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000872081186	GH	On-Demand	Anodyne	CACNA1G	38	43
CCN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872081195	DF	On-Demand	Anodyne	DRD4	38	41
CCN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872081195	DF	On-Demand	Anodyne	ACHE	20	42
CCN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872081195	DF	On-Demand	Anodyne	SIGMAR1	41	42
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CC[C@@H](C(N)=O)CC1)CCCC2	ZINC000872081332	FG	On-Demand	Anodyne	MTNR1B	18	40
O=C(CCCc1ccccc1)NCCN[C@H]1CCOC2(CCCC2)C1	ZINC000872081389	EG	On-Demand	Anodyne	PREP	44	37
O=C(CCCc1ccccc1)NCCN[C@@H]1CCOC2(CCCC2)C1	ZINC000872081390	EG	On-Demand	Anodyne	PREP	44	37
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1cc(O)ccc1F	ZINC000872081588	EG	On-Demand	Anodyne	GRIA1	49	42
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1cc(O)ccc1F	ZINC000872081588	EG	On-Demand	Anodyne	CASP1	16	40
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1cc(O)ccc1F	ZINC000872081588	EG	On-Demand	Anodyne	CES1D	43	31
C[C@H](NCc1ccc(CN2CCC(C(N)=O)CC2)cc1)c1cc(O)ccc1F	ZINC000872081595	GG	On-Demand	Anodyne	SIGMAR1	23	44
C[C@H](NCc1ccc(CN2CCC(C(N)=O)CC2)cc1)c1cc(O)ccc1F	ZINC000872081595	GG	On-Demand	Anodyne	ALK	17	40
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1cccc(O)c1F	ZINC000872081649	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@H]1CCCOC1	ZINC000872081652	EF	On-Demand	Anodyne	MTNR1A	30	40
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@H]1CCCOC1	ZINC000872081652	EF	On-Demand	Anodyne	MTNR1B	30	40
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@H]1CCCOC1	ZINC000872081652	EF	On-Demand	Anodyne	MMP2	65	33
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872081653	EF	On-Demand	Anodyne	MTNR1A	30	40
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872081653	EF	On-Demand	Anodyne	MTNR1B	30	40
CC[C@@H](NCCNC(=O)CCCc1ccccc1)[C@@H]1CCCOC1	ZINC000872081653	EF	On-Demand	Anodyne	MMP2	65	33
OCc1ccc(CN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC000872081965	EG	On-Demand	Anodyne	SIGMAR1	30	41
C[C@H](NCc1ccc(CO)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082106	DG	On-Demand	Bother	COLA	69	33
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	F2	15	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	HTR1A	17	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	DRD4	50	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	F10	15	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	HTR7	28	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP13	44	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	TRY2_BOVIN	85	40
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP2	23	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP3	29	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP8	17	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP9	38	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP12	20	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	MMP1	37	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc1	ZINC000872082650	ID	On-Demand	Clean	AKR1C3	22	45
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082767	FH	On-Demand	Mild	SIGMAR1	25	45
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082767	FH	On-Demand	Mild	CCR3	32	45
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082767	FH	On-Demand	Mild	MLNR	23	41
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082767	FH	On-Demand	Mild	MCHR1	32	42
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082768	FH	On-Demand	Mild	SIGMAR1	25	45
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082768	FH	On-Demand	Mild	CCR3	32	45
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082768	FH	On-Demand	Mild	MLNR	23	41
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cccc(O)c1F	ZINC000872082768	FH	On-Demand	Mild	MCHR1	32	42
C[C@H](N[C@H](C)[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082841	EH	On-Demand	Bother	COLA	57	36
C[C@H](N[C@@H](C)[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082842	EH	On-Demand	Bother	COLA	57	36
C[C@H](N[C@H](C)[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082843	EH	On-Demand	Bother	COLA	57	36
C[C@H](N[C@@H](C)[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082844	EH	On-Demand	Bother	COLA	57	36
COc1cc2c(cc1OC)[C@@H](N[C@@H](CO)CCF)CCCC2	ZINC000872082945	DF	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@@H](N[C@H](CO)CCF)CCCC2	ZINC000872082947	DF	On-Demand	Anodyne	SLC18A2	51	37
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082974	GH	On-Demand	Mild	SIGMAR1	16	41
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082974	GH	On-Demand	Mild	CCR3	21	40
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082975	GH	On-Demand	Mild	SIGMAR1	16	41
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872082975	GH	On-Demand	Mild	CCR3	21	40
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000872083156	FI	On-Demand	Mild	SIGMAR1	22	46
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000872083156	FI	On-Demand	Mild	CCR3	22	42
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000872083156	FI	On-Demand	Mild	MLNR	26	41
CC[C@@H](CCC(F)(F)F)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000872083156	FI	On-Demand	Mild	MCHR1	22	41
CC[C@H](N[C@H](C)[C@](C)(O)c1ccccc1)[C@H]1CCCOC1	ZINC000872083260	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@H](N[C@H](C)[C@](C)(O)c1ccccc1)[C@@H]1CCCOC1	ZINC000872083261	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@H](N[C@H](C)[C@@](C)(O)c1ccccc1)[C@H]1CCCOC1	ZINC000872083262	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@H](N[C@H](C)[C@@](C)(O)c1ccccc1)[C@@H]1CCCOC1	ZINC000872083263	CG	On-Demand	Anodyne	AMY2	43	30
CO[C@@](C)(CO)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083268	CD	On-Demand	Bother	COLA	42	32
CO[C@@](C)(CO)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083270	CD	On-Demand	Bother	COLA	42	32
OC/C=C/CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872083444	CE	On-Demand	Anodyne	SIGMAR1	28	43
OC/C=C\CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872083445	CE	On-Demand	Anodyne	SIGMAR1	28	43
OC/C=C\CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872083446	CE	On-Demand	Anodyne	SIGMAR1	28	43
OC/C=C/CN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872083447	CE	On-Demand	Anodyne	SIGMAR1	28	43
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083620	FF	On-Demand	Anodyne	ADRB2	46	63
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083620	FF	On-Demand	Anodyne	ADRB1	62	63
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083620	FF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083620	FF	On-Demand	Anodyne	ADRB3	41	56
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083621	FF	On-Demand	Anodyne	ADRB2	46	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083621	FF	On-Demand	Anodyne	ADRB1	62	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083621	FF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872083621	FF	On-Demand	Anodyne	ADRB3	41	56
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083622	FF	On-Demand	Anodyne	ADRB2	46	63
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083622	FF	On-Demand	Anodyne	ADRB1	62	63
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083622	FF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083622	FF	On-Demand	Anodyne	ADRB3	41	56
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083623	FF	On-Demand	Anodyne	ADRB2	46	63
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083623	FF	On-Demand	Anodyne	ADRB1	62	63
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083623	FF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc(O)ccc2F)cc1	ZINC000872083623	FF	On-Demand	Anodyne	ADRB3	41	56
COC[C@@H](CCN[C@@H]1CCCCc2cc(OC)c(OC)cc21)OC	ZINC000872083653	EG	On-Demand	Anodyne	SLC18A2	47	34
COC[C@@H](CCN[C@H]1CCCCc2cc(OC)c(OC)cc21)OC	ZINC000872083655	EG	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](NCc1ccc(CNC(C)=O)cc1)CCCC2	ZINC000872083658	GH	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](NCc1ccc(CNC(C)=O)cc1)CCCC2	ZINC000872083658	GH	On-Demand	Anodyne	NQO2	16	51
COc1cc2c(cc1OC)[C@@H](NCc1ccc(CNC(C)=O)cc1)CCCC2	ZINC000872083658	GH	On-Demand	Anodyne	MTNR1B	34	41
Cc1ccncc1CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083676	DG	On-Demand	Bother	COLA	51	32
Cc1ccncc1CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083677	DG	On-Demand	Bother	COLA	51	32
O=C1CCCN1CCN[C@H]1CCCCc2ccccc2C1	ZINC000872083699	CF	On-Demand	Anodyne	TYRO3	19	50
O=C1CCCN1CCN[C@@H]1CCCCc2ccccc2C1	ZINC000872083700	CF	On-Demand	Anodyne	TYRO3	19	50
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083834	FH	On-Demand	Bother	ACHE	23	43
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083834	FH	On-Demand	Bother	SIGMAR1	21	43
COC(=O)N(C)CCN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083843	CE	On-Demand	Bother	COLA	100	35
COC(=O)N(C)CCN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872083844	CE	On-Demand	Bother	COLA	100	35
CC[C@@H](NCC1CCN(Cc2ccncc2)CC1)[C@H]1CCCOC1	ZINC000872084015	EG	On-Demand	Anodyne	SSTR5	41	34
CC[C@@H](NCC1CCN(Cc2ccncc2)CC1)[C@@H]1CCCOC1	ZINC000872084016	EG	On-Demand	Anodyne	SSTR5	41	34
O=C1CCCN1CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872084095	EE	On-Demand	Anodyne	ACHE	26	55
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	EDNRB	43	34
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	HTR7	16	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	BMP1	85	48
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP13	60	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	TRY2_BOVIN	49	35
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP2	32	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP3	41	45
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP8	29	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP9	44	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	PKM	32	47
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP12	24	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	MMP1	45	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	ZINC000872084144	JD	On-Demand	Clean	FFAR4	20	40
C[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000872084167	EG	On-Demand	Bother	COLA	73	35
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000872084168	EG	On-Demand	Bother	COLA	73	35
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084185	FH	On-Demand	Mild	DRD4	15	44
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084185	FH	On-Demand	Mild	SIGMAR1	24	44
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084185	FH	On-Demand	Mild	CCR3	29	42
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084185	FH	On-Demand	Mild	MLNR	20	40
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084185	FH	On-Demand	Mild	MCHR1	41	42
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084186	FH	On-Demand	Mild	DRD4	15	44
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084186	FH	On-Demand	Mild	SIGMAR1	24	44
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084186	FH	On-Demand	Mild	CCR3	29	42
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084186	FH	On-Demand	Mild	MLNR	20	40
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc(O)ccc1F	ZINC000872084186	FH	On-Demand	Mild	MCHR1	41	42
COC1CC(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084219	EG	On-Demand	Anodyne	ACHE	27	40
COC1CC(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084221	EG	On-Demand	Anodyne	ACHE	27	40
N#Cc1cccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872084263	FH	On-Demand	Mild	SIGMAR1	18	45
N#Cc1cccc(CN2CCC(N[C@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872084263	FH	On-Demand	Mild	MCHR1	18	41
C[C@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cccc(O)c1F	ZINC000872084282	EF	On-Demand	Anodyne	SIGMAR1	17	40
C[C@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cccc(O)c1F	ZINC000872084282	EF	On-Demand	Anodyne	SLC18A3	21	40
C[C@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cccc(O)c1F	ZINC000872084283	EF	On-Demand	Anodyne	SIGMAR1	17	40
C[C@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cccc(O)c1F	ZINC000872084283	EF	On-Demand	Anodyne	SLC18A3	21	40
N#Cc1cccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872084306	FH	On-Demand	Mild	SIGMAR1	18	45
N#Cc1cccc(CN2CCC(N[C@@H]3CCOC4(CCCC4)C3)CC2)c1	ZINC000872084306	FH	On-Demand	Mild	MCHR1	18	41
COc1cc2c(cc1OC)[C@@H](NCCN1CCCC1=O)CCCC2	ZINC000872084334	EF	On-Demand	Anodyne	SLC18A2	40	35
CC[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)[C@H]1CCCOC1	ZINC000872084349	DE	On-Demand	Anodyne	PYGM	25	40
CC[C@H](N[C@H]1Cc2ccccc2N(C)C1=O)[C@H]1CCCOC1	ZINC000872084350	DE	On-Demand	Anodyne	PYGM	25	40
CC[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)[C@@H]1CCCOC1	ZINC000872084351	DE	On-Demand	Anodyne	PYGM	25	40
CC[C@H](N[C@H]1Cc2ccccc2N(C)C1=O)[C@@H]1CCCOC1	ZINC000872084352	DE	On-Demand	Anodyne	PYGM	25	40
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1CC(=O)N(C)C1)CCCC2	ZINC000872084575	EF	On-Demand	Anodyne	SLC18A2	41	37
COc1cc2c(cc1OC)[C@@H](NC[C@H]1CC(=O)N(C)C1)CCCC2	ZINC000872084576	EF	On-Demand	Anodyne	SLC18A2	41	37
NC(=O)[C@H]1C[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084676	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)[C@H]1C[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084676	DD	On-Demand	Anodyne	SIGMAR1	28	42
NC(=O)[C@H]1C[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084678	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)[C@H]1C[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084678	DD	On-Demand	Anodyne	SIGMAR1	28	42
COC[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000872084809	EH	On-Demand	Bother	TAAR1	21	41
COC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000872084812	EH	On-Demand	Bother	TAAR1	21	41
COC[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000872084815	EH	On-Demand	Bother	TAAR1	21	41
COC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000872084819	EH	On-Demand	Bother	TAAR1	21	41
CS(=O)(=O)N1CC[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084917	FD	On-Demand	Anodyne	DRD4	25	41
CS(=O)(=O)N1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084919	FD	On-Demand	Anodyne	DRD4	25	41
CS(=O)(=O)N1CC[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872084922	FD	On-Demand	Anodyne	DRD4	25	41
COC(=O)Cc1ccccc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872084957	EG	On-Demand	Bother	COLA	120	39
COC(=O)Cc1ccccc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872084983	EG	On-Demand	Bother	COLA	120	39
COC(=O)N(C)CCN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872085306	EE	On-Demand	Anodyne	ACHE	18	40
COC(=O)N(C)CCN[C@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000872085307	EE	On-Demand	Anodyne	ACHE	18	40
COC(=O)c1nc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)ccc1Cl	ZINC000872085378	GI	On-Demand	Bother	CACNA1D	45	34
COC(=O)c1nc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)ccc1Cl	ZINC000872085380	GI	On-Demand	Bother	CACNA1D	45	34
Cn1cnnc1N1CCN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872085387	FD	On-Demand	Anodyne	SLC18A3	15	42
Cn1cnnc1N1CCN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872085389	FD	On-Demand	Anodyne	SLC18A3	15	42
CC[C@@H](CCC(F)(F)F)NCC1CCN(Cc2ccncc2)CC1	ZINC000872085449	EI	On-Demand	Anodyne	ACHE	26	44
C[C@@H](N[C@H]1Cc2ccccc2N(C)C1=O)c1cc(O)ccc1F	ZINC000872085568	DF	On-Demand	Anodyne	PYGL	31	49
C[C@@H](N[C@H]1Cc2ccccc2N(C)C1=O)c1cc(O)ccc1F	ZINC000872085568	DF	On-Demand	Anodyne	PYGM	30	49
C[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)c1cc(O)ccc1F	ZINC000872085569	DF	On-Demand	Anodyne	PYGL	31	49
C[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)c1cc(O)ccc1F	ZINC000872085569	DF	On-Demand	Anodyne	PYGM	30	49
C[C@@H](NCCS(=O)(=O)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872085670	FE	On-Demand	Bother	COLA	67	36
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872085689	EG	On-Demand	Anodyne	SIGMAR1	22	47
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872085689	EG	On-Demand	Anodyne	SSTR5	44	35
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1cc(O)ccc1F	ZINC000872085689	EG	On-Demand	Anodyne	CACNA1I	43	38
C[C@@H](N[C@H]1Cc2ccccc2N(C)C1=O)c1cccc(O)c1F	ZINC000872085832	DF	On-Demand	Anodyne	PYGL	26	41
C[C@@H](N[C@H]1Cc2ccccc2N(C)C1=O)c1cccc(O)c1F	ZINC000872085832	DF	On-Demand	Anodyne	PYGM	28	43
C[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)c1cccc(O)c1F	ZINC000872085834	DF	On-Demand	Anodyne	PYGL	26	41
C[C@H](N[C@@H]1Cc2ccccc2N(C)C1=O)c1cccc(O)c1F	ZINC000872085834	DF	On-Demand	Anodyne	PYGM	28	43
CC[C@H](CCC(F)(F)F)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000872085849	DG	On-Demand	Anodyne	PYGM	26	41
CC[C@H](CCC(F)(F)F)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000872085850	DG	On-Demand	Anodyne	PYGM	26	41
CC[C@@H](CCC(F)(F)F)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000872085851	DG	On-Demand	Anodyne	PYGM	26	41
CC[C@@H](CCC(F)(F)F)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000872085852	DG	On-Demand	Anodyne	PYGM	26	41
C[C@@H](NCCC(C)(C)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872085954	CH	On-Demand	Bother	COLA	45	34
C[C@@H](NCCC1(CS(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872086012	EF	On-Demand	Bother	COLA	75	34
C[C@@H](NC/C=C/CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872086188	CD	On-Demand	Bother	COLA	74	34
C[C@H](NC/C=C/CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872086189	CD	On-Demand	Bother	COLA	74	34
C[C@@H](NC/C=C\CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872086190	CD	On-Demand	Bother	COLA	74	34
C[C@H](NC/C=C\CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872086191	CD	On-Demand	Bother	COLA	74	34
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086437	FF	On-Demand	Anodyne	ADRB2	54	66
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086437	FF	On-Demand	Anodyne	ADRB1	69	66
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086437	FF	On-Demand	Anodyne	ADRB3	44	53
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086439	FF	On-Demand	Anodyne	ADRB2	54	66
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086439	FF	On-Demand	Anodyne	ADRB1	69	66
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086439	FF	On-Demand	Anodyne	ADRB3	44	53
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086442	FF	On-Demand	Anodyne	ADRB2	54	66
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086442	FF	On-Demand	Anodyne	ADRB1	69	66
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(O)c2F)cc1	ZINC000872086442	FF	On-Demand	Anodyne	ADRB3	44	53
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086444	FF	On-Demand	Anodyne	ADRB2	54	66
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086444	FF	On-Demand	Anodyne	ADRB1	69	66
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872086444	FF	On-Demand	Anodyne	ADRB3	44	53
COc1cc2c(cc1OC)[C@@H](N[C@@H](C)C1(CO)CC1)CCCC2	ZINC000872086521	DG	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@@H](N[C@H](C)C1(CO)CC1)CCCC2	ZINC000872086522	DG	On-Demand	Anodyne	SLC18A2	46	35
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872086707	EG	On-Demand	Anodyne	ACHE	26	41
C[C@@H](NCC1CCN(Cc2ccncc2)CC1)c1cccc(O)c1F	ZINC000872086707	EG	On-Demand	Anodyne	SIGMAR1	28	48
CC(=O)NCc1ccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872086841	EG	On-Demand	Bother	COLA	80	32
CC(=O)NCc1ccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872086842	EG	On-Demand	Bother	COLA	80	32
COc1cccc([C@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1	ZINC000872086900	EH	On-Demand	Bother	TAAR1	20	40
COc1cccc([C@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1	ZINC000872086901	EH	On-Demand	Bother	TAAR1	20	40
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3N3CCN(c4nccnn4)CC3)C2)cc1	ZINC000872086934	FD	On-Demand	Anodyne	SLC18A3	15	42
c1ccc(CN2C[C@H]3[C@@H](N4CCN(c5nccnn5)CC4)CC[C@H]3C2)cc1	ZINC000872086936	FD	On-Demand	Anodyne	SLC18A3	15	42
COc1cc2c(cc1OC)[C@@H](NC/C=C/CO)CCCC2	ZINC000872086951	CF	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](NC/C=C\CO)CCCC2	ZINC000872086952	CF	On-Demand	Anodyne	SLC18A2	47	33
CC[C@@H](N[C@@H]1CCN(C(C)=O)C1)C(C)(C)CC	ZINC000872086987	BE	On-Demand	Anodyne	EPHX2	17	45
CC[C@H](N[C@@H]1CCN(C(C)=O)C1)C(C)(C)CC	ZINC000872086989	BE	On-Demand	Anodyne	EPHX2	17	45
C[C@@H](NC[C@@H]1CCCN(CC2CC2)C1)c1cc(O)ccc1F	ZINC000872086991	DG	On-Demand	Anodyne	CCR3	40	37
COc1cc2c(cc1OC)[C@@H](NCCCN1CCC[C@H]1C(N)=O)CCCC2	ZINC000872087039	GE	On-Demand	Anodyne	FKBP1A	23	40
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3NC3CCN([C@H]4CCOC4)CC3)C2)cc1	ZINC000872087049	FF	On-Demand	Anodyne	DRD4	19	40
c1ccc(CN2C[C@@H]3[C@@H](CC[C@H]3NC3CCN([C@@H]4CCOC4)CC3)C2)cc1	ZINC000872087050	FF	On-Demand	Anodyne	DRD4	19	40
CC(=O)N(C)c1ccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872087131	EH	On-Demand	Bother	COLA	84	34
CC(=O)N(C)c1ccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1	ZINC000872087132	EH	On-Demand	Bother	COLA	84	34
COc1cc2c(cc1OC)[C@@H](NC1CC(CO)C1)CCCC2	ZINC000872087465	DF	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](N[C@H]1C[C@H](O)C1)CCCC2	ZINC000872087857	CF	On-Demand	Anodyne	SLC18A2	46	35
C[C@H](NC[C@H](O)c1cc(F)c(F)c(F)c1)c1cccc(O)c1F	ZINC000872088183	EG	On-Demand	Anodyne	ADRB2	17	43
C[C@@H](NC[C@@H](O)c1cc(F)c(F)c(F)c1)c1cccc(O)c1F	ZINC000872088184	EG	On-Demand	Anodyne	ADRB2	17	43
CC[C@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)[C@@H]1CCCOC1	ZINC000872088269	EH	On-Demand	Anodyne	SSTR3	30	44
CC[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)[C@H]1CCCOC1	ZINC000872088270	EH	On-Demand	Anodyne	SSTR3	30	44
CC[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)[C@@H]1CCCOC1	ZINC000872088371	EH	On-Demand	Anodyne	SSTR3	30	44
CC[C@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)[C@H]1CCCOC1	ZINC000872088372	EH	On-Demand	Anodyne	SSTR3	30	44
COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCN(C(C)=O)C1)CCCC2	ZINC000872088385	EF	On-Demand	Anodyne	SLC18A2	46	34
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(C)=O)C1	ZINC000872088433	CE	On-Demand	Anodyne	EPHX2	22	41
CC[C@@H](CCC(F)(F)F)N[C@@H]1CCN(C(C)=O)C1	ZINC000872088436	CE	On-Demand	Anodyne	EPHX2	22	41
COc1cc2c(cc1OC)[C@@H](NCCOCCF)CCCC2	ZINC000872088457	DG	On-Demand	Anodyne	SLC18A2	41	37
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872088460	EH	On-Demand	Bother	COLA	82	32
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872088463	EH	On-Demand	Bother	COLA	82	32
NC(=O)[C@@H]1C[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872088617	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)[C@@H]1C[C@@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872088617	DD	On-Demand	Anodyne	SIGMAR1	28	42
NC(=O)[C@@H]1C[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872088618	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)[C@@H]1C[C@@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872088618	DD	On-Demand	Anodyne	SIGMAR1	28	42
CC[C@@H](NCCCN1CCC[C@H]1C(N)=O)C(C)(C)CC	ZINC000872088879	CE	On-Demand	Anodyne	TPP2	27	40
C[C@@H](NCCCN1CCC[C@H]1C(N)=O)c1cc(O)ccc1F	ZINC000872088996	DD	On-Demand	Anodyne	NTSR1	43	30
NC(=O)[C@@H]1CCCN1CCCN[C@@H]1CCCCc2ccccc2C1	ZINC000872089083	EE	On-Demand	Anodyne	HTR1A	16	43
NC(=O)[C@@H]1CCCN1CCCN[C@@H]1CCCCc2ccccc2C1	ZINC000872089083	EE	On-Demand	Anodyne	PREP	54	38
NC(=O)[C@@H]1CCCN1CCCN[C@H]1CCCCc2ccccc2C1	ZINC000872089084	EE	On-Demand	Anodyne	HTR1A	16	43
NC(=O)[C@@H]1CCCN1CCCN[C@H]1CCCCc2ccccc2C1	ZINC000872089084	EE	On-Demand	Anodyne	PREP	54	38
COc1cc2c(cc1OC)[C@@H](NCC1CCC(O)CC1)CCCC2	ZINC000872089196	EH	On-Demand	Anodyne	SLC18A2	46	34
C[C@@H](NCC1CCN(CC2CC2)CC1)c1cc(O)ccc1F	ZINC000872089381	DG	On-Demand	Anodyne	CACNA1I	42	33
CCOC(=O)C1=CC[C@@H](N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872089734	DG	On-Demand	Bother	CACNA1D	43	36
CCOC(=O)C1=CC[C@H](N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872089735	DG	On-Demand	Bother	CACNA1D	43	36
CCOC(=O)C1=CC[C@H](N[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872089736	DG	On-Demand	Bother	CACNA1D	43	36
CCOC(=O)C1=CC[C@@H](N[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000872089737	DG	On-Demand	Bother	CACNA1D	43	36
C/C=C/CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089964	BF	On-Demand	Bother	COLA	44	33
C/C=C/CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089965	BF	On-Demand	Bother	COLA	44	33
C/C=C\CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089966	BF	On-Demand	Bother	COLA	44	33
C/C=C\CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089967	BF	On-Demand	Bother	COLA	44	33
C[C@@H](NCC(C)(C)C(=O)N1CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089980	EG	On-Demand	Bother	COLA	53	32
C[C@H](NCC(C)(C)C(=O)N1CCCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089981	EG	On-Demand	Bother	COLA	53	32
C[C@@H](NCC1CC(O)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872089989	CE	On-Demand	Bother	COLA	40	31
NC(=O)C[C@@H]1CN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872090154	ED	On-Demand	Anodyne	DRD4	21	42
NC(=O)C[C@H]1CN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872090155	ED	On-Demand	Anodyne	DRD4	21	42
NC(=O)C[C@H]1CN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872090156	ED	On-Demand	Anodyne	DRD4	21	42
NC(=O)C[C@@H]1CN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872090157	ED	On-Demand	Anodyne	DRD4	21	42
O[C@H]1CCN(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872090193	ED	On-Demand	Anodyne	SIGMAR1	41	40
O[C@H]1CCN(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872090194	ED	On-Demand	Anodyne	SIGMAR1	41	40
O[C@@H]1CCN(CCN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872090195	ED	On-Demand	Anodyne	SIGMAR1	41	40
O[C@@H]1CCN(CCN[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872090196	ED	On-Demand	Anodyne	SIGMAR1	41	40
C[C@@H](NCC[C@@H](O)C(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872090358	CE	On-Demand	Bother	COLA	42	31
C[C@@H](NCC[C@H](O)C(F)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872090360	CE	On-Demand	Bother	COLA	42	31
C[C@@H](NCC(C)(C)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872090378	CG	On-Demand	Bother	COLA	54	35
C[C@H](NCC(C)(C)F)c1c(F)cccc1[N+](=O)[O-]	ZINC000872090379	CG	On-Demand	Bother	COLA	54	35
Cc1ccc(CN2CCO[C@H](CN[C@H]3CCOC(C)(C)C3)C2)cc1	ZINC000872090470	EF	On-Demand	Anodyne	DRD4	15	42
Cc1ccc(CN2CCO[C@H](CN[C@@H]3CCOC(C)(C)C3)C2)cc1	ZINC000872090471	EF	On-Demand	Anodyne	DRD4	15	42
C[C@@H](NCCOCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872090682	EF	On-Demand	Bother	COLA	49	33
CNS(=O)(=O)c1ccc(CCN[C@H](C)c2cc(O)ccc2F)cc1	ZINC000872090694	FE	On-Demand	Anodyne	TBXA2R	50	38
COc1cc2c(cc1OC)[C@@H](NCCN1CC[C@H](O)C1)CCCC2	ZINC000872090826	EE	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@@H](NCCN1CC[C@@H](O)C1)CCCC2	ZINC000872090827	EE	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@@H](N[C@@H]1C[C@H](CO)C1)CCCC2	ZINC000872090894	DF	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1C[C@H](O)C1)CCCC2	ZINC000872091171	DF	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](NCC1CC(O)C1)CCCC2	ZINC000872091175	DF	On-Demand	Anodyne	SLC18A2	47	35
C[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872091316	EC	On-Demand	Bother	COLA	44	32
C[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872091320	EC	On-Demand	Bother	COLA	44	32
CC[C@H](CCC(F)(F)F)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872091410	FH	On-Demand	Anodyne	CTSF	53	36
CC[C@@H](CCC(F)(F)F)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872091417	FH	On-Demand	Anodyne	CTSF	53	36
CC[C@@H](CCC(F)(F)F)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872091419	FH	On-Demand	Anodyne	CTSF	53	36
CC[C@H](CCC(F)(F)F)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000872091420	FH	On-Demand	Anodyne	CTSF	53	36
C[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000872091435	GH	On-Demand	Bother	COLA	74	34
C[C@H](NC[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872091436	GH	On-Demand	Bother	COLA	74	34
N#CCCN1CCN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872091599	EE	On-Demand	Mild	SLC18A3	17	40
N#CCCN1CCN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872091604	EE	On-Demand	Mild	SLC18A3	17	40
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872091708	EH	On-Demand	Anodyne	FKBP1A	15	42
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000872091708	EH	On-Demand	Anodyne	SLC12A5	60	36
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872091712	EH	On-Demand	Anodyne	FKBP1A	15	42
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000872091712	EH	On-Demand	Anodyne	SLC12A5	60	36
COc1cc2c(cc1OC)[C@@H](NC[C@@H]1C[C@H](OC)C1)CCCC2	ZINC000872091788	DG	On-Demand	Anodyne	SLC18A2	46	33
N#CCCN1CCN([C@H]2CCCCc3ccccc3C2)CC1	ZINC000872091913	CF	On-Demand	Mild	SIGMAR1	19	47
N#CCCN1CCN([C@H]2CCCCc3ccccc3C2)CC1	ZINC000872091913	CF	On-Demand	Mild	EBP	17	41
N#CCCN1CCN([C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872091914	CF	On-Demand	Mild	SIGMAR1	19	47
N#CCCN1CCN([C@@H]2CCCCc3ccccc3C2)CC1	ZINC000872091914	CF	On-Demand	Mild	EBP	17	41
CC[C@@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872091951	EG	On-Demand	Anodyne	FKBP1A	22	40
CC[C@@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872091951	EG	On-Demand	Anodyne	CAPN2	45	37
CC[C@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872091952	EG	On-Demand	Anodyne	FKBP1A	22	40
CC[C@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872091952	EG	On-Demand	Anodyne	CAPN2	45	37
CC[C@@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872091953	EG	On-Demand	Anodyne	FKBP1A	22	40
CC[C@@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@@H]1CCCOC1	ZINC000872091953	EG	On-Demand	Anodyne	CAPN2	45	37
CC[C@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872091954	EG	On-Demand	Anodyne	FKBP1A	22	40
CC[C@H](N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)[C@H]1CCCOC1	ZINC000872091954	EG	On-Demand	Anodyne	CAPN2	45	37
COc1cc2c(cc1OC)[C@@H](NCC[C@H](O)C(F)F)CCCC2	ZINC000872092039	EG	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](NCC[C@@H](O)C(F)F)CCCC2	ZINC000872092041	EG	On-Demand	Anodyne	SLC18A2	49	36
CNS(=O)(=O)c1ccc(CCN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872092259	FE	On-Demand	Anodyne	CA2	20	42
CNS(=O)(=O)c1ccc(CCN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872092259	FE	On-Demand	Anodyne	CA1	23	41
CNS(=O)(=O)c1ccc(CCN[C@H](C)c2cccc(O)c2F)cc1	ZINC000872092259	FE	On-Demand	Anodyne	CA9	18	41
CC[C@@H](CCC(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872092412	EG	On-Demand	Anodyne	ETHR	58	43
CC[C@@H](CCC(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872092413	EG	On-Demand	Anodyne	ETHR	58	43
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(CCC#N)CC1	ZINC000872092468	EF	On-Demand	Mild	KCNJ1	25	42
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(CCC#N)CC1	ZINC000872092470	EF	On-Demand	Mild	KCNJ1	25	42
C[C@@H](C1CN(C(=O)OC(C)(C)C)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872092557	GF	On-Demand	Anodyne	ETHR	40	35
C[C@@H](C1CN(C(=O)OC(C)(C)C)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872092560	GF	On-Demand	Anodyne	ETHR	40	35
COCc1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1OC	ZINC000872092573	DH	On-Demand	Anodyne	QRFPR	40	33
COCc1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1OC	ZINC000872092574	DH	On-Demand	Anodyne	QRFPR	40	33
CC[C@H](CCC(F)(F)F)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872092715	EH	On-Demand	Anodyne	SFRP1	74	34
CC[C@H](CCC(F)(F)F)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872092715	EH	On-Demand	Anodyne	WNT3	44	34
CC[C@@H](CCC(F)(F)F)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872092716	EH	On-Demand	Anodyne	SFRP1	74	34
CC[C@@H](CCC(F)(F)F)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872092716	EH	On-Demand	Anodyne	WNT3	44	34
C[C@H](c1cccc(Cl)c1)N1CCC2(CCNC2=O)CC1	ZINC000872092730	CG	On-Demand	Anodyne	OPRL1	15	47
C[C@@H](c1cccc(Cl)c1)N1CCC2(CCNC2=O)CC1	ZINC000872092732	CG	On-Demand	Anodyne	OPRL1	15	47
CC(=O)N1CCN(c2ccc(N[C@@H](C)c3c(F)cccc3[N+](=O)[O-])cc2)CC1	ZINC000872092790	GH	On-Demand	Bother	BCL2L1	53	33
CC(=O)N1CCN(c2ccc(N[C@@H](C)c3c(F)cccc3[N+](=O)[O-])cc2)CC1	ZINC000872092790	GH	On-Demand	Bother	BCL2	47	31
CC(=O)N1CCN(c2ccc(N[C@H](C)c3c(F)cccc3[N+](=O)[O-])cc2)CC1	ZINC000872092791	GH	On-Demand	Bother	BCL2L1	53	33
CC(=O)N1CCN(c2ccc(N[C@H](C)c3c(F)cccc3[N+](=O)[O-])cc2)CC1	ZINC000872092791	GH	On-Demand	Bother	BCL2	47	31
NC(=O)C1CC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093027	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)C1CC(N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093027	DD	On-Demand	Anodyne	SIGMAR1	28	42
NC(=O)C1CC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093029	DD	On-Demand	Anodyne	DRD4	24	40
NC(=O)C1CC(N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093029	DD	On-Demand	Anodyne	SIGMAR1	28	42
C[C@@H](Nc1ccc(CCNC(=O)N(C)C)cc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872093032	FH	On-Demand	Bother	COLA	49	36
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	HTR1A	29	42
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	DRD2	16	42
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	ADRA1D	22	42
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	ADRA1A	22	42
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	ADRA1B	20	42
COc1ccccc1N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093132	GF	On-Demand	Anodyne	HTR7	21	41
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	HTR1A	29	42
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	DRD2	16	42
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	ADRA1D	22	42
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	ADRA1A	22	42
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	ADRA1B	20	42
COc1ccccc1N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872093133	GF	On-Demand	Anodyne	HTR7	21	41
Cn1nnnc1C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093144	ED	On-Demand	Anodyne	DRD4	35	43
Cn1nnnc1C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093144	ED	On-Demand	Anodyne	ACHE	19	41
Cn1nnnc1C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093144	ED	On-Demand	Anodyne	SIGMAR1	36	41
Cn1nnnc1C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093144	ED	On-Demand	Anodyne	SLC18A3	25	41
Cn1nnnc1C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093146	ED	On-Demand	Anodyne	DRD4	35	43
Cn1nnnc1C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093146	ED	On-Demand	Anodyne	ACHE	19	41
Cn1nnnc1C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093146	ED	On-Demand	Anodyne	SIGMAR1	36	41
Cn1nnnc1C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872093146	ED	On-Demand	Anodyne	SLC18A3	25	41
COC(=O)CCC[C@@H]1CCC[C@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000872093212	GG	On-Demand	Anodyne	ETHR	47	36
COC(=O)CCC[C@@H]1CCC[C@@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000872093214	GG	On-Demand	Anodyne	ETHR	47	36
COC(=O)CCC[C@@H]1CCC[C@@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000872093216	GG	On-Demand	Anodyne	ETHR	47	36
COC(=O)CCC[C@@H]1CCC[C@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000872093218	GG	On-Demand	Anodyne	ETHR	47	36
CC(C)c1ccccc1NC(=O)C[C@@H](C)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872093258	GH	On-Demand	Anodyne	SMO	35	47
CC(C)c1ccccc1NC(=O)C[C@@H](C)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872093259	GH	On-Demand	Anodyne	SMO	35	47
CC(C)c1ccccc1NC(=O)C[C@H](C)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872093260	GH	On-Demand	Anodyne	SMO	35	47
CC(C)c1ccccc1NC(=O)C[C@H](C)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872093262	GH	On-Demand	Anodyne	SMO	35	47
CC(C)(O)CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093410	FE	On-Demand	Anodyne	DRD4	34	40
CC(C)(O)CN1CC[C@H](N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093410	FE	On-Demand	Anodyne	SIGMAR1	32	40
CC(C)(O)CN1CC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093411	FE	On-Demand	Anodyne	DRD4	34	40
CC(C)(O)CN1CC[C@H](N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000872093411	FE	On-Demand	Anodyne	SIGMAR1	32	40
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872093633	FG	On-Demand	Anodyne	GPR119	35	41
CC[C@H](CCC(F)(F)F)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872093636	FG	On-Demand	Anodyne	GPR119	35	41
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872093638	FG	On-Demand	Anodyne	GPR119	35	41
CC[C@H](CCC(F)(F)F)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872093640	FG	On-Demand	Anodyne	GPR119	35	41
C[C@@H](CCc1ccccc1)N1CCC(c2nnnn2C)CC1	ZINC000872093780	CE	On-Demand	Anodyne	SLC18A2	24	40
C[C@H](CCc1ccccc1)N1CCC(c2nnnn2C)CC1	ZINC000872093782	CE	On-Demand	Anodyne	SLC18A2	24	40
c1cnc2c(c1)CCC[C@H]2N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872093888	EF	On-Demand	Anodyne	CXCR4	42	33
c1cnc2c(c1)CCC[C@@H]2N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872093889	EF	On-Demand	Anodyne	CXCR4	42	33
c1cnc2c(c1)CCC[C@H]2N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872093890	EF	On-Demand	Anodyne	CXCR4	42	33
c1cnc2c(c1)CCC[C@@H]2N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872093891	EF	On-Demand	Anodyne	CXCR4	42	33
C[C@@H](CCCC(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872093940	EG	On-Demand	Anodyne	ETHR	60	44
C[C@@H](CCCC(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872093941	EG	On-Demand	Anodyne	ETHR	60	44
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	CHRM2	15	53
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	DRD4	30	40
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	ACHE	27	40
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	OPRL1	29	43
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	CHRM3	15	53
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	SIGMAR1	60	42
O=C1NCCC12CCN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094289	DD	On-Demand	Anodyne	SLC18A3	25	42
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	CHRM2	15	53
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	DRD4	30	40
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	ACHE	27	40
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	OPRL1	29	43
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	CHRM3	15	53
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	SIGMAR1	60	42
O=C1NCCC12CCN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872094292	DD	On-Demand	Anodyne	SLC18A3	25	42
O=C1NCCC12CCN([C@H]1CCc3c(Cl)cccc31)CC2	ZINC000872094476	DF	On-Demand	Anodyne	OPRL1	24	53
O=C1NCCC12CCN([C@@H]1CCc3c(Cl)cccc31)CC2	ZINC000872094479	DF	On-Demand	Anodyne	OPRL1	24	53
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	EDNRB	43	36
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	BMP1	77	49
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	MMP13	33	42
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	MMP3	25	42
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	PKM	37	52
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	ZINC000872094619	ID	On-Demand	Clean	MMP1	26	44
C[C@@H](CC(=O)N1CCCCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872094688	FF	On-Demand	Anodyne	ETHR	63	45
C[C@@H](CC(=O)N1CCCCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872094689	FF	On-Demand	Anodyne	ETHR	63	45
COc1ccccc1NC(=O)C[C@@H](C)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872094725	GF	On-Demand	Anodyne	SMO	34	48
COc1ccccc1NC(=O)C[C@@H](C)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872094726	GF	On-Demand	Anodyne	SMO	34	48
COc1ccccc1NC(=O)C[C@H](C)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872094827	GF	On-Demand	Anodyne	SMO	34	48
COc1ccccc1NC(=O)C[C@H](C)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872094828	GF	On-Demand	Anodyne	SMO	34	48
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)CC2)cc1	ZINC000872094998	JG	On-Demand	Clean	CHRM2	24	40
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)CC2)cc1	ZINC000872094998	JG	On-Demand	Clean	MMP13	35	43
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)CC2)cc1	ZINC000872094998	JG	On-Demand	Clean	MMP2	21	40
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)CC2)cc1	ZINC000872094998	JG	On-Demand	Clean	SSTR1	84	39
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)CC2)cc1	ZINC000872094998	JG	On-Demand	Clean	MMP9	25	40
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)CC2)cc1	ZINC000872094999	JG	On-Demand	Clean	CHRM2	24	40
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)CC2)cc1	ZINC000872094999	JG	On-Demand	Clean	MMP13	35	43
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)CC2)cc1	ZINC000872094999	JG	On-Demand	Clean	MMP2	21	40
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)CC2)cc1	ZINC000872094999	JG	On-Demand	Clean	SSTR1	84	39
COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)CC2)cc1	ZINC000872094999	JG	On-Demand	Clean	MMP9	25	40
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095022	GG	On-Demand	Anodyne	ETHR	53	39
CC(C)(C)OC(=O)N1CCC[C@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095023	GG	On-Demand	Anodyne	ETHR	53	39
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095024	GG	On-Demand	Anodyne	ETHR	53	39
CC(C)(C)OC(=O)N1CCC[C@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095025	GG	On-Demand	Anodyne	ETHR	53	39
C[C@@H](c1ccc(OCC(F)(F)F)cc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095060	GI	On-Demand	Anodyne	ETHR	52	34
C[C@@H](c1ccc(OCC(F)(F)F)cc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095062	GI	On-Demand	Anodyne	ETHR	52	34
COC(=O)N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095089	ED	On-Demand	Anodyne	ETHR	54	38
COC(=O)N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095090	ED	On-Demand	Anodyne	ETHR	54	38
C[C@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095200	GF	On-Demand	Anodyne	ETHR	42	36
C[C@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095202	GF	On-Demand	Anodyne	ETHR	42	36
C[C@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095204	GF	On-Demand	Anodyne	ETHR	42	36
C[C@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095206	GF	On-Demand	Anodyne	ETHR	42	36
C[C@H](c1cccc(C(F)(F)F)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095343	FI	On-Demand	Anodyne	ETHR	40	32
C[C@H](c1cccc(C(F)(F)F)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095344	FI	On-Demand	Anodyne	ETHR	40	32
C[C@@H](c1cccc(C(F)(F)F)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095345	FI	On-Demand	Anodyne	ETHR	40	32
C[C@@H](c1cccc(C(F)(F)F)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095346	FI	On-Demand	Anodyne	ETHR	40	32
C[C@H](CC(=O)OC(C)(C)C)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095412	EE	On-Demand	Anodyne	ETHR	41	36
C[C@H](CC(=O)OC(C)(C)C)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095414	EE	On-Demand	Anodyne	ETHR	41	36
C[C@@H](c1cccc(O)c1F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095473	EF	On-Demand	Anodyne	ETHR	41	35
C[C@@H](c1cccc(O)c1F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095474	EF	On-Demand	Anodyne	ETHR	41	35
CCOC(=O)N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095575	FD	On-Demand	Anodyne	ETHR	56	39
CCOC(=O)N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872095576	FD	On-Demand	Anodyne	ETHR	56	39
C[C@@H](CC(=O)N(C)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872095595	FF	On-Demand	Anodyne	ETHR	43	38
C[C@@H](CC(=O)N(C)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872095596	FF	On-Demand	Anodyne	ETHR	43	38
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000872095776	GF	On-Demand	Anodyne	ETHR	62	38
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000872095777	GF	On-Demand	Anodyne	ETHR	62	38
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000872095778	GF	On-Demand	Anodyne	ETHR	62	38
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000872095779	GF	On-Demand	Anodyne	ETHR	62	38
O=C1NCCC12CCN([C@H]1CCc3ccccc31)CC2	ZINC000872095859	CE	On-Demand	Anodyne	OPRL1	37	59
O=C1NCCC12CCN([C@@H]1CCc3ccccc31)CC2	ZINC000872095860	CE	On-Demand	Anodyne	OPRL1	37	59
O=C1NCCC12CCN([C@H]1CCCc3ccccc31)CC2	ZINC000872095887	CF	On-Demand	Anodyne	OPRL1	37	62
O=C1NCCC12CCN([C@@H]1CCCc3ccccc31)CC2	ZINC000872095888	CF	On-Demand	Anodyne	OPRL1	37	62
C[C@@H](Cc1cccs1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872096211	DG	On-Demand	Anodyne	ETHR	46	43
C[C@@H](Cc1cccs1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872096215	DG	On-Demand	Anodyne	ETHR	46	43
C[C@H](NCc1cc2c(nc1O)CCCC2)c1c(F)cccc1[N+](=O)[O-]	ZINC000872096239	EH	On-Demand	Bother	COLA	46	33
c1ccc(N2CCC(N3CCO[C@H](c4noc(C5CC5)n4)C3)CC2)nc1	ZINC000872096260	FE	On-Demand	Anodyne	EBP	28	44
c1ccc(N2CCC(N3CCO[C@@H](c4noc(C5CC5)n4)C3)CC2)nc1	ZINC000872096262	FE	On-Demand	Anodyne	EBP	28	44
O=C(c1ccoc1)N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096364	FE	On-Demand	Anodyne	L3MBTL3	68	36
O=C(c1ccoc1)N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096364	FE	On-Demand	Anodyne	ETHR	62	36
O=C(c1ccoc1)N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096365	FE	On-Demand	Anodyne	L3MBTL3	68	36
O=C(c1ccoc1)N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096365	FE	On-Demand	Anodyne	ETHR	62	36
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	HTR1A	39	41
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	DRD2	21	41
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	ADRA1D	44	41
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	ADRA1A	36	41
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	ADRA1B	38	41
COc1ccccc1N1CCC(N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)CC1	ZINC000872096382	GF	On-Demand	Anodyne	HTR7	23	40
COC[C@@H](c1cccc(C(F)(F)F)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872096418	GH	On-Demand	Anodyne	ETHR	40	30
COC[C@@H](c1cccc(C(F)(F)F)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872096422	GH	On-Demand	Anodyne	ETHR	40	30
FC(F)(F)CCN1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096578	FF	On-Demand	Anodyne	ETHR	53	42
FC(F)(F)CCN1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096579	FF	On-Demand	Anodyne	ETHR	53	42
CC(C)(C)CC(=O)N1CCC(N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096598	GF	On-Demand	Anodyne	ETHR	69	45
CC(C)(C)CC(=O)N1CCC(N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000872096599	GF	On-Demand	Anodyne	ETHR	69	45
CC(C)(C)OC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872097660	ED	On-Demand	Anodyne	GPR119	50	47
CC(C)(C)OC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872097661	ED	On-Demand	Anodyne	GPR119	50	47
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccoc3)CC2)CC1	ZINC000872097710	ED	On-Demand	Anodyne	CHRM2	54	35
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccoc3)CC2)CC1	ZINC000872097710	ED	On-Demand	Anodyne	L3MBTL3	103	47
COC[C@@H](c1cccc(C(F)(F)F)c1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097720	FF	On-Demand	Anodyne	CACNA1B	45	34
COC[C@@H](c1cccc(C(F)(F)F)c1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097722	FF	On-Demand	Anodyne	CACNA1B	45	34
C[C@@H](CCc1ccc(F)cc1F)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097864	EE	On-Demand	Anodyne	HTR2A	17	51
C[C@H](CCc1ccc(F)cc1F)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097865	EE	On-Demand	Anodyne	HTR2A	17	51
C[C@H](CCc1ccc(F)cc1F)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097866	EE	On-Demand	Anodyne	HTR2A	17	51
C[C@@H](CCc1ccc(F)cc1F)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097867	EE	On-Demand	Anodyne	HTR2A	17	51
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097904	FE	On-Demand	Anodyne	DRD2	17	41
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097904	FE	On-Demand	Anodyne	DRD4	40	38
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097904	FE	On-Demand	Anodyne	ACHE	25	42
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097904	FE	On-Demand	Anodyne	SIGMAR1	45	42
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097904	FE	On-Demand	Anodyne	CCR5	40	38
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097905	FE	On-Demand	Anodyne	DRD2	17	41
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097905	FE	On-Demand	Anodyne	DRD4	40	38
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097905	FE	On-Demand	Anodyne	ACHE	25	42
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097905	FE	On-Demand	Anodyne	SIGMAR1	45	42
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097905	FE	On-Demand	Anodyne	CCR5	40	38
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097906	FE	On-Demand	Anodyne	DRD2	17	41
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097906	FE	On-Demand	Anodyne	DRD4	40	38
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097906	FE	On-Demand	Anodyne	ACHE	25	42
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097906	FE	On-Demand	Anodyne	SIGMAR1	45	42
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872097906	FE	On-Demand	Anodyne	CCR5	40	38
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097907	FE	On-Demand	Anodyne	DRD2	17	41
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097907	FE	On-Demand	Anodyne	DRD4	40	38
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097907	FE	On-Demand	Anodyne	ACHE	25	42
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097907	FE	On-Demand	Anodyne	SIGMAR1	45	42
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872097907	FE	On-Demand	Anodyne	CCR5	40	38
C[S@](=N)(=O)N1CCN(C2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000872098048	FE	On-Demand	Anodyne	ADRA1D	34	42
C[S@](=N)(=O)N1CCN(C2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000872098048	FE	On-Demand	Anodyne	ADRA1A	23	42
C[S@](=N)(=O)N1CCN(C2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000872098048	FE	On-Demand	Anodyne	ADRA1B	26	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N1CCN([S@](C)(=N)=O)CC1	ZINC000872098102	ED	On-Demand	Anodyne	SIGMAR1	38	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N1CCN([S@@](C)(=N)=O)CC1	ZINC000872098109	ED	On-Demand	Anodyne	SIGMAR1	38	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N1CCN([S@@](C)(=N)=O)CC1	ZINC000872098112	ED	On-Demand	Anodyne	SIGMAR1	38	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N1CCN([S@](C)(=N)=O)CC1	ZINC000872098114	ED	On-Demand	Anodyne	SIGMAR1	38	43
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3Cl)CC2)CC1	ZINC000872098149	FF	On-Demand	Anodyne	DRD4	18	47
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3Cl)CC2)CC1	ZINC000872098149	FF	On-Demand	Anodyne	SIGMAR1	22	45
CONC(=O)C1CCN([C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872098165	ED	On-Demand	Anodyne	CHRM2	32	44
CONC(=O)C1CCN([C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872098165	ED	On-Demand	Anodyne	CCR5	18	40
CONC(=O)C1CCN([C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872098167	ED	On-Demand	Anodyne	CHRM2	32	44
CONC(=O)C1CCN([C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872098167	ED	On-Demand	Anodyne	CCR5	18	40
C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872098217	FE	On-Demand	Anodyne	GPR119	60	45
C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872098222	FE	On-Demand	Anodyne	GPR119	60	45
CONC(=O)C1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000872098238	DE	On-Demand	Bother	CACNA1C	62	41
CONC(=O)C1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000872098238	DE	On-Demand	Bother	CACNA1D	92	39
CONC(=O)C1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000872098248	DE	On-Demand	Bother	CACNA1C	62	41
CONC(=O)C1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000872098248	DE	On-Demand	Bother	CACNA1D	92	39
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	CHRM2	55	56
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	CHRM1	16	44
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	GRIN2B	44	51
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	APP	28	41
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	PREP	34	43
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	TGM2	50	48
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	F13A1	63	48
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	CCR8	31	45
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	SLC12A5	66	35
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000872098273	GD	On-Demand	Anodyne	L3MBTL3	76	38
C[S@](=N)(=O)N1CCN(C2CCN(c3ccccn3)CC2)CC1	ZINC000872098315	DD	On-Demand	Anodyne	HTR1A	15	49
C[S@](=N)(=O)N1CCN(C2CCN(c3ccccn3)CC2)CC1	ZINC000872098315	DD	On-Demand	Anodyne	ADRA1A	15	47
C[S@](=N)(=O)N1CCN(C2CCN(c3ccccn3)CC2)CC1	ZINC000872098315	DD	On-Demand	Anodyne	ADRA1B	17	47
C[S@](=N)(=O)N1CCN(C2CCN(c3ccccn3)CC2)CC1	ZINC000872098315	DD	On-Demand	Anodyne	EBP	35	53
CONC(=O)C1CCN([C@H](C)c2ccccc2Cl)CC1	ZINC000872098482	CF	On-Demand	Anodyne	OPRL1	44	48
CONC(=O)C1CCN([C@@H](C)c2ccccc2Cl)CC1	ZINC000872098490	CF	On-Demand	Anodyne	OPRL1	44	48
CONC(=O)C1CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1	ZINC000872098492	DF	On-Demand	Anodyne	OPRL1	22	42
CONC(=O)C1CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1	ZINC000872098494	DF	On-Demand	Anodyne	OPRL1	22	42
CONC(=O)C1CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1	ZINC000872098496	DF	On-Demand	Anodyne	OPRL1	22	42
CONC(=O)C1CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1	ZINC000872098497	DF	On-Demand	Anodyne	OPRL1	22	42
CC(=O)Nc1ccc([C@H](C)N2CCN(c3ccc(C#N)nc3)CC2)cc1	ZINC000872098504	EF	On-Demand	Mild	PRNP	57	38
CC(=O)Nc1ccc([C@@H](C)N2CCN(c3ccc(C#N)nc3)CC2)cc1	ZINC000872098505	EF	On-Demand	Mild	PRNP	57	38
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	CHRM2	37	42
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	DRD2	23	44
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	DRD4	58	44
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	ACHE	44	41
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	SLC6A1	41	32
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	DRD3	22	44
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	SLC6A3	23	42
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	CHRM3	34	42
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	LTA4H	36	46
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	HRH3	19	41
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	SIGMAR1	63	53
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	SLC18A3	42	52
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	S1PR5	15	41
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	MCHR1	20	43
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	CACNA1G	44	46
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	NPFFR1	41	36
CONC(=O)C1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098506	DD	On-Demand	Anodyne	L3MBTL3	35	40
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	CHRM2	37	42
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	DRD2	23	44
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	DRD4	58	44
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	ACHE	44	41
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	SLC6A1	41	32
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	DRD3	22	44
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	SLC6A3	23	42
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	CHRM3	34	42
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	LTA4H	36	46
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	HRH3	19	41
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	SIGMAR1	63	53
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	SLC18A3	42	52
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	S1PR5	15	41
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	MCHR1	20	43
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	CACNA1G	44	46
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	NPFFR1	41	36
CONC(=O)C1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872098507	DD	On-Demand	Anodyne	L3MBTL3	35	40
CONC(=O)C1CCN([C@@H](C)c2ccc(Cl)cc2Cl)CC1	ZINC000872098522	EG	On-Demand	Anodyne	EPHX2	18	42
CONC(=O)C1CCN([C@H](C)c2ccc(Cl)cc2Cl)CC1	ZINC000872098524	EG	On-Demand	Anodyne	EPHX2	18	42
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872098537	GE	On-Demand	Anodyne	CHRM2	73	47
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872098537	GE	On-Demand	Anodyne	CCR3	32	48
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872098537	GE	On-Demand	Anodyne	CCR8	45	32
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872098537	GE	On-Demand	Anodyne	SFRP1	27	44
C[S@](=N)(=O)N1CCN(C2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872098537	GE	On-Demand	Anodyne	L3MBTL3	104	58
C[S@](=N)(=O)N1CCN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872098624	FE	On-Demand	Anodyne	SIGMAR1	41	41
C[S@](=N)(=O)N1CCN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872098624	FE	On-Demand	Anodyne	SLC18A3	26	40
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872098627	FE	On-Demand	Anodyne	SIGMAR1	41	41
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000872098627	FE	On-Demand	Anodyne	SLC18A3	26	40
C[C@@H](Cn1cncn1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872098641	CB	On-Demand	Anodyne	HIS3	40	35
C[C@@H](Cn1cncn1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872098642	CB	On-Demand	Anodyne	HIS3	40	35
C[S@](=N)(=O)N1CCN(C2CCN(c3ccc(C#N)cc3)CC2)CC1	ZINC000872098700	ED	On-Demand	Mild	L3MBTL3	39	44
C[S@](=N)(=O)N1CCN(C2CCN(c3ccccc3)CC2)CC1	ZINC000872098702	DD	On-Demand	Anodyne	L3MBTL3	60	46
C[C@@H](c1ccc(S(=O)(=O)C2CCCC2)cc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872098746	GF	On-Demand	Anodyne	CHRM2	16	48
C[C@@H](c1ccc(S(=O)(=O)C2CCCC2)cc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872098747	GF	On-Demand	Anodyne	CHRM2	16	48
COc1ccc(N2CCC(N3CCN([S@](C)(=N)=O)CC3)CC2)cc1	ZINC000872098861	FD	On-Demand	Clean	CHRM2	52	41
COc1ccc(N2CCC(N3CCN([S@](C)(=N)=O)CC3)CC2)cc1	ZINC000872098861	FD	On-Demand	Clean	L3MBTL3	43	45
COc1ccc(N2CCC(N3CCN([S@@](C)(=N)=O)CC3)CC2)cc1	ZINC000872098862	FD	On-Demand	Clean	CHRM2	52	41
COc1ccc(N2CCC(N3CCN([S@@](C)(=N)=O)CC3)CC2)cc1	ZINC000872098862	FD	On-Demand	Clean	L3MBTL3	43	45
CONC(=O)C1CCN([C@H](C)c2cccc(Cl)c2)CC1	ZINC000872098937	CF	On-Demand	Anodyne	CCR5	16	41
CONC(=O)C1CCN([C@@H](C)c2cccc(Cl)c2)CC1	ZINC000872098939	CF	On-Demand	Anodyne	CCR5	16	41
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	HTR1A	75	50
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	DRD2	51	51
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	ADRA1D	64	48
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	ADRA1A	55	48
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	ADRA1B	51	48
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	DRD3	43	51
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	HTR7	41	41
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	EBP	23	41
COc1ccccc1N1CCC(N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000872098949	GF	On-Demand	Mild	MAPK7	37	40
C[S@](=N)(=O)N1CCN([C@@H]2CCc3c(F)cccc32)CC1	ZINC000872098959	CE	On-Demand	Anodyne	PKM	20	40
C[S@](=N)(=O)N1CCN([C@H]2CCc3c(F)cccc32)CC1	ZINC000872098960	CE	On-Demand	Anodyne	PKM	20	40
CONC(=O)C1CCN([C@H](C)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000872098970	EG	On-Demand	Anodyne	EPHX2	43	41
CONC(=O)C1CCN([C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000872098971	EG	On-Demand	Anodyne	EPHX2	43	41
CONC(=O)C1CCN(C2CCCC2)CC1	ZINC000872098985	BD	On-Demand	Anodyne	L3MBTL3	45	34
COCCOc1ccc([C@@H](C)N2CCN([S@@](C)(=N)=O)CC2)cc1OC	ZINC000872099152	FD	On-Demand	Anodyne	UTS2R	25	41
COCCOc1ccc([C@H](C)N2CCN([S@@](C)(=N)=O)CC2)cc1OC	ZINC000872099154	FD	On-Demand	Anodyne	UTS2R	25	41
COCCOc1ccc([C@@H](C)N2CCN([S@](C)(=N)=O)CC2)cc1OC	ZINC000872099156	FD	On-Demand	Anodyne	UTS2R	25	41
COCCOc1ccc([C@H](C)N2CCN([S@](C)(=N)=O)CC2)cc1OC	ZINC000872099158	FD	On-Demand	Anodyne	UTS2R	25	41
C[C@@H](c1ccc(NC(=O)NC2CC2)cc1)N1CCO[C@H](C(F)F)C1	ZINC000872099181	EF	On-Demand	Anodyne	EPHX2	48	48
C[C@@H](c1ccc(NC(=O)NC2CC2)cc1)N1CCO[C@@H](C(F)F)C1	ZINC000872099183	EF	On-Demand	Anodyne	EPHX2	48	48
CONC(=O)C1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000872099205	DE	On-Demand	Bother	CACNA1D	44	34
CONC(=O)C1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000872099207	DE	On-Demand	Bother	CACNA1D	44	34
C[C@@H](c1ccc(OCCN(C)C)cc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099235	FD	On-Demand	Anodyne	ESRRG	43	32
C[C@@H](c1ccc(OCCN(C)C)cc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872099241	FD	On-Demand	Anodyne	ESRRG	43	32
FC(F)[C@@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099249	EG	On-Demand	Anodyne	DRD4	35	42
FC(F)[C@@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099249	EG	On-Demand	Anodyne	SIGMAR1	20	40
FC(F)[C@@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099249	EG	On-Demand	Anodyne	L3MBTL3	25	41
C[C@H](CCc1ccccc1[N+](=O)[O-])N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099250	EE	On-Demand	Bother	COLA	117	40
FC(F)[C@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099251	EG	On-Demand	Anodyne	DRD4	35	42
FC(F)[C@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099251	EG	On-Demand	Anodyne	SIGMAR1	20	40
FC(F)[C@H]1CN(C2CCN(Cc3ccc(Cl)cc3)CC2)CCO1	ZINC000872099251	EG	On-Demand	Anodyne	L3MBTL3	25	41
C[C@@H](CCc1ccccc1[N+](=O)[O-])N1CCN([S@](C)(=N)=O)CC1	ZINC000872099252	EE	On-Demand	Bother	COLA	117	40
C[C@@H](CCc1ccccc1[N+](=O)[O-])N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099254	EE	On-Demand	Bother	COLA	117	40
C[C@H](CCc1ccccc1[N+](=O)[O-])N1CCN([S@](C)(=N)=O)CC1	ZINC000872099256	EE	On-Demand	Bother	COLA	117	40
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	HTR1A	85	58
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	DRD2	65	64
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	ADRA1D	96	52
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	HTR2A	18	40
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	ADRA1A	79	52
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	ADRA1B	77	52
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	DRD3	55	64
COc1ccccc1N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872099307	FD	On-Demand	Anodyne	HTR7	49	46
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	HTR1A	85	58
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	DRD2	65	64
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	ADRA1D	96	52
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	HTR2A	18	40
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	ADRA1A	79	52
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	ADRA1B	77	52
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	DRD3	55	64
COc1ccccc1N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872099308	FD	On-Demand	Anodyne	HTR7	49	46
C[S@](=N)(=O)N1CCN([C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099460	GE	On-Demand	Anodyne	CHRM2	46	40
C[S@](=N)(=O)N1CCN([C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099460	GE	On-Demand	Anodyne	HRH3	24	41
C[S@](=N)(=O)N1CCN([C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099460	GE	On-Demand	Anodyne	L3MBTL3	76	41
C[S@](=N)(=O)N1CCN([C@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099470	GE	On-Demand	Anodyne	CHRM2	46	40
C[S@](=N)(=O)N1CCN([C@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099470	GE	On-Demand	Anodyne	HRH3	24	41
C[S@](=N)(=O)N1CCN([C@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872099470	GE	On-Demand	Anodyne	L3MBTL3	76	41
C[C@@H](CC(=O)NCCc1ccccc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099488	FD	On-Demand	Anodyne	CA5B	16	41
C[C@H](CC(=O)NCCc1ccccc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872099490	FD	On-Demand	Anodyne	CA5B	16	41
C[C@@H](CC(=O)NCCc1ccccc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872099492	FD	On-Demand	Anodyne	CA5B	16	41
C[C@H](CC(=O)NCCc1ccccc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099494	FD	On-Demand	Anodyne	CA5B	16	41
CC(C)(C)OC(=O)N1CC[C@H](N2CCN([S@@](C)(=N)=O)CC2)C1	ZINC000872099495	ED	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN([S@](C)(=N)=O)CC2)C1	ZINC000872099508	ED	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN([S@@](C)(=N)=O)CC2)C1	ZINC000872099510	ED	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@H](N2CCN([S@](C)(=N)=O)CC2)C1	ZINC000872099511	ED	On-Demand	Anodyne	GPR119	44	43
COc1ccc2c(c1)CC[C@H]2N1CCN([S@@](C)(=N)=O)CC1	ZINC000872099516	DD	On-Demand	Anodyne	CA14	31	44
COc1ccc2c(c1)CC[C@H]2N1CCN([S@](C)(=N)=O)CC1	ZINC000872099518	DD	On-Demand	Anodyne	CA14	31	44
O=C(c1ccoc1)N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872099566	DD	On-Demand	Anodyne	L3MBTL3	95	44
O=C(c1ccoc1)N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872099567	DD	On-Demand	Anodyne	L3MBTL3	95	44
C[C@H]([C@H]1CN(Cc2ccccc2)CCO1)N1CCO[C@@H](C(F)F)C1	ZINC000872099591	EE	On-Demand	Anodyne	DRD4	21	48
C[C@H]([C@@H]1CN(Cc2ccccc2)CCO1)N1CCO[C@@H](C(F)F)C1	ZINC000872099592	EE	On-Demand	Anodyne	DRD4	21	48
C[C@H]([C@H]1CN(Cc2ccccc2)CCO1)N1CCO[C@H](C(F)F)C1	ZINC000872099593	EE	On-Demand	Anodyne	DRD4	21	48
C[C@H]([C@@H]1CN(Cc2ccccc2)CCO1)N1CCO[C@H](C(F)F)C1	ZINC000872099594	EE	On-Demand	Anodyne	DRD4	21	48
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	OPRL1	17	55
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	SLC18A3	47	36
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	MTNR1B	18	46
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	EPHX2	15	48
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	XIAP	20	40
CONC(=O)C1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872099612	CE	On-Demand	Anodyne	BIRC3	27	40
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	OPRL1	17	55
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	SLC18A3	47	36
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	MTNR1B	18	46
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	EPHX2	15	48
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	XIAP	20	40
CONC(=O)C1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872099613	CE	On-Demand	Anodyne	BIRC3	27	40
C[S@](=N)(=O)N1CCN([C@H]2CCCc3cccnc32)CC1	ZINC000872099719	CD	On-Demand	Anodyne	CXCR4	50	34
C[S@](=N)(=O)N1CCN([C@@H]2CCCc3cccnc32)CC1	ZINC000872099723	CD	On-Demand	Anodyne	CXCR4	50	34
COc1ccc(N2CCN(C(=O)CCc3nc4ccccc4oc3=O)CC2)cc1	ZINC000872099725	GE	On-Demand	Clean	SSTR1	59	39
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	HTR1A	81	46
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	DRD2	65	46
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	ADRA1D	78	38
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	HTR2A	18	40
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	ADRA1A	66	40
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	ADRA1B	61	39
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	DRD3	62	44
COCC(C)(C)CCNC1CCN(c2ccccc2OC)CC1	ZINC000872099833	DG	On-Demand	Anodyne	HTR7	46	46
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	CHRM1	18	40
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	SLC6A1	108	36
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	PREP	58	40
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	SLC12A5	63	36
CC(=O)[C@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099854	CG	On-Demand	Anodyne	L3MBTL3	50	37
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	CHRM1	18	40
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	SLC6A1	108	36
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	PREP	58	40
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	SLC12A5	63	36
CC(=O)[C@@H]1CCCN(C2CC(OCc3ccccc3)C2)C1	ZINC000872099855	CG	On-Demand	Anodyne	L3MBTL3	50	37
FC(F)[C@@H]1CN(C2CCN(c3ccccc3)CC2)CCO1	ZINC000872099868	CF	On-Demand	Anodyne	L3MBTL3	42	41
FC(F)[C@H]1CN(C2CCN(c3ccccc3)CC2)CCO1	ZINC000872099869	CF	On-Demand	Anodyne	L3MBTL3	42	41
CONC(=O)C1CCN([C@H]2CCc3ccccc32)CC1	ZINC000872099913	CE	On-Demand	Anodyne	OPRL1	15	47
CONC(=O)C1CCN([C@H]2CCc3ccccc32)CC1	ZINC000872099913	CE	On-Demand	Anodyne	SLC18A3	41	35
CONC(=O)C1CCN([C@H]2CCc3ccccc32)CC1	ZINC000872099913	CE	On-Demand	Anodyne	MTNR1B	20	44
CONC(=O)C1CCN([C@@H]2CCc3ccccc32)CC1	ZINC000872099914	CE	On-Demand	Anodyne	OPRL1	15	47
CONC(=O)C1CCN([C@@H]2CCc3ccccc32)CC1	ZINC000872099914	CE	On-Demand	Anodyne	SLC18A3	41	35
CONC(=O)C1CCN([C@@H]2CCc3ccccc32)CC1	ZINC000872099914	CE	On-Demand	Anodyne	MTNR1B	20	44
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	CHRM2	28	50
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	GRIN2B	33	47
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	PREP	32	42
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	TGM2	49	47
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	F13A1	55	47
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	CCR8	40	43
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	SLC12A5	56	34
C[S@](=N)(=O)N1CCN([C@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099994	FD	On-Demand	Anodyne	L3MBTL3	54	35
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	CHRM2	28	50
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	GRIN2B	33	47
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	PREP	32	42
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	TGM2	49	47
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	F13A1	55	47
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	CCR8	40	43
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	SLC12A5	56	34
C[S@](=N)(=O)N1CCN([C@@H]2CCN(C(=O)OCc3ccccc3)C2)CC1	ZINC000872099996	FD	On-Demand	Anodyne	L3MBTL3	54	35
CONC(=O)C1CCN([C@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000872100032	FF	On-Demand	Anodyne	PDE6D	60	37
CONC(=O)C1CCN([C@@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000872100036	FF	On-Demand	Anodyne	PDE6D	60	37
C[S@](=N)(=O)N1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1	ZINC000872100039	FD	On-Demand	Bother	L3MBTL3	39	43
FC(F)[C@H]1CN(C2CCN(c3ccccn3)CC2)CCO1	ZINC000872100067	CE	On-Demand	Anodyne	DRD4	15	40
FC(F)[C@H]1CN(C2CCN(c3ccccn3)CC2)CCO1	ZINC000872100067	CE	On-Demand	Anodyne	EBP	29	46
FC(F)[C@@H]1CN(C2CCN(c3ccccn3)CC2)CCO1	ZINC000872100070	CE	On-Demand	Anodyne	DRD4	15	40
FC(F)[C@@H]1CN(C2CCN(c3ccccn3)CC2)CCO1	ZINC000872100070	CE	On-Demand	Anodyne	EBP	29	46
FC(F)[C@@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100082	DF	On-Demand	Anodyne	DRD4	15	41
FC(F)[C@@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100082	DF	On-Demand	Anodyne	SIGMAR1	45	43
FC(F)[C@@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100082	DF	On-Demand	Anodyne	L3MBTL3	40	43
FC(F)[C@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100083	DF	On-Demand	Anodyne	DRD4	15	41
FC(F)[C@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100083	DF	On-Demand	Anodyne	SIGMAR1	45	43
FC(F)[C@H]1CN(C2CCN(CCc3ccccc3)CC2)CCO1	ZINC000872100083	DF	On-Demand	Anodyne	L3MBTL3	40	43
C=CC(C)(C)CCCNC1CCN(c2ccccn2)CC1	ZINC000872100098	CH	On-Demand	Mild	CACNA1S	45	35
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCCC3)nc2)cc1	ZINC000872100124	GF	On-Demand	Anodyne	DGAT1	31	40
C=CC(C)(C)CCCN[C@H](C)Cn1cncn1	ZINC000872100153	BE	On-Demand	Mild	HIS3	46	36
C=CC(C)(C)CCCN[C@@H](C)Cn1cncn1	ZINC000872100158	BE	On-Demand	Mild	HIS3	46	36
CC(=O)[C@@H]1CCCN([C@@H](C)c2cc(F)ccc2F)C1	ZINC000872100179	CG	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@H]1CCCN([C@@H](C)c2cc(F)ccc2F)C1	ZINC000872100180	CG	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@H]1CCCN([C@H](C)c2cc(F)ccc2F)C1	ZINC000872100181	CG	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@@H]1CCCN([C@H](C)c2cc(F)ccc2F)C1	ZINC000872100182	CG	On-Demand	Anodyne	SLC6A1	40	37
C[S@](=N)(=O)N1CCN(C2CCc3ccccc3CC2)CC1	ZINC000872100206	DE	On-Demand	Anodyne	OPRL1	22	42
C[S@](=N)(=O)N1CCN(C2[C@H]3C[C@H]2CN(Cc2ccccc2)C3)CC1	ZINC000872100214	ED	On-Demand	Anodyne	SIGMAR1	47	48
CONC(=O)C1CCN([C@@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000872100215	EG	On-Demand	Anodyne	SLC6A3	22	51
CONC(=O)C1CCN([C@@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000872100215	EG	On-Demand	Anodyne	TACR2	40	37
CONC(=O)C1CCN([C@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000872100216	EG	On-Demand	Anodyne	SLC6A3	22	51
CONC(=O)C1CCN([C@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000872100216	EG	On-Demand	Anodyne	TACR2	40	37
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100225	EF	On-Demand	Anodyne	HTR1D	43	41
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100225	EF	On-Demand	Anodyne	HTR1B	34	41
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100225	EF	On-Demand	Anodyne	MPO	16	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100226	EF	On-Demand	Anodyne	HTR1D	43	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100226	EF	On-Demand	Anodyne	HTR1B	34	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100226	EF	On-Demand	Anodyne	MPO	16	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100227	EF	On-Demand	Anodyne	HTR1D	43	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100227	EF	On-Demand	Anodyne	HTR1B	34	41
C[C@@H](CCc1c[nH]c2ccccc12)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100227	EF	On-Demand	Anodyne	MPO	16	41
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100228	EF	On-Demand	Anodyne	HTR1D	43	41
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100228	EF	On-Demand	Anodyne	HTR1B	34	41
C[C@H](CCc1c[nH]c2ccccc12)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100228	EF	On-Demand	Anodyne	MPO	16	41
CONC(=O)C1CCN([C@@H](C)c2ccc3ccccc3c2)CC1	ZINC000872100253	DG	On-Demand	Anodyne	SLC6A3	15	47
CONC(=O)C1CCN([C@H](C)c2ccc3ccccc3c2)CC1	ZINC000872100254	DG	On-Demand	Anodyne	SLC6A3	15	47
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	CHRM2	16	40
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	CHRM1	19	40
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	SLC6A3	22	49
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	CHRM4	23	40
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	CHRM5	20	40
CONC(=O)C1CCN([C@H](C)c2ccccc2)CC1	ZINC000872100307	CE	On-Demand	Anodyne	CCR5	26	42
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	CHRM2	16	40
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	CHRM1	19	40
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	SLC6A3	22	49
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	CHRM4	23	40
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	CHRM5	20	40
CONC(=O)C1CCN([C@@H](C)c2ccccc2)CC1	ZINC000872100308	CE	On-Demand	Anodyne	CCR5	26	42
C[C@H](CCc1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872100325	DE	On-Demand	Anodyne	SIGMAR1	18	41
C[C@H](CCc1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872100327	DE	On-Demand	Anodyne	SIGMAR1	18	41
C[C@H](CCc1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872100330	DE	On-Demand	Anodyne	SIGMAR1	18	41
C[C@H](c1ccc(-n2cccn2)cc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100331	EE	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@@H](c1ccc(-n2cccn2)cc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100332	EE	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@@H](c1ccc(-n2cccn2)cc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100333	EE	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@H](c1ccc(-n2cccn2)cc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100334	EE	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	ADRA1D	22	41
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	ADRA1A	16	41
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	ADRA1B	18	41
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	LTA4H	15	44
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	SIGMAR1	27	43
C[S@](=N)(=O)N1CCN(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100347	FE	On-Demand	Anodyne	ACHP_LYMST	15	40
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	ADRA1D	22	41
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	ADRA1A	16	41
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	ADRA1B	18	41
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	LTA4H	15	44
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	SIGMAR1	27	43
C[S@](=N)(=O)N1CCN([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100348	FE	On-Demand	Anodyne	ACHP_LYMST	15	40
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	ADRA1D	22	41
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	ADRA1A	16	41
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	ADRA1B	18	41
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	LTA4H	15	44
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	SIGMAR1	27	43
C[S@](=N)(=O)N1CCN([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872100350	FE	On-Demand	Anodyne	ACHP_LYMST	15	40
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccncc3)CC2)CC1	ZINC000872100396	ED	On-Demand	Anodyne	SIGMAR1	19	41
CC(=O)[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1	ZINC000872100455	BG	On-Demand	Anodyne	SLC6A3	19	47
CC(=O)[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1	ZINC000872100456	BG	On-Demand	Anodyne	SLC6A3	19	47
CC(=O)[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1	ZINC000872100457	BG	On-Demand	Anodyne	SLC6A3	19	47
CC(=O)[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1	ZINC000872100458	BG	On-Demand	Anodyne	SLC6A3	19	47
CC(=O)[C@@H]1CCCN([C@@H]2CCc3ccccc32)C1	ZINC000872100468	BF	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)[C@@H]1CCCN([C@@H]2CCc3ccccc32)C1	ZINC000872100468	BF	On-Demand	Anodyne	L3MBTL3	42	35
CC(=O)[C@H]1CCCN([C@@H]2CCc3ccccc32)C1	ZINC000872100469	BF	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)[C@H]1CCCN([C@@H]2CCc3ccccc32)C1	ZINC000872100469	BF	On-Demand	Anodyne	L3MBTL3	42	35
CC(=O)[C@H]1CCCN([C@H]2CCc3ccccc32)C1	ZINC000872100470	BF	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)[C@H]1CCCN([C@H]2CCc3ccccc32)C1	ZINC000872100470	BF	On-Demand	Anodyne	L3MBTL3	42	35
CC(=O)[C@@H]1CCCN([C@H]2CCc3ccccc32)C1	ZINC000872100471	BF	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)[C@@H]1CCCN([C@H]2CCc3ccccc32)C1	ZINC000872100471	BF	On-Demand	Anodyne	L3MBTL3	42	35
COc1ccc(N2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872100492	EF	On-Demand	Clean	L3MBTL3	33	40
COc1ccc(N2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872100493	EF	On-Demand	Clean	L3MBTL3	33	40
C[C@H](CCc1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872100497	DE	On-Demand	Anodyne	SIGMAR1	18	41
CONC(=O)C1CCN([C@H](C)CCc2cccc(F)c2)CC1	ZINC000872100550	DF	On-Demand	Anodyne	CCR5	74	36
CONC(=O)C1CCN([C@H](C)CCc2cccc(F)c2)CC1	ZINC000872100550	DF	On-Demand	Anodyne	CACNA1G	39	44
CONC(=O)C1CCN([C@H](C)CCc2cccc(F)c2)CC1	ZINC000872100550	DF	On-Demand	Anodyne	BIRC2	17	41
CONC(=O)C1CCN([C@@H](C)CCc2cccc(F)c2)CC1	ZINC000872100551	DF	On-Demand	Anodyne	CCR5	74	36
CONC(=O)C1CCN([C@@H](C)CCc2cccc(F)c2)CC1	ZINC000872100551	DF	On-Demand	Anodyne	CACNA1G	39	44
CONC(=O)C1CCN([C@@H](C)CCc2cccc(F)c2)CC1	ZINC000872100551	DF	On-Demand	Anodyne	BIRC2	17	41
CONC(=O)C1CCN([C@H](C)c2cccc(C)c2)CC1	ZINC000872100592	CE	On-Demand	Anodyne	EPHX2	22	40
CONC(=O)C1CCN([C@@H](C)c2cccc(C)c2)CC1	ZINC000872100599	CE	On-Demand	Anodyne	EPHX2	22	40
FC(F)[C@@H]1CN([C@H]2CC[C@@H](c3ccccc3)C2)CCO1	ZINC000872100619	CG	On-Demand	Anodyne	SLC18A3	47	39
FC(F)[C@@H]1CN([C@@H]2CC[C@@H](c3ccccc3)C2)CCO1	ZINC000872100620	CG	On-Demand	Anodyne	SLC18A3	47	39
FC(F)[C@@H]1CN([C@H]2CC[C@H](c3ccccc3)C2)CCO1	ZINC000872100623	CG	On-Demand	Anodyne	SLC18A3	47	39
FC(F)[C@@H]1CN([C@@H]2CC[C@H](c3ccccc3)C2)CCO1	ZINC000872100627	CG	On-Demand	Anodyne	SLC18A3	47	39
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	ACE	77	43
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	FKBP1A	66	40
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	DRD4	17	40
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	SLC6A3	22	44
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	SLC18A2	36	41
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	GRIN2B	22	41
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	MME	35	40
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	SIGMAR1	27	44
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	CCR5	47	45
CONC(=O)C1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000872100661	CE	On-Demand	Anodyne	CAPN1	42	39
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	ACE	77	43
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	FKBP1A	66	40
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	DRD4	17	40
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	SLC6A3	22	44
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	SLC18A2	36	41
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	GRIN2B	22	41
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	MME	35	40
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	SIGMAR1	27	44
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	CCR5	47	45
CONC(=O)C1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000872100662	CE	On-Demand	Anodyne	CAPN1	42	39
CONC(=O)C1CCN([C@H](C)c2cccnc2)CC1	ZINC000872100670	CD	On-Demand	Anodyne	KCNA5	22	40
CONC(=O)C1CCN([C@@H](C)c2cccnc2)CC1	ZINC000872100671	CD	On-Demand	Anodyne	KCNA5	22	40
C[C@H](c1cccc(F)c1F)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100696	DE	On-Demand	Anodyne	PKM	20	40
C[C@@H](c1cccc(F)c1F)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100697	DE	On-Demand	Anodyne	PKM	20	40
C[C@H](c1cccc(F)c1F)N1CCN([S@](C)(=N)=O)CC1	ZINC000872100698	DE	On-Demand	Anodyne	PKM	20	40
C[C@@H](c1cccc(F)c1F)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872100699	DE	On-Demand	Anodyne	PKM	20	40
CC(C)(C)CC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872100757	ED	On-Demand	Anodyne	L3MBTL3	41	33
CC(C)(C)CC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872100758	ED	On-Demand	Anodyne	L3MBTL3	41	33
C[S@](=N)(=O)N1CCN([C@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000872100795	DF	On-Demand	Anodyne	SLC18A3	39	41
C[S@](=N)(=O)N1CCN([C@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000872100795	DF	On-Demand	Anodyne	EBP	22	42
COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	ZINC000872100915	HG	On-Demand	Clean	HTR1A	18	44
COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	ZINC000872100915	HG	On-Demand	Clean	HTR1B	16	40
COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	ZINC000872100915	HG	On-Demand	Clean	HTR7	15	40
COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	ZINC000872100915	HG	On-Demand	Clean	PDE4D	15	43
COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	ZINC000872100915	HG	On-Demand	Clean	SSTR1	48	35
CONC(=O)C1CCN([C@H](C)c2ccc(Cl)cc2)CC1	ZINC000872101009	CF	On-Demand	Anodyne	SLC6A3	27	44
CONC(=O)C1CCN([C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000872101010	CF	On-Demand	Anodyne	SLC6A3	27	44
O=C(Oc1ccccc1)N1CCC[C@@H](N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872101050	FG	On-Demand	Anodyne	CHRM2	17	40
O=C(Oc1ccccc1)N1CCC[C@@H](N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872101050	FG	On-Demand	Anodyne	L3MBTL3	69	39
O=C(Oc1ccccc1)N1CCC[C@H](N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872101052	FG	On-Demand	Anodyne	CHRM2	17	40
O=C(Oc1ccccc1)N1CCC[C@H](N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872101052	FG	On-Demand	Anodyne	L3MBTL3	69	39
O=C(Oc1ccccc1)N1CCC[C@H](N2CCO[C@H](C(F)F)C2)CC1	ZINC000872101053	FG	On-Demand	Anodyne	CHRM2	17	40
O=C(Oc1ccccc1)N1CCC[C@H](N2CCO[C@H](C(F)F)C2)CC1	ZINC000872101053	FG	On-Demand	Anodyne	L3MBTL3	69	39
O=C(Oc1ccccc1)N1CCC[C@@H](N2CCO[C@H](C(F)F)C2)CC1	ZINC000872101054	FG	On-Demand	Anodyne	CHRM2	17	40
O=C(Oc1ccccc1)N1CCC[C@@H](N2CCO[C@H](C(F)F)C2)CC1	ZINC000872101054	FG	On-Demand	Anodyne	L3MBTL3	69	39
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000872101096	DF	On-Demand	Anodyne	SLC18A3	39	41
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000872101096	DF	On-Demand	Anodyne	EBP	22	42
C[S@](=N)(=O)N1CCN([C@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000872101097	DF	On-Demand	Anodyne	SLC18A3	39	41
C[S@](=N)(=O)N1CCN([C@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000872101097	DF	On-Demand	Anodyne	EBP	22	42
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000872101098	DF	On-Demand	Anodyne	SLC18A3	39	41
C[S@](=N)(=O)N1CCN([C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000872101098	DF	On-Demand	Anodyne	EBP	22	42
C[C@@H](c1ccc(NC(=O)NC2CC2)cc1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872101147	FE	On-Demand	Anodyne	EPHX2	51	44
C[C@@H](c1ccc(NC(=O)NC2CC2)cc1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872101150	FE	On-Demand	Anodyne	EPHX2	51	44
CONC(=O)C1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC000872101260	CE	On-Demand	Anodyne	SLC6A3	34	43
CONC(=O)C1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC000872101265	CE	On-Demand	Anodyne	SLC6A3	34	43
C[C@@H](c1cccc(C(F)(F)F)c1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872101266	EF	On-Demand	Anodyne	CACNA1B	46	33
CONC(=O)C1CCN([C@H](C)Cc2ccsc2)CC1	ZINC000872101267	CE	On-Demand	Anodyne	CCR5	21	44
CONC(=O)C1CCN([C@@H](C)Cc2ccsc2)CC1	ZINC000872101269	CE	On-Demand	Anodyne	CCR5	21	44
CONC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872101271	DE	On-Demand	Anodyne	CHRM2	23	41
CONC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872101271	DE	On-Demand	Anodyne	SIGMAR1	17	40
CONC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872101271	DE	On-Demand	Anodyne	CAPN1	47	37
CONC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872101271	DE	On-Demand	Anodyne	CAPN2	42	31
C[C@H](c1cccc(C(F)(F)F)c1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872101282	EF	On-Demand	Anodyne	CACNA1B	46	33
CC(=O)[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2F)C1	ZINC000872101283	CG	On-Demand	Anodyne	SLC6A1	42	37
C[C@@H](c1cccc(C(F)(F)F)c1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872101284	EF	On-Demand	Anodyne	CACNA1B	46	33
C[C@H](c1cccc(C(F)(F)F)c1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872101285	EF	On-Demand	Anodyne	CACNA1B	46	33
CC(=O)[C@H]1CCCN([C@@H](C)c2ccc(F)cc2F)C1	ZINC000872101286	CG	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@H]1CCCN([C@H](C)c2ccc(F)cc2F)C1	ZINC000872101290	CG	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@@H]1CCCN([C@H](C)c2ccc(F)cc2F)C1	ZINC000872101294	CG	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@H]1CCCN([C@@H]2CCCc3ccccc32)C1	ZINC000872101334	CG	On-Demand	Anodyne	SLC6A1	41	34
O=S1(=O)C[C@@H]2CN([C@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101337	ED	On-Demand	Anodyne	DRD2	15	42
O=S1(=O)C[C@@H]2CN([C@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101337	ED	On-Demand	Anodyne	DRD4	35	43
O=S1(=O)C[C@@H]2CN([C@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101337	ED	On-Demand	Anodyne	ACHE	39	43
O=S1(=O)C[C@@H]2CN([C@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101337	ED	On-Demand	Anodyne	SIGMAR1	59	42
O=S1(=O)C[C@@H]2CN([C@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101337	ED	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)[C@@H]1CCCN([C@@H]2CCCc3ccccc32)C1	ZINC000872101338	CG	On-Demand	Anodyne	SLC6A1	41	34
O=S1(=O)C[C@@H]2CCN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101339	ED	On-Demand	Anodyne	DRD2	15	42
O=S1(=O)C[C@@H]2CCN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101339	ED	On-Demand	Anodyne	DRD4	35	43
O=S1(=O)C[C@@H]2CCN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101339	ED	On-Demand	Anodyne	ACHE	39	43
O=S1(=O)C[C@@H]2CCN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101339	ED	On-Demand	Anodyne	SIGMAR1	59	42
O=S1(=O)C[C@@H]2CCN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101339	ED	On-Demand	Anodyne	SLC18A3	28	42
O=S1(=O)C[C@@H]2CN([C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101340	ED	On-Demand	Anodyne	DRD2	15	42
O=S1(=O)C[C@@H]2CN([C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101340	ED	On-Demand	Anodyne	DRD4	35	43
O=S1(=O)C[C@@H]2CN([C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101340	ED	On-Demand	Anodyne	ACHE	39	43
O=S1(=O)C[C@@H]2CN([C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101340	ED	On-Demand	Anodyne	SIGMAR1	59	42
O=S1(=O)C[C@@H]2CN([C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2C1	ZINC000872101340	ED	On-Demand	Anodyne	SLC18A3	28	42
O=S1(=O)C[C@@H]2CCN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101341	ED	On-Demand	Anodyne	DRD2	15	42
O=S1(=O)C[C@@H]2CCN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101341	ED	On-Demand	Anodyne	DRD4	35	43
O=S1(=O)C[C@@H]2CCN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101341	ED	On-Demand	Anodyne	ACHE	39	43
O=S1(=O)C[C@@H]2CCN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101341	ED	On-Demand	Anodyne	SIGMAR1	59	42
O=S1(=O)C[C@@H]2CCN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C1	ZINC000872101341	ED	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)[C@H]1CCCN([C@H]2CCCc3ccccc32)C1	ZINC000872101342	CG	On-Demand	Anodyne	SLC6A1	41	34
CC(=O)[C@@H]1CCCN([C@H]2CCCc3ccccc32)C1	ZINC000872101345	CG	On-Demand	Anodyne	SLC6A1	41	34
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	CHRM2	16	45
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	DRD2	17	44
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	DRD4	43	42
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	ACHE	33	44
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	SIGMAR1	58	44
C[S@](=N)(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101541	DD	On-Demand	Anodyne	SLC18A3	27	43
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	CHRM2	16	45
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	DRD2	17	44
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	DRD4	43	42
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	ACHE	33	44
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	SIGMAR1	58	44
C[S@](=N)(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872101543	DD	On-Demand	Anodyne	SLC18A3	27	43
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	DRD2	20	46
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	DRD4	21	46
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	OPRM1	21	44
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	SIGMAR1	65	52
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	CCR5	26	41
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccccc3)CC2)CC1	ZINC000872101583	FD	On-Demand	Anodyne	L3MBTL3	53	43
CC(C)(C)OC(=O)N1CCC[C@H](N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101588	FD	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC[C@H](N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101588	FD	On-Demand	Anodyne	L3MBTL3	40	37
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101589	FD	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101589	FD	On-Demand	Anodyne	L3MBTL3	40	37
CC(C)(C)OC(=O)N1CCC[C@H](N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101590	FD	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC[C@H](N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101590	FD	On-Demand	Anodyne	L3MBTL3	40	37
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101591	FD	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC[C@@H](N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101591	FD	On-Demand	Anodyne	L3MBTL3	40	37
FC(F)[C@@H]1CN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872101611	EF	On-Demand	Anodyne	DRD4	15	41
FC(F)[C@H]1CN([C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872101612	EF	On-Demand	Anodyne	DRD4	15	41
FC(F)[C@@H]1CN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872101613	EF	On-Demand	Anodyne	DRD4	15	41
FC(F)[C@H]1CN([C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CCO1	ZINC000872101614	EF	On-Demand	Anodyne	DRD4	15	41
C[C@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872101747	FD	On-Demand	Anodyne	GPR119	36	44
C[C@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872101749	FD	On-Demand	Anodyne	GPR119	36	44
C[C@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872101750	FD	On-Demand	Anodyne	GPR119	36	44
C[C@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872101752	FD	On-Demand	Anodyne	GPR119	36	44
COC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101763	DC	On-Demand	Anodyne	CHRM2	19	44
COC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872101763	DC	On-Demand	Anodyne	L3MBTL3	54	34
COC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101767	DC	On-Demand	Anodyne	CHRM2	19	44
COC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872101767	DC	On-Demand	Anodyne	L3MBTL3	54	34
COc1ccc2c(c1)C[C@@H](N1CCN([S@](C)(=N)=O)CC1)CC2	ZINC000872101788	DD	On-Demand	Anodyne	ADRA1D	22	42
COc1ccc2c(c1)C[C@@H](N1CCN([S@](C)(=N)=O)CC1)CC2	ZINC000872101788	DD	On-Demand	Anodyne	ADRA1A	16	42
COc1ccc2c(c1)C[C@@H](N1CCN([S@](C)(=N)=O)CC1)CC2	ZINC000872101788	DD	On-Demand	Anodyne	ADRA1B	18	42
COc1ccc2c(c1)C[C@@H](N1CCN([S@@](C)(=N)=O)CC1)CC2	ZINC000872101790	DD	On-Demand	Anodyne	ADRA1D	22	42
COc1ccc2c(c1)C[C@@H](N1CCN([S@@](C)(=N)=O)CC1)CC2	ZINC000872101790	DD	On-Demand	Anodyne	ADRA1A	16	42
COc1ccc2c(c1)C[C@@H](N1CCN([S@@](C)(=N)=O)CC1)CC2	ZINC000872101790	DD	On-Demand	Anodyne	ADRA1B	18	42
CC(=O)[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(F)cc3)n2)C1	ZINC000872101808	GH	On-Demand	Anodyne	SLC6A1	84	35
CC(=O)[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(F)cc3)n2)C1	ZINC000872101808	GH	On-Demand	Anodyne	CCR3	48	34
CC(=O)[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(F)cc3)n2)C1	ZINC000872101809	GH	On-Demand	Anodyne	SLC6A1	84	35
CC(=O)[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(F)cc3)n2)C1	ZINC000872101809	GH	On-Demand	Anodyne	CCR3	48	34
Fc1ccc(CCN2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872101858	EF	On-Demand	Anodyne	SLC6A3	15	41
Fc1ccc(CCN2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872101858	EF	On-Demand	Anodyne	SIGMAR1	20	44
Fc1ccc(CCN2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872101858	EF	On-Demand	Anodyne	L3MBTL3	39	44
Fc1ccc(CCN2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872101859	EF	On-Demand	Anodyne	SLC6A3	15	41
Fc1ccc(CCN2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872101859	EF	On-Demand	Anodyne	SIGMAR1	20	44
Fc1ccc(CCN2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872101859	EF	On-Demand	Anodyne	L3MBTL3	39	44
CN(C)c1ccc(N2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872101872	EF	On-Demand	Anodyne	L3MBTL3	33	40
CN(C)c1ccc(N2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872101875	EF	On-Demand	Anodyne	L3MBTL3	33	40
CC(=O)[C@H]1CCCN([C@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872102077	DE	On-Demand	Anodyne	CHRM2	28	44
CC(=O)[C@@H]1CCCN([C@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872102078	DE	On-Demand	Anodyne	CHRM2	28	44
CC(=O)[C@@H]1CCCN([C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872102080	DE	On-Demand	Anodyne	CHRM2	28	44
CC(=O)[C@H]1CCCN([C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872102083	DE	On-Demand	Anodyne	CHRM2	28	44
C[C@H]([C@H]1CN(Cc2ccccc2)CCO1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872102118	FD	On-Demand	Anodyne	DRD4	17	43
C[C@H]([C@@H]1CN(Cc2ccccc2)CCO1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872102120	FD	On-Demand	Anodyne	DRD4	17	43
C[C@H]([C@@H]1CN(Cc2ccccc2)CCO1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872102121	FD	On-Demand	Anodyne	DRD4	17	43
C[C@H]([C@H]1CN(Cc2ccccc2)CCO1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872102122	FD	On-Demand	Anodyne	DRD4	17	43
FC(F)[C@@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102170	DF	On-Demand	Anodyne	DRD4	41	44
FC(F)[C@@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102170	DF	On-Demand	Anodyne	ACHE	35	45
FC(F)[C@@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102170	DF	On-Demand	Anodyne	SIGMAR1	71	43
FC(F)[C@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102171	DF	On-Demand	Anodyne	DRD4	41	44
FC(F)[C@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102171	DF	On-Demand	Anodyne	ACHE	35	45
FC(F)[C@H]1CN(C2CCN(Cc3ccccc3)CC2)CCO1	ZINC000872102171	DF	On-Demand	Anodyne	SIGMAR1	71	43
CC(=O)[C@@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000872102192	CF	On-Demand	Bother	CACNA1D	46	34
CC(=O)[C@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000872102193	CF	On-Demand	Bother	CACNA1D	46	34
CC(=O)[C@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000872102194	CF	On-Demand	Bother	CACNA1D	46	34
CC(=O)[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000872102195	CF	On-Demand	Bother	CACNA1D	46	34
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	DRD4	43	42
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	SIGMAR1	32	43
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	LSS	15	45
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	CXCR3	39	50
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	MCHR1	16	42
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872102327	FF	On-Demand	Anodyne	L3MBTL3	27	44
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000872102332	FD	On-Demand	Mild	SIGMAR1	20	44
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000872102332	FD	On-Demand	Mild	CXCR3	19	43
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000872102332	FD	On-Demand	Mild	L3MBTL3	17	41
CC(=O)[C@@H]1CCCN([C@@H](C)c2ccccc2C)C1	ZINC000872102420	BG	On-Demand	Anodyne	SLC6A1	70	43
CC(=O)[C@H]1CCCN([C@H](C)c2ccccc2C)C1	ZINC000872102421	BG	On-Demand	Anodyne	SLC6A1	70	43
CC(=O)[C@@H]1CCCN([C@H](C)c2ccccc2C)C1	ZINC000872102422	BG	On-Demand	Anodyne	SLC6A1	70	43
CC(=O)[C@H]1CCCN([C@@H](C)c2ccccc2C)C1	ZINC000872102423	BG	On-Demand	Anodyne	SLC6A1	70	43
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	CHRM1	15	40
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	DRD2	25	44
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	DRD4	58	43
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	ACHE	42	47
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	SLC6A1	134	40
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	OPRM1	16	43
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	DRD3	18	42
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	OPRK1	20	43
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	OPRL1	15	43
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	CHRM3	22	45
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	HRH3	34	42
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	SIGMAR1	74	45
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	CCR3	29	45
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	CCR5	46	38
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	SLC18A3	37	46
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102489	CF	On-Demand	Anodyne	L3MBTL3	101	46
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	CHRM1	15	40
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	DRD2	25	44
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	DRD4	58	43
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	ACHE	42	47
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	SLC6A1	134	40
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	OPRM1	16	43
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	DRD3	18	42
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	OPRK1	20	43
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	OPRL1	15	43
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	CHRM3	22	45
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	HRH3	34	42
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	SIGMAR1	74	45
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	CCR3	29	45
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	CCR5	46	38
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	SLC18A3	37	46
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102490	CF	On-Demand	Anodyne	L3MBTL3	101	46
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	CHRM1	15	40
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	DRD2	25	44
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	DRD4	58	43
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	ACHE	42	47
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	SLC6A1	134	40
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	OPRM1	16	43
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	DRD3	18	42
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	OPRK1	20	43
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	OPRL1	15	43
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	CHRM3	22	45
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	HRH3	34	42
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	SIGMAR1	74	45
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	CCR3	29	45
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	CCR5	46	38
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	SLC18A3	37	46
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@H]1CCCN([C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102491	CF	On-Demand	Anodyne	L3MBTL3	101	46
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	CHRM1	15	40
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	DRD2	25	44
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	DRD4	58	43
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	ACHE	42	47
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	SLC6A1	134	40
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	OPRM1	16	43
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	DRD3	18	42
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	OPRK1	20	43
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	OPRL1	15	43
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	CHRM3	22	45
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	HRH3	34	42
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	SIGMAR1	74	45
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	CCR3	29	45
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	CCR5	46	38
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	SLC18A3	37	46
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@H]1CCCN([C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000872102492	CF	On-Demand	Anodyne	L3MBTL3	101	46
CN(C)c1ccc(N2CCC(N3CCN([S@@](C)(=N)=O)CC3)CC2)cc1	ZINC000872102547	FD	On-Demand	Anodyne	L3MBTL3	43	45
CN(C)c1ccc(N2CCC(N3CCN([S@](C)(=N)=O)CC3)CC2)cc1	ZINC000872102559	FD	On-Demand	Anodyne	L3MBTL3	43	45
CC(=O)[C@H]1CCCN([C@@H](C)c2ccccc2F)C1	ZINC000872102628	BG	On-Demand	Anodyne	SLC6A1	65	37
CC(=O)[C@@H]1CCCN([C@H](C)c2ccccc2F)C1	ZINC000872102629	BG	On-Demand	Anodyne	SLC6A1	65	37
CC(=O)[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1	ZINC000872102630	BG	On-Demand	Anodyne	SLC6A1	65	37
CC(=O)[C@H]1CCCN([C@H](C)c2ccccc2F)C1	ZINC000872102631	BG	On-Demand	Anodyne	SLC6A1	65	37
CCOC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872102660	DC	On-Demand	Anodyne	CHRM2	21	46
CCOC(=O)N1CCC(N2CCN([S@](C)(=N)=O)CC2)CC1	ZINC000872102660	DC	On-Demand	Anodyne	L3MBTL3	45	34
CCOC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872102672	DC	On-Demand	Anodyne	CHRM2	21	46
CCOC(=O)N1CCC(N2CCN([S@@](C)(=N)=O)CC2)CC1	ZINC000872102672	DC	On-Demand	Anodyne	L3MBTL3	45	34
CC(=O)[C@@H]1CCCN([C@H](C)c2cccc(F)c2)C1	ZINC000872102731	BG	On-Demand	Anodyne	SLC6A1	45	44
CC(=O)[C@H]1CCCN([C@@H](C)c2cccc(F)c2)C1	ZINC000872102732	BG	On-Demand	Anodyne	SLC6A1	45	44
CC(=O)[C@H]1CCCN([C@H](C)c2cccc(F)c2)C1	ZINC000872102733	BG	On-Demand	Anodyne	SLC6A1	45	44
CC(=O)[C@@H]1CCCN([C@@H](C)c2cccc(F)c2)C1	ZINC000872102734	BG	On-Demand	Anodyne	SLC6A1	45	44
C[C@H](CCc1ccccc1[N+](=O)[O-])N1CCO[C@@H](C(F)F)C1	ZINC000872102986	DF	On-Demand	Bother	COLA	82	33
C[C@@H](CCc1ccccc1[N+](=O)[O-])N1CCO[C@H](C(F)F)C1	ZINC000872102987	DF	On-Demand	Bother	COLA	82	33
C[C@H](CCc1ccccc1[N+](=O)[O-])N1CCO[C@H](C(F)F)C1	ZINC000872102988	DF	On-Demand	Bother	COLA	82	33
C[C@@H](CCc1ccccc1[N+](=O)[O-])N1CCO[C@@H](C(F)F)C1	ZINC000872102989	DF	On-Demand	Bother	COLA	82	33
CC(=O)[C@@H]1CCCN(C2CCN(C(C)=O)CC2)C1	ZINC000872103002	CD	On-Demand	Anodyne	L3MBTL3	98	45
CC(=O)[C@H]1CCCN(C2CCN(C(C)=O)CC2)C1	ZINC000872103003	CD	On-Demand	Anodyne	L3MBTL3	98	45
C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)N1CCO[C@@H](C(F)F)C1	ZINC000872103066	EF	On-Demand	Anodyne	GPR119	24	40
C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)N1CCO[C@H](C(F)F)C1	ZINC000872103068	EF	On-Demand	Anodyne	GPR119	24	40
C=CC(C)(C)CCCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872103088	DF	On-Demand	Mild	CA2	41	38
C=CC(C)(C)CCCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872103088	DF	On-Demand	Mild	CYNT	40	35
C=CC(C)(C)CCCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872103090	DF	On-Demand	Mild	CA2	41	38
C=CC(C)(C)CCCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872103090	DF	On-Demand	Mild	CYNT	40	35
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	CHRM2	31	40
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	TACR1	15	42
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	SIGMAR1	19	42
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	SLC18A3	30	42
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	GLRA1	42	34
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	ACHP_LYMST	30	40
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	SLC12A5	62	35
CC(=O)C1CCN(C2CC(OCc3ccccc3)C2)CC1	ZINC000872103091	CG	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	HTR1A	61	46
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	DRD2	44	47
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	ADRA1D	65	44
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	ADRA1A	56	44
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	ADRA1B	55	44
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	DRD3	35	47
COc1ccccc1N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103134	EF	On-Demand	Anodyne	HTR7	39	43
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	HTR1A	61	46
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	DRD2	44	47
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	ADRA1D	65	44
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	ADRA1A	56	44
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	ADRA1B	55	44
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	DRD3	35	47
COc1ccccc1N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103135	EF	On-Demand	Anodyne	HTR7	39	43
CC(=O)[C@@H]1CCCN([C@H](C)c2cccnc2)C1	ZINC000872103197	BE	On-Demand	Anodyne	PTAFR	15	40
CC(=O)[C@@H]1CCCN([C@H](C)c2cccnc2)C1	ZINC000872103197	BE	On-Demand	Anodyne	KCNA5	24	43
CC(=O)[C@H]1CCCN([C@@H](C)c2cccnc2)C1	ZINC000872103199	BE	On-Demand	Anodyne	PTAFR	15	40
CC(=O)[C@H]1CCCN([C@@H](C)c2cccnc2)C1	ZINC000872103199	BE	On-Demand	Anodyne	KCNA5	24	43
CC(=O)[C@H]1CCCN([C@H](C)c2cccnc2)C1	ZINC000872103206	BE	On-Demand	Anodyne	PTAFR	15	40
CC(=O)[C@H]1CCCN([C@H](C)c2cccnc2)C1	ZINC000872103206	BE	On-Demand	Anodyne	KCNA5	24	43
CC(=O)[C@@H]1CCCN([C@@H](C)c2cccnc2)C1	ZINC000872103211	BE	On-Demand	Anodyne	PTAFR	15	40
CC(=O)[C@@H]1CCCN([C@@H](C)c2cccnc2)C1	ZINC000872103211	BE	On-Demand	Anodyne	KCNA5	24	43
C[C@@H](c1ccc2c(c1)CCC(=O)N2)N1CCO[C@H](C(F)F)C1	ZINC000872103233	DF	On-Demand	Anodyne	GRIN2B	16	43
C[C@@H](c1ccc2c(c1)CCC(=O)N2)N1CCO[C@@H](C(F)F)C1	ZINC000872103236	DF	On-Demand	Anodyne	GRIN2B	16	43
C[C@H](c1ccc2c(c1)CCC(=O)N2)N1CCO[C@@H](C(F)F)C1	ZINC000872103238	DF	On-Demand	Anodyne	GRIN2B	16	43
C[C@H](c1ccc2c(c1)CCC(=O)N2)N1CCO[C@H](C(F)F)C1	ZINC000872103240	DF	On-Demand	Anodyne	GRIN2B	16	43
C[S@](=N)(=O)N1CCN([C@@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000872103241	EG	On-Demand	Anodyne	DRD1	18	43
C[S@](=N)(=O)N1CCN([C@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000872103243	EG	On-Demand	Anodyne	DRD1	18	43
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103326	FF	On-Demand	Anodyne	CHRM2	46	44
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103326	FF	On-Demand	Anodyne	CCR3	25	43
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@H](C(F)F)C2)CC1	ZINC000872103326	FF	On-Demand	Anodyne	L3MBTL3	94	53
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	GRIN2B	29	43
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	PREP	24	41
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	TGM2	27	40
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	KLK5	40	39
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103330	EE	On-Demand	Anodyne	SLC12A5	42	34
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	GRIN2B	29	43
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	PREP	24	41
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	TGM2	27	40
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	KLK5	40	39
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@H](C(F)F)C2)C1	ZINC000872103331	EE	On-Demand	Anodyne	SLC12A5	42	34
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103332	FF	On-Demand	Anodyne	CHRM2	46	44
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103332	FF	On-Demand	Anodyne	CCR3	25	43
O=C(c1ccccc1Cl)N1CCC(N2CCO[C@@H](C(F)F)C2)CC1	ZINC000872103332	FF	On-Demand	Anodyne	L3MBTL3	94	53
C[C@H](c1ccc(-n2cccn2)cc1)N1CCO[C@H](C(F)F)C1	ZINC000872103345	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](c1ccc(-n2cccn2)cc1)N1CCO[C@@H](C(F)F)C1	ZINC000872103346	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@@H](c1ccc(-n2cccn2)cc1)N1CCO[C@@H](C(F)F)C1	ZINC000872103347	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@@H](c1ccc(-n2cccn2)cc1)N1CCO[C@H](C(F)F)C1	ZINC000872103348	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N1CCO[C@H](C(F)F)C1	ZINC000872103355	DE	On-Demand	Anodyne	DRD4	19	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N1CCO[C@@H](C(F)F)C1	ZINC000872103356	DE	On-Demand	Anodyne	DRD4	19	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N1CCO[C@H](C(F)F)C1	ZINC000872103357	DE	On-Demand	Anodyne	DRD4	19	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N1CCO[C@@H](C(F)F)C1	ZINC000872103358	DE	On-Demand	Anodyne	DRD4	19	42
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	GRIN2B	29	43
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	PREP	24	41
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	TGM2	27	40
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	KLK5	40	39
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CC[C@@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103407	EE	On-Demand	Anodyne	SLC12A5	42	34
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	GRIN2B	29	43
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	PREP	24	41
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	TGM2	27	40
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	KLK5	40	39
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CC[C@H](N2CCO[C@@H](C(F)F)C2)C1	ZINC000872103409	EE	On-Demand	Anodyne	SLC12A5	42	34
FC(F)[C@@H]1CN([C@@H]2CCCc3cccnc32)CCO1	ZINC000872103456	CE	On-Demand	Anodyne	CXCR4	40	35
FC(F)[C@H]1CN([C@H]2CCCc3cccnc32)CCO1	ZINC000872103457	CE	On-Demand	Anodyne	CXCR4	40	35
FC(F)[C@@H]1CN([C@H]2CCCc3cccnc32)CCO1	ZINC000872103458	CE	On-Demand	Anodyne	CXCR4	40	35
FC(F)[C@H]1CN([C@@H]2CCCc3cccnc32)CCO1	ZINC000872103459	CE	On-Demand	Anodyne	CXCR4	40	35
C[S@](=N)(=O)N1CCN([C@@H]2CCCc3ccccc32)CC1	ZINC000872103480	CE	On-Demand	Anodyne	OPRL1	18	51
C[S@](=N)(=O)N1CCN([C@H]2CCCc3ccccc32)CC1	ZINC000872103481	CE	On-Demand	Anodyne	OPRL1	18	51
C[C@H](c1ccc2c(c1)OCCCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103510	EE	On-Demand	Anodyne	PKM	36	42
C[C@@H](c1ccc2c(c1)OCCCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103511	EE	On-Demand	Anodyne	PKM	36	42
C[C@@H](c1ccc2c(c1)OCCCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103512	EE	On-Demand	Anodyne	PKM	36	42
C[C@H](c1ccc2c(c1)OCCCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103513	EE	On-Demand	Anodyne	PKM	36	42
C[C@@H](c1ccc(N2CCOCC2)c(F)c1)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103545	FD	On-Demand	Clean	NPY2R	46	33
C[C@@H](c1ccc(N2CCOCC2)c(F)c1)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103547	FD	On-Demand	Clean	NPY2R	46	33
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)F)C1	ZINC000872103572	DF	On-Demand	Anodyne	DRD4	33	43
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)F)C1	ZINC000872103572	DF	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)F)C1	ZINC000872103573	DF	On-Demand	Anodyne	DRD4	33	43
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)F)C1	ZINC000872103573	DF	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)F)C1	ZINC000872103574	DF	On-Demand	Anodyne	DRD4	33	43
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)F)C1	ZINC000872103574	DF	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)F)C1	ZINC000872103575	DF	On-Demand	Anodyne	DRD4	33	43
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)F)C1	ZINC000872103575	DF	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H](c1ccc2c(c1)OCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103774	DD	On-Demand	Anodyne	CHRM2	27	42
C[C@@H](c1ccc2c(c1)OCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103775	DD	On-Demand	Anodyne	CHRM2	27	42
C[C@@H](c1ccc2c(c1)OCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103776	DD	On-Demand	Anodyne	CHRM2	27	42
C[C@H](c1ccc2c(c1)OCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103777	DD	On-Demand	Anodyne	CHRM2	27	42
CC(C)c1ccccc1NC(=O)C[C@@H](C)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103868	FF	On-Demand	Anodyne	KCNQ2	52	33
CC(C)c1ccccc1NC(=O)C[C@H](C)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103869	FF	On-Demand	Anodyne	KCNQ2	52	33
CC(C)c1ccccc1NC(=O)C[C@H](C)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103870	FF	On-Demand	Anodyne	KCNQ2	52	33
CC(C)c1ccccc1NC(=O)C[C@@H](C)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103871	FF	On-Demand	Anodyne	KCNQ2	52	33
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	CHRM2	24	44
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	DRD2	28	48
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	DRD4	59	46
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	ACHE	46	50
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	DRD3	15	45
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	OPRL1	19	47
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	CHRM3	18	44
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	HRH3	21	42
C[S@](=N)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1	ZINC000872103896	ED	On-Demand	Anodyne	SIGMAR1	80	49
C[C@@H](c1ccc2c(c1)OCCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103984	ED	On-Demand	Anodyne	PKM	39	47
C[C@H](c1ccc2c(c1)OCCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103985	ED	On-Demand	Anodyne	PKM	39	47
C[C@H](c1ccc2c(c1)OCCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872103986	ED	On-Demand	Anodyne	PKM	39	47
C[C@@H](c1ccc2c(c1)OCCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872103987	ED	On-Demand	Anodyne	PKM	39	47
COc1ccccc1NC(=O)C[C@@H](C)N1CCN([S@](C)(=N)=O)CC1	ZINC000872104012	FD	On-Demand	Anodyne	ADRA1D	15	41
COc1ccccc1NC(=O)C[C@H](C)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872104013	FD	On-Demand	Anodyne	ADRA1D	15	41
COc1ccccc1NC(=O)C[C@H](C)N1CCN([S@](C)(=N)=O)CC1	ZINC000872104014	FD	On-Demand	Anodyne	ADRA1D	15	41
COc1ccccc1NC(=O)C[C@@H](C)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872104015	FD	On-Demand	Anodyne	ADRA1D	15	41
N#Cc1ccc(N2CCC(N3CCO[C@H](C(F)F)C3)CC2)cc1	ZINC000872104044	DE	On-Demand	Mild	L3MBTL3	34	40
N#Cc1ccc(N2CCC(N3CCO[C@@H](C(F)F)C3)CC2)cc1	ZINC000872104045	DE	On-Demand	Mild	L3MBTL3	34	40
C[C@H](CCc1ccc2c(c1)OCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872104068	ED	On-Demand	Anodyne	BMP1	51	38
C[C@@H](CCc1ccc2c(c1)OCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872104069	ED	On-Demand	Anodyne	BMP1	51	38
C[C@@H](CCc1ccc2c(c1)OCO2)N1CCN([S@@](C)(=N)=O)CC1	ZINC000872104070	ED	On-Demand	Anodyne	BMP1	51	38
C[C@H](CCc1ccc2c(c1)OCO2)N1CCN([S@](C)(=N)=O)CC1	ZINC000872104071	ED	On-Demand	Anodyne	BMP1	51	38
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccc(F)cc3)CC2)CC1	ZINC000872104154	FE	On-Demand	Anodyne	HTR2A	17	48
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccc(F)cc3)CC2)CC1	ZINC000872104154	FE	On-Demand	Anodyne	SIGMAR1	23	46
C[S@](=N)(=O)N1CCN(C2CCN(CCc3ccc(F)cc3)CC2)CC1	ZINC000872104154	FE	On-Demand	Anodyne	L3MBTL3	44	44
COCC(C)(C)CCN[C@H]1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000872104322	EH	On-Demand	Anodyne	SFRP1	57	32
COCC(C)(C)CCN[C@H]1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000872104322	EH	On-Demand	Anodyne	WNT3	40	31
COCC(C)(C)CCN[C@@H]1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000872104323	EH	On-Demand	Anodyne	SFRP1	57	32
COCC(C)(C)CCN[C@@H]1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000872104323	EH	On-Demand	Anodyne	WNT3	40	31
COCC(C)(C)CCN[C@H](C)Cn1cncn1	ZINC000872104393	BD	On-Demand	Anodyne	HIS3	78	36
COCC(C)(C)CCN[C@@H](C)Cn1cncn1	ZINC000872104394	BD	On-Demand	Anodyne	HIS3	78	36
COCC(C)(C)CCN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872104406	DH	On-Demand	Bother	COLA	82	33
COCC(C)(C)CCN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872104407	DH	On-Demand	Bother	COLA	82	33
COCC(C)(C)CCN[C@H]1CCN(C(=O)C(F)(F)F)Cc2ccccc21	ZINC000872104437	FH	On-Demand	Anodyne	RBP4	40	38
COCC(C)(C)CCN[C@@H]1CCN(C(=O)C(F)(F)F)Cc2ccccc21	ZINC000872104438	FH	On-Demand	Anodyne	RBP4	40	38
COCC(C)(C)CCNC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872104458	EG	On-Demand	Mild	SIGMAR1	21	45
COCC(C)(C)CCN[C@H]1CCc2c(cccc2OC)C1	ZINC000872104460	CG	On-Demand	Anodyne	HTR1A	16	57
COCC(C)(C)CCN[C@@H]1CCc2c(cccc2OC)C1	ZINC000872104461	CG	On-Demand	Anodyne	HTR1A	16	57
COCC(C)(C)CCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104489	DE	On-Demand	Anodyne	CA2	49	39
COCC(C)(C)CCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104489	DE	On-Demand	Anodyne	CA1	42	39
COCC(C)(C)CCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104489	DE	On-Demand	Anodyne	CA7	40	35
COCC(C)(C)CCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104489	DE	On-Demand	Anodyne	CA9	40	39
COCC(C)(C)CCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104489	DE	On-Demand	Anodyne	CYNT	41	36
COCC(C)(C)CCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104490	DE	On-Demand	Anodyne	CA2	49	39
COCC(C)(C)CCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104490	DE	On-Demand	Anodyne	CA1	42	39
COCC(C)(C)CCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104490	DE	On-Demand	Anodyne	CA7	40	35
COCC(C)(C)CCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104490	DE	On-Demand	Anodyne	CA9	40	39
COCC(C)(C)CCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000872104490	DE	On-Demand	Anodyne	CYNT	41	36
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP13	46	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP2	25	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP3	49	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP8	25	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP9	33	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	TGM2	35	45
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP7	43	46
COCC(C)(C)CCNC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000872104527	GF	On-Demand	Anodyne	MMP1	43	46
COCC(C)(C)CCN[C@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000872104628	DG	On-Demand	Anodyne	ENPP1	54	32
COCC(C)(C)CCN[C@@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000872104629	DG	On-Demand	Anodyne	ENPP1	54	32
COCC(C)(C)CCN[C@@H](C)CCCc1cccnc1	ZINC000872104756	CG	On-Demand	Anodyne	TBXAS1	24	42
COCC(C)(C)CCN[C@@H](C)CCCc1cccnc1	ZINC000872104756	CG	On-Demand	Anodyne	PTAFR	35	45
COCC(C)(C)CCN[C@H](C)CCCc1cccnc1	ZINC000872104757	CG	On-Demand	Anodyne	TBXAS1	24	42
COCC(C)(C)CCN[C@H](C)CCCc1cccnc1	ZINC000872104757	CG	On-Demand	Anodyne	PTAFR	35	45
COCC(C)(C)CCN[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872104971	DI	On-Demand	Anodyne	MPO	24	41
COCC(C)(C)CCN[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872104971	DI	On-Demand	Anodyne	MMP11	43	32
COCC(C)(C)CCN[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872104971	DI	On-Demand	Anodyne	CCKBR	47	35
COCC(C)(C)CCN[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872104972	DI	On-Demand	Anodyne	MPO	24	41
COCC(C)(C)CCN[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872104972	DI	On-Demand	Anodyne	MMP11	43	32
COCC(C)(C)CCN[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872104972	DI	On-Demand	Anodyne	CCKBR	47	35
COCC(C)(C)CCN[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872104995	DH	On-Demand	Anodyne	ACHE	36	43
COCC(C)(C)CCN[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872104995	DH	On-Demand	Anodyne	SIGMAR1	39	41
COCC(C)(C)CCN[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872104996	DH	On-Demand	Anodyne	ACHE	36	43
COCC(C)(C)CCN[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872104996	DH	On-Demand	Anodyne	SIGMAR1	39	41
COCC(C)(C)CCN[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872104997	DH	On-Demand	Anodyne	ACHE	36	43
COCC(C)(C)CCN[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872104997	DH	On-Demand	Anodyne	SIGMAR1	39	41
COCC(C)(C)CCN[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872104998	DH	On-Demand	Anodyne	ACHE	36	43
COCC(C)(C)CCN[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872104998	DH	On-Demand	Anodyne	SIGMAR1	39	41
COCC(C)(C)CCN[C@H]1CCc2ccc(OC)cc2C1	ZINC000872105020	CG	On-Demand	Anodyne	ADRB3	18	42
COCC(C)(C)CCN[C@@H]1CCc2ccc(OC)cc2C1	ZINC000872105021	CG	On-Demand	Anodyne	ADRB3	18	42
COCC(C)(C)CCN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105034	EH	On-Demand	Anodyne	DRD2	15	44
COCC(C)(C)CCN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105034	EH	On-Demand	Anodyne	LTA4H	16	44
COCC(C)(C)CCN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105034	EH	On-Demand	Anodyne	ACHP_LYMST	15	40
COCC(C)(C)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105035	EH	On-Demand	Anodyne	DRD2	15	44
COCC(C)(C)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105035	EH	On-Demand	Anodyne	LTA4H	16	44
COCC(C)(C)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105035	EH	On-Demand	Anodyne	ACHP_LYMST	15	40
COCC(C)(C)CCN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105036	EH	On-Demand	Anodyne	DRD2	15	44
COCC(C)(C)CCN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105036	EH	On-Demand	Anodyne	LTA4H	16	44
COCC(C)(C)CCN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872105036	EH	On-Demand	Anodyne	ACHP_LYMST	15	40
COCC(C)(C)CCN[C@@H](C)c1ccc(-n2ccnc2)cc1	ZINC000872105139	DH	On-Demand	Anodyne	CYP2C19	20	40
COCC(C)(C)CCN[C@H](C)c1ccc(-n2ccnc2)cc1	ZINC000872105140	DH	On-Demand	Anodyne	CYP2C19	20	40
CC[C@@H](NCCC(C)(C)COC)c1cccc([N+](=O)[O-])c1	ZINC000872105164	CH	On-Demand	Bother	CACNA1C	46	35
CC[C@@H](NCCC(C)(C)COC)c1cccc([N+](=O)[O-])c1	ZINC000872105164	CH	On-Demand	Bother	CACNA1D	71	34
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105187	DG	On-Demand	Anodyne	MTNR1A	28	44
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105187	DG	On-Demand	Anodyne	MTNR1B	31	47
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105187	DG	On-Demand	Anodyne	TAAR1	33	42
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105188	DG	On-Demand	Anodyne	MTNR1A	28	44
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105188	DG	On-Demand	Anodyne	MTNR1B	31	47
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc(OC)c1	ZINC000872105188	DG	On-Demand	Anodyne	TAAR1	33	42
COCC(C)(C)CCN[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000872105191	DH	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COCC(C)(C)CCN[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000872105192	DH	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COCC(C)(C)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872105200	EG	On-Demand	Anodyne	SIGMAR1	23	44
COCC(C)(C)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872105200	EG	On-Demand	Anodyne	CACNA1G	26	42
COCC(C)(C)CCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872105228	EH	On-Demand	Anodyne	DRD4	40	42
COCC(C)(C)CCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872105228	EH	On-Demand	Anodyne	SIGMAR1	30	44
COCC(C)(C)CCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872105228	EH	On-Demand	Anodyne	SSTR5	56	38
COCC(C)(C)CCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872105228	EH	On-Demand	Anodyne	CXCR3	24	49
COCC(C)(C)CCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872105228	EH	On-Demand	Anodyne	MCHR1	33	42
COCC(C)(C)CCN[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000872105257	DH	On-Demand	Anodyne	DRD4	36	45
COCC(C)(C)CCN[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000872105257	DH	On-Demand	Anodyne	ACHE	38	43
COCC(C)(C)CCN[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000872105258	DH	On-Demand	Anodyne	DRD4	36	45
COCC(C)(C)CCN[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000872105258	DH	On-Demand	Anodyne	ACHE	38	43
COCC(C)(C)CCN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000872105259	DH	On-Demand	Anodyne	DRD4	36	45
COCC(C)(C)CCN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000872105259	DH	On-Demand	Anodyne	ACHE	38	43
COCC(C)(C)CCN[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000872105260	DH	On-Demand	Anodyne	DRD4	36	45
COCC(C)(C)CCN[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000872105260	DH	On-Demand	Anodyne	ACHE	38	43
COCC(C)(C)CCNC1CCN(CCc2ccccc2)CC1	ZINC000872105359	DG	On-Demand	Anodyne	DRD2	15	40
COCC(C)(C)CCNC1CCN(CCc2ccccc2)CC1	ZINC000872105359	DG	On-Demand	Anodyne	DRD4	29	44
COCC(C)(C)CCNC1CCN(CCc2ccccc2)CC1	ZINC000872105359	DG	On-Demand	Anodyne	ACHE	28	49
COCC(C)(C)CCNC1CCN(CCc2ccccc2)CC1	ZINC000872105359	DG	On-Demand	Anodyne	SIGMAR1	59	49
COC(=O)c1cccc(NC(=O)C[C@H](C)NC[C@@H]2CC(C)(C)CO2)c1	ZINC000872105360	EF	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NC(=O)C[C@@H](C)NC[C@@H]2CC(C)(C)CO2)c1	ZINC000872105361	EF	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NC(=O)C[C@@H](C)NC[C@H]2CC(C)(C)CO2)c1	ZINC000872105362	EF	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NC(=O)C[C@H](C)NC[C@H]2CC(C)(C)CO2)c1	ZINC000872105363	EF	On-Demand	Anodyne	HIF1A	15	44
O=C(c1ccoc1)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872105425	FH	On-Demand	Anodyne	SFRP1	51	35
COCC(C)(C)CCN[C@H](C)c1ccc(NS(C)(=O)=O)cc1	ZINC000872105516	EF	On-Demand	Anodyne	TRPV1	16	40
COCC(C)(C)CCN[C@@H](C)c1ccc(NS(C)(=O)=O)cc1	ZINC000872105517	EF	On-Demand	Anodyne	TRPV1	16	40
COCC(C)(C)CCNC1CCN(Cc2ccncc2)CC1	ZINC000872105520	DF	On-Demand	Anodyne	SIGMAR1	19	40
COCC(C)(C)CCNC1CCN(Cc2ccncc2)CC1	ZINC000872105520	DF	On-Demand	Anodyne	SSTR5	67	35
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000872105556	EF	On-Demand	Bother	CACNA1C	47	35
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000872105556	EF	On-Demand	Bother	CACNA1D	76	35
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000872105558	EF	On-Demand	Bother	CACNA1C	47	35
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000872105558	EF	On-Demand	Bother	CACNA1D	76	35
COc1ccc(N2CCN(C(=O)/C=C\c3ccc(OCc4c(C)noc4C)c(OC)c3)CC2)cc1	ZINC000872105575	JI	On-Demand	Clean	PDK1	25	41
CC(C)(C)CC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872105578	FI	On-Demand	Anodyne	SFRP1	118	39
CC(C)(C)CC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872105578	FI	On-Demand	Anodyne	WNT3	83	39
COc1ccc(N2CCN(C(=O)/C=C/c3ccc(OCc4c(C)noc4C)c(OC)c3)CC2)cc1	ZINC000872105579	JI	On-Demand	Clean	PDK1	25	41
C[C@@H](Cn1cncn1)NC[C@@H]1CC(C)(C)CO1	ZINC000872105586	BD	On-Demand	Anodyne	HIS3	44	33
C[C@@H](Cn1cncn1)NC[C@H]1CC(C)(C)CO1	ZINC000872105588	BD	On-Demand	Anodyne	HIS3	44	33
NC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872105686	DE	On-Demand	Anodyne	SFRP1	61	33
NC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872105686	DE	On-Demand	Anodyne	WNT3	41	33
C[C@H](NCc1ccc(C(F)(F)F)s1)c1ccc(S(N)(=O)=O)cc1	ZINC000872105793	FG	On-Demand	Anodyne	CA2	28	40
C[C@H](NCc1ccc(C(F)(F)F)s1)c1ccc(S(N)(=O)=O)cc1	ZINC000872105793	FG	On-Demand	Anodyne	CA1	19	40
C[C@H](NCc1ccc(C(F)(F)F)s1)c1ccc(S(N)(=O)=O)cc1	ZINC000872105793	FG	On-Demand	Anodyne	CA9	16	40
CN1[C@H]2CC[C@H]1CC(NCC(F)(F)c1ccc(F)cc1F)C2	ZINC000872105953	DG	On-Demand	Anodyne	SLC6A3	16	46
C[C@@H](NC[C@@H]1CC(C)(C)CO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872105959	EG	On-Demand	Anodyne	EPHX2	47	39
C[C@H](NC[C@H]1CC(C)(C)CO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872105975	EG	On-Demand	Anodyne	EPHX2	47	39
COCC(C)(C)CCN[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000872106015	DG	On-Demand	Anodyne	BMP1	41	35
COCC(C)(C)CCN[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000872106018	DG	On-Demand	Anodyne	BMP1	41	35
COCC(C)(C)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872106171	FH	On-Demand	Anodyne	ECR	41	33
COCC(C)(C)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872106171	FH	On-Demand	Anodyne	EPHX2	16	41
COCC(C)(C)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872106171	FH	On-Demand	Anodyne	CCR8	61	32
COCC(C)(C)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872106171	FH	On-Demand	Anodyne	SFRP1	48	43
COCC(C)(C)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872106171	FH	On-Demand	Anodyne	L3MBTL3	47	39
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1ccc(OC)cc1	ZINC000872106173	DG	On-Demand	Anodyne	MTNR1B	16	45
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1ccc(OC)cc1	ZINC000872106174	DG	On-Demand	Anodyne	MTNR1B	16	45
COCC(C)(C)CCN[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872106195	EH	On-Demand	Anodyne	EPHX2	51	42
COCC(C)(C)CCN[C@H](C)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872106196	EH	On-Demand	Anodyne	EPHX2	51	42
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872106221	EG	On-Demand	Anodyne	G2YM83_BOTF4	56	31
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872106222	EG	On-Demand	Anodyne	G2YM83_BOTF4	56	31
C[C@@H](Cn1cncn1)NCC1(c2ccc(Br)cc2)CC1	ZINC000872106288	EF	On-Demand	Anodyne	HIS3	69	32
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc(C)c1	ZINC000872106471	DG	On-Demand	Anodyne	KCNK3	63	36
COCC(C)(C)CCN[C@@H](C)CC(=O)Nc1cccc(C)c1	ZINC000872106471	DG	On-Demand	Anodyne	KCNK9	58	36
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc(C)c1	ZINC000872106472	DG	On-Demand	Anodyne	KCNK3	63	36
COCC(C)(C)CCN[C@H](C)CC(=O)Nc1cccc(C)c1	ZINC000872106472	DG	On-Demand	Anodyne	KCNK9	58	36
C[C@@H](Cn1cncn1)NCCC[C@@H]1C=CCC1	ZINC000872106692	BE	On-Demand	Anodyne	HIS3	44	33
C[C@@H](Cn1cncn1)NCCC[C@H]1C=CCC1	ZINC000872106693	BE	On-Demand	Anodyne	HIS3	44	33
COC[C@H](NC[C@@H]1C[C@H]2CCC[C@H]2O1)c1ccccc1	ZINC000872106707	CF	On-Demand	Anodyne	MAN1B1	48	35
COC[C@H](NC[C@@H]1C[C@@H]2CCC[C@H]2O1)c1ccccc1	ZINC000872106708	CF	On-Demand	Anodyne	MAN1B1	48	35
COC[C@H](NC[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1ccccc1	ZINC000872106709	CF	On-Demand	Anodyne	MAN1B1	48	35
COC[C@H](NC[C@@H]1C[C@H]2CCC[C@@H]2O1)c1ccccc1	ZINC000872106710	CF	On-Demand	Anodyne	MAN1B1	48	35
COc1ccc([C@H](Cc2ccncc2)NC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872106783	EH	On-Demand	Anodyne	PDE4A	22	42
COc1ccc([C@H](Cc2ccncc2)NC[C@H]2CC(C)(C)CO2)cc1	ZINC000872106784	EH	On-Demand	Anodyne	PDE4A	22	42
COc1ccc([C@@H](Cc2ccncc2)NC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872106785	EH	On-Demand	Anodyne	PDE4A	22	42
COc1ccc([C@@H](Cc2ccncc2)NC[C@H]2CC(C)(C)CO2)cc1	ZINC000872106786	EH	On-Demand	Anodyne	PDE4A	22	42
COCC(C)(C)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000872106787	EH	On-Demand	Anodyne	DRD4	15	47
COCC(C)(C)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000872106787	EH	On-Demand	Anodyne	SIGMAR1	18	44
COCC(C)(C)CCN[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872106788	EF	On-Demand	Anodyne	DRD4	25	44
COCC(C)(C)CCN[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872106789	EF	On-Demand	Anodyne	DRD4	25	44
COCC(C)(C)CCN[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872106790	EF	On-Demand	Anodyne	DRD4	25	44
COCC(C)(C)CCN[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872106791	EF	On-Demand	Anodyne	DRD4	25	44
CCOC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872107044	EG	On-Demand	Anodyne	GPR119	18	40
CCOC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872107044	EG	On-Demand	Anodyne	SFRP1	61	35
CCOC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872107044	EG	On-Demand	Anodyne	WNT3	43	33
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	HTR1A	67	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	DRD2	48	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	ADRA1D	56	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872107147	EG	On-Demand	Anodyne	HTR7	40	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	HTR1A	67	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	DRD2	48	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	ADRA1D	56	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872107148	EG	On-Demand	Anodyne	HTR7	40	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	HTR1A	67	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	DRD2	48	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	ADRA1D	56	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872107149	EG	On-Demand	Anodyne	HTR7	40	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	HTR1A	67	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	DRD2	48	45
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	ADRA1D	56	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872107150	EG	On-Demand	Anodyne	HTR7	40	41
COCC(C)(C)CCN[C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872107482	DH	On-Demand	Bother	COLA	115	37
COCC(C)(C)CCN[C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872107483	DH	On-Demand	Bother	COLA	115	37
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	HTR1A	82	47
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	DRD4	34	44
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	ADRA1D	76	45
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	ADRA1A	66	45
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	ADRA1B	62	45
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	DRD3	58	44
COc1ccccc1N1CCC(NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000872107516	DG	On-Demand	Anodyne	HTR7	46	44
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	HTR1A	82	47
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	DRD4	34	44
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	ADRA1D	76	45
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	ADRA1A	66	45
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	ADRA1B	62	45
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	DRD3	58	44
COc1ccccc1N1CCC(NC[C@H]2CC(C)(C)CO2)CC1	ZINC000872107517	DG	On-Demand	Anodyne	HTR7	46	44
FC(F)(F)c1ccc(CN[C@@H]2CCCc3cccnc32)s1	ZINC000872107775	DI	On-Demand	Anodyne	CXCR4	51	34
FC(F)(F)c1ccc(CN[C@H]2CCCc3cccnc32)s1	ZINC000872107776	DI	On-Demand	Anodyne	CXCR4	51	34
C[C@@H](Cn1cncn1)NCC(F)(F)c1ccc(F)cc1F	ZINC000872107953	DE	On-Demand	Anodyne	HIS3	53	31
Cc1cccc(NC(=O)C[C@H](C)NC[C@H]2CC(C)(C)CO2)c1	ZINC000872108072	DG	On-Demand	Anodyne	KCNK3	41	34
Cc1cccc(NC(=O)C[C@H](C)NC[C@@H]2CC(C)(C)CO2)c1	ZINC000872108073	DG	On-Demand	Anodyne	KCNK3	41	34
Fc1ccc(C(F)(F)CNC2CCN(Cc3ccncc3)CC2)c(F)c1	ZINC000872108301	FH	On-Demand	Anodyne	SIGMAR1	22	45
Fc1ccc(C(F)(F)CNC2CCN(Cc3ccncc3)CC2)c(F)c1	ZINC000872108301	FH	On-Demand	Anodyne	CCR3	15	43
COC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872108330	EF	On-Demand	Anodyne	SFRP1	67	36
COC(=O)N1CCC(NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000872108330	EF	On-Demand	Anodyne	WNT3	49	34
c1cnc2c(c1)CCC[C@@H]2NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872108532	CG	On-Demand	Anodyne	CXCR4	49	34
c1cnc2c(c1)CCC[C@@H]2NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872108535	CG	On-Demand	Anodyne	CXCR4	49	34
c1cnc2c(c1)CCC[C@@H]2NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872108537	CG	On-Demand	Anodyne	CXCR4	49	34
c1cnc2c(c1)CCC[C@@H]2NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872108539	CG	On-Demand	Anodyne	CXCR4	49	34
N#Cc1ccc(CN2CCC(NCCC[C@@H]3C=CCC3)CC2)cc1	ZINC000872108653	DH	On-Demand	Mild	SIGMAR1	15	42
N#Cc1ccc(CN2CCC(NCCC[C@H]3C=CCC3)CC2)cc1	ZINC000872108658	DH	On-Demand	Mild	SIGMAR1	15	42
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872109082	DG	On-Demand	Bother	COLA	90	32
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872109083	DG	On-Demand	Bother	COLA	90	32
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872109084	DG	On-Demand	Bother	COLA	90	32
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872109085	DG	On-Demand	Bother	COLA	90	32
O=C(Oc1ccccc1)N1CCC[C@H](NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872109329	GH	On-Demand	Anodyne	SFRP1	105	34
O=C(Oc1ccccc1)N1CCC[C@H](NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872109329	GH	On-Demand	Anodyne	WNT3	76	34
O=C(Oc1ccccc1)N1CCC[C@@H](NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872109330	GH	On-Demand	Anodyne	SFRP1	105	34
O=C(Oc1ccccc1)N1CCC[C@@H](NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872109330	GH	On-Demand	Anodyne	WNT3	76	34
c1ccc(CCN2CCC(NC[C@@H]3C[C@H]4CCC[C@@H]4O3)CC2)cc1	ZINC000872109643	EG	On-Demand	Anodyne	SIGMAR1	32	40
c1ccc(CCN2CCC(NC[C@@H]3C[C@H]4CCC[C@H]4O3)CC2)cc1	ZINC000872109644	EG	On-Demand	Anodyne	SIGMAR1	32	40
c1ccc(CCN2CCC(NC[C@@H]3C[C@@H]4CCC[C@@H]4O3)CC2)cc1	ZINC000872109645	EG	On-Demand	Anodyne	SIGMAR1	32	40
c1ccc(CCN2CCC(NC[C@@H]3C[C@@H]4CCC[C@H]4O3)CC2)cc1	ZINC000872109646	EG	On-Demand	Anodyne	SIGMAR1	32	40
O=C(c1ccoc1)N1CCC(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000872109749	DE	On-Demand	Anodyne	L3MBTL3	43	32
O=C(c1ccoc1)N1CCC(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000872109750	DE	On-Demand	Anodyne	L3MBTL3	43	32
O=C(c1ccoc1)N1CCC(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000872109751	DE	On-Demand	Anodyne	L3MBTL3	43	32
O=C(c1ccoc1)N1CCC(NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000872109752	DE	On-Demand	Anodyne	L3MBTL3	43	32
COc1ccc(N2CCN(C(=O)C(O)(c3ccccc3)c3ccccc3)CC2)cc1	ZINC000872110011	HG	On-Demand	Clean	HTR1A	22	41
COc1ccc(N2CCN(C(=O)C(O)(c3ccccc3)c3ccccc3)CC2)cc1	ZINC000872110011	HG	On-Demand	Clean	HTR7	22	41
COc1ccc(N2CCN(C(=O)C(O)(c3ccccc3)c3ccccc3)CC2)cc1	ZINC000872110011	HG	On-Demand	Clean	CCKAR	24	41
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccncc2)CC1	ZINC000872110019	FF	On-Demand	Anodyne	DRD4	18	40
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccncc2)CC1	ZINC000872110019	FF	On-Demand	Anodyne	SIGMAR1	22	44
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccncc2)CC1	ZINC000872110019	FF	On-Demand	Anodyne	SSTR5	53	37
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccncc2)CC1	ZINC000872110019	FF	On-Demand	Anodyne	SLC6A5	25	40
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccncc2)CC1	ZINC000872110019	FF	On-Demand	Anodyne	MCHR1	19	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872110030	JG	On-Demand	Anodyne	EPHX2	20	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872110030	JG	On-Demand	Anodyne	L3MBTL3	65	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872110030	JG	On-Demand	Anodyne	NAMPT	70	46
COc1cccc([C@@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872110066	DH	On-Demand	Anodyne	CASR	15	53
COc1cccc([C@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872110068	DH	On-Demand	Anodyne	CASR	15	53
C[C@H](CC(=O)OC(C)(C)C)NCCOC(F)(F)C(F)(F)F	ZINC000872110086	DF	On-Demand	Anodyne	MLYCD	21	45
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOCC3)CC2)cc1	ZINC000872110115	FC	On-Demand	Clean	ITGAL	85	42
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOCC3)CC2)cc1	ZINC000872110115	FC	On-Demand	Clean	PDK1	17	41
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOCC3)CC2)cc1	ZINC000872110115	FC	On-Demand	Clean	AKR1C3	22	53
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOCC3)CC2)cc1	ZINC000872110116	FC	On-Demand	Clean	ITGAL	85	42
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOCC3)CC2)cc1	ZINC000872110116	FC	On-Demand	Clean	PDK1	17	41
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOCC3)CC2)cc1	ZINC000872110116	FC	On-Demand	Clean	AKR1C3	22	53
C[C@@H](NCCn1ccc(C(F)(F)F)n1)c1ccc(N2CCOCC2)c(F)c1	ZINC000872110155	GG	On-Demand	Clean	TRPV1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110169	EF	On-Demand	Anodyne	GPR119	49	38
CC(C)(C)OC(=O)N1CC[C@@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110169	EF	On-Demand	Anodyne	SFRP1	99	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110169	EF	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CC[C@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110176	EF	On-Demand	Anodyne	GPR119	49	38
CC(C)(C)OC(=O)N1CC[C@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110176	EF	On-Demand	Anodyne	SFRP1	99	42
CC(C)(C)OC(=O)N1CC[C@H](NCCn2ccc(C(F)(F)F)n2)C1	ZINC000872110176	EF	On-Demand	Anodyne	WNT3	69	37
CSCC[C@@H](C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	ZINC000872110279	JF	On-Demand	Anodyne	L3MBTL3	46	35
CSCC[C@H](C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	ZINC000872110280	JF	On-Demand	Anodyne	L3MBTL3	46	35
CSCC[C@H](C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	ZINC000872110281	JF	On-Demand	Anodyne	L3MBTL3	46	35
CSCC[C@H](C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	ZINC000872110282	JF	On-Demand	Anodyne	L3MBTL3	46	35
C[C@@H](Cn1cncn1)NCCOC(F)(F)C(F)(F)F	ZINC000872110292	CD	On-Demand	Anodyne	HIS3	79	37
C[C@@H](NCCOC(F)(F)C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000872110295	GG	On-Demand	Anodyne	TRPV1	65	35
FC(F)(F)C(F)(F)OCCNC1CCN(Cc2ccccn2)CC1	ZINC000872110299	FF	On-Demand	Anodyne	SSTR5	44	34
FC(F)(F)C(F)(F)OCCNC1CCN(c2ccccn2)CC1	ZINC000872110427	EF	On-Demand	Anodyne	DRD4	23	43
O=C(Nc1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1cccs1	ZINC000872110433	II	On-Demand	Anodyne	HDAC1	20	40
O=C(Nc1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1cccs1	ZINC000872110433	II	On-Demand	Anodyne	HDAC2	16	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc(F)c(F)c(F)c1F	ZINC000872110454	GG	On-Demand	Anodyne	PARP1	51	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc(F)c(F)c(F)c1F	ZINC000872110454	GG	On-Demand	Anodyne	L3MBTL3	72	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc(F)c(F)c(F)c1F	ZINC000872110454	GG	On-Demand	Anodyne	NAMPT	32	43
O=C1OCC[C@H]1CCCN[C@H]1CCc2cccc3cccc1c23	ZINC000872110471	DH	On-Demand	Anodyne	MTNR1A	16	41
O=C1OCC[C@H]1CCCN[C@H]1CCc2cccc3cccc1c23	ZINC000872110471	DH	On-Demand	Anodyne	MTNR1B	15	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2cccc3cccc1c23	ZINC000872110472	DH	On-Demand	Anodyne	MTNR1A	16	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2cccc3cccc1c23	ZINC000872110472	DH	On-Demand	Anodyne	MTNR1B	15	41
O=C1OCC[C@H]1CCCN[C@@H]1CCc2cccc3cccc1c23	ZINC000872110473	DH	On-Demand	Anodyne	MTNR1A	16	41
O=C1OCC[C@H]1CCCN[C@@H]1CCc2cccc3cccc1c23	ZINC000872110473	DH	On-Demand	Anodyne	MTNR1B	15	41
O=C1OCC[C@@H]1CCCN[C@H]1CCc2cccc3cccc1c23	ZINC000872110474	DH	On-Demand	Anodyne	MTNR1A	16	41
O=C1OCC[C@@H]1CCCN[C@H]1CCc2cccc3cccc1c23	ZINC000872110474	DH	On-Demand	Anodyne	MTNR1B	15	41
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1	ZINC000872110483	HD	On-Demand	Clean	HTR1A	19	48
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1	ZINC000872110483	HD	On-Demand	Clean	DRD4	45	38
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1	ZINC000872110483	HD	On-Demand	Clean	HTR7	30	48
COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1	ZINC000872110483	HD	On-Demand	Clean	CCR1	21	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	F2	15	44
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	CHRM2	18	43
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	ADRA1D	23	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	ADRA1A	16	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	ADRA1B	19	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	EPHX2	20	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	TGM2	17	42
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	F13A1	26	42
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	CCR8	97	47
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	SFRP1	104	41
CCOC(=O)N1CCC(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)CC1	ZINC000872110490	ID	On-Demand	Anodyne	WNT3	72	34
C[C@@H](NCCn1ccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872110521	GG	On-Demand	Anodyne	GPR119	48	43
C[C@@H](NCCn1ccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872110522	GG	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CCC(NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872110660	FF	On-Demand	Anodyne	GPR119	54	39
CC(C)(C)OC(=O)N1CCC(NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872110660	FF	On-Demand	Anodyne	SFRP1	81	41
CC(C)(C)OC(=O)N1CCC(NCCn2ccc(C(F)(F)F)n2)CC1	ZINC000872110660	FF	On-Demand	Anodyne	WNT3	53	36
COC(=O)c1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872110669	FE	On-Demand	Anodyne	BDKRB1	19	41
COC(=O)c1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872110669	FE	On-Demand	Anodyne	PTR1	40	36
COC(=O)c1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872110669	FE	On-Demand	Anodyne	L3MBTL3	48	42
COC(=O)c1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872110669	FE	On-Demand	Anodyne	NAMPT	50	43
C[C@@H](CC(=O)N1CCCCCC1)NCCOC(F)(F)C(F)(F)F	ZINC000872110733	EF	On-Demand	Anodyne	RIR1_HHV11	44	31
C[C@@H](NCCOC(F)(F)C(F)(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872110736	FE	On-Demand	Anodyne	CA2	57	39
C[C@@H](NCCOC(F)(F)C(F)(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872110736	FE	On-Demand	Anodyne	CA1	44	39
C[C@@H](NCCOC(F)(F)C(F)(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872110736	FE	On-Demand	Anodyne	CA7	42	35
C[C@@H](NCCOC(F)(F)C(F)(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872110736	FE	On-Demand	Anodyne	CYNT	40	36
C[C@@H](CCCc1cccnc1)NCCOC(F)(F)C(F)(F)F	ZINC000872110743	EH	On-Demand	Anodyne	PTAFR	34	44
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	HTR1A	90	43
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	DRD2	68	43
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	DRD4	34	41
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	ADRA1D	85	40
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	HTR2A	22	43
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	ADRA1A	73	40
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	ADRA1B	67	40
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	DRD3	65	41
COc1ccccc1N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872110839	EF	On-Demand	Anodyne	HTR7	51	40
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	HTR1A	90	43
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	DRD2	68	43
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	DRD4	34	41
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	ADRA1D	85	40
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	HTR2A	22	43
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	ADRA1A	73	40
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	ADRA1B	67	40
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	DRD3	65	41
COc1ccccc1N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872110840	EF	On-Demand	Anodyne	HTR7	51	40
COc1ccc2c(c1)CC[C@H]2NCCC[C@H]1CCOC1=O	ZINC000872110925	CF	On-Demand	Anodyne	NQO2	21	43
COc1ccc2c(c1)CC[C@H]2NCCC[C@H]1CCOC1=O	ZINC000872110925	CF	On-Demand	Anodyne	PPARD	24	40
COc1ccc2c(c1)CC[C@H]2NCCC[C@H]1CCOC1=O	ZINC000872110925	CF	On-Demand	Anodyne	EBP	15	41
COc1ccc2c(c1)CC[C@H]2NCCC[C@@H]1CCOC1=O	ZINC000872110927	CF	On-Demand	Anodyne	NQO2	21	43
COc1ccc2c(c1)CC[C@H]2NCCC[C@@H]1CCOC1=O	ZINC000872110927	CF	On-Demand	Anodyne	PPARD	24	40
COc1ccc2c(c1)CC[C@H]2NCCC[C@@H]1CCOC1=O	ZINC000872110927	CF	On-Demand	Anodyne	EBP	15	41
FC(F)(F)C(F)(F)OCCN[C@H]1CCCc2cccnc21	ZINC000872110955	DG	On-Demand	Anodyne	CXCR4	63	35
FC(F)(F)C(F)(F)OCCN[C@@H]1CCCc2cccnc21	ZINC000872110956	DG	On-Demand	Anodyne	CXCR4	63	35
N#Cc1ccc(CN2CCC(NCCOC(F)(F)C(F)(F)F)CC2)cc1	ZINC000872111068	GG	On-Demand	Mild	SIGMAR1	24	48
N#Cc1ccc(CN2CCC(NCCOC(F)(F)C(F)(F)F)CC2)cc1	ZINC000872111068	GG	On-Demand	Mild	SLC6A5	24	40
N#Cc1ccc(CN2CCC(NCCOC(F)(F)C(F)(F)F)CC2)cc1	ZINC000872111068	GG	On-Demand	Mild	MCHR1	15	40
CC(=O)Nc1cccc([C@@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872111071	EG	On-Demand	Anodyne	KCNK3	56	37
CC(=O)Nc1cccc([C@@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872111071	EG	On-Demand	Anodyne	KCNK9	49	37
CC(=O)Nc1cccc([C@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872111072	EG	On-Demand	Anodyne	KCNK3	56	37
CC(=O)Nc1cccc([C@H](C)NCCOC(F)(F)C(F)(F)F)c1	ZINC000872111072	EG	On-Demand	Anodyne	KCNK9	49	37
CCC[C@H](NCCC[C@H]1CCOC1=O)C1CCC1	ZINC000872111248	CF	On-Demand	Anodyne	LASR	40	34
CCC[C@H](NCCC[C@@H]1CCOC1=O)C1CCC1	ZINC000872111249	CF	On-Demand	Anodyne	LASR	40	34
CCC[C@@H](NCCC[C@H]1CCOC1=O)C1CCC1	ZINC000872111250	CF	On-Demand	Anodyne	LASR	40	34
CCC[C@@H](NCCC[C@@H]1CCOC1=O)C1CCC1	ZINC000872111251	CF	On-Demand	Anodyne	LASR	40	34
O=C1OCC[C@H]1CCCN[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872111377	DF	On-Demand	Anodyne	DRD4	27	41
O=C1OCC[C@H]1CCCN[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872111377	DF	On-Demand	Anodyne	SIGMAR1	33	44
O=C1OCC[C@H]1CCCN[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872111378	DF	On-Demand	Anodyne	DRD4	27	41
O=C1OCC[C@H]1CCCN[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872111378	DF	On-Demand	Anodyne	SIGMAR1	33	44
O=C1OCC[C@@H]1CCCN[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872111379	DF	On-Demand	Anodyne	DRD4	27	41
O=C1OCC[C@@H]1CCCN[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872111379	DF	On-Demand	Anodyne	SIGMAR1	33	44
O=C1OCC[C@@H]1CCCN[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872111380	DF	On-Demand	Anodyne	DRD4	27	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872111380	DF	On-Demand	Anodyne	SIGMAR1	33	44
CCCC[C@@H](C)NCCC[C@H]1CCOC1=O	ZINC000872111399	BE	On-Demand	Anodyne	LASR	45	38
CCCC[C@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872111400	BE	On-Demand	Anodyne	LASR	45	38
CCCC[C@H](C)NCCC[C@H]1CCOC1=O	ZINC000872111401	BE	On-Demand	Anodyne	LASR	45	38
CCCC[C@@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872111402	BE	On-Demand	Anodyne	LASR	45	38
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111427	EE	On-Demand	Anodyne	LUXR	64	34
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111427	EE	On-Demand	Anodyne	TRAR	44	39
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111427	EE	On-Demand	Anodyne	LASR	48	39
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111428	EE	On-Demand	Anodyne	LUXR	64	34
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111428	EE	On-Demand	Anodyne	TRAR	44	39
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872111428	EE	On-Demand	Anodyne	LASR	48	39
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111429	EE	On-Demand	Anodyne	LUXR	64	34
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111429	EE	On-Demand	Anodyne	TRAR	44	39
C[C@@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111429	EE	On-Demand	Anodyne	LASR	48	39
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111430	EE	On-Demand	Anodyne	LUXR	64	34
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111430	EE	On-Demand	Anodyne	TRAR	44	39
C[C@H](CC(=O)NCCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872111430	EE	On-Demand	Anodyne	LASR	48	39
O=C1OCC[C@H]1CCCNC1CC(c2cccc(Br)c2)C1	ZINC000872111484	FH	On-Demand	Anodyne	LUXR	22	40
O=C1OCC[C@@H]1CCCNC1CC(c2cccc(Br)c2)C1	ZINC000872111485	FH	On-Demand	Anodyne	LUXR	22	40
C[C@@H](NCCC[C@@H]1CCOC1=O)c1ccc(-n2cccn2)cc1	ZINC000872111573	DF	On-Demand	Anodyne	AMP1_PLAFQ	54	40
C[C@@H](NCCC[C@H]1CCOC1=O)c1ccc(-n2cccn2)cc1	ZINC000872111576	DF	On-Demand	Anodyne	AMP1_PLAFQ	54	40
CCCc1ccc([C@@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872111637	CH	On-Demand	Anodyne	LUXR	48	35
CCCc1ccc([C@@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872111642	CH	On-Demand	Anodyne	LUXR	48	35
CCCc1ccc([C@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872111644	CH	On-Demand	Anodyne	LUXR	48	35
CCCc1ccc([C@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872111646	CH	On-Demand	Anodyne	LUXR	48	35
O=C1OCC[C@@H]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000872111668	DF	On-Demand	Bother	LUXR	18	40
O=C1OCC[C@H]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000872111669	DF	On-Demand	Bother	LUXR	18	40
O=C1OCC[C@H]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000872111670	DF	On-Demand	Bother	LUXR	18	40
O=C1OCC[C@@H]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000872111671	DF	On-Demand	Bother	LUXR	18	40
CCOC(=O)NC1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872111726	DD	On-Demand	Anodyne	LASR	43	36
CCOC(=O)NC1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872111727	DD	On-Demand	Anodyne	LASR	43	36
O=C1OCC[C@H]1CCCN[C@@H]1CCc2cccc(O)c21	ZINC000872111728	CE	On-Demand	Clean	LUXR	58	33
O=C1OCC[C@H]1CCCN[C@@H]1CCc2cccc(O)c21	ZINC000872111728	CE	On-Demand	Clean	TRAR	56	33
O=C1OCC[C@H]1CCCN[C@H]1CCc2cccc(O)c21	ZINC000872111729	CE	On-Demand	Clean	LUXR	58	33
O=C1OCC[C@H]1CCCN[C@H]1CCc2cccc(O)c21	ZINC000872111729	CE	On-Demand	Clean	TRAR	56	33
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2cccc(O)c21	ZINC000872111730	CE	On-Demand	Clean	LUXR	58	33
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2cccc(O)c21	ZINC000872111730	CE	On-Demand	Clean	TRAR	56	33
O=C1OCC[C@@H]1CCCN[C@H]1CCc2cccc(O)c21	ZINC000872111731	CE	On-Demand	Clean	LUXR	58	33
O=C1OCC[C@@H]1CCCN[C@H]1CCc2cccc(O)c21	ZINC000872111731	CE	On-Demand	Clean	TRAR	56	33
CCCOc1ccc([C@@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872111952	DG	On-Demand	Anodyne	ACACB	15	44
CCCOc1ccc([C@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872111953	DG	On-Demand	Anodyne	ACACB	15	44
CCCOc1ccc([C@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872111954	DG	On-Demand	Anodyne	ACACB	15	44
CCCOc1ccc([C@@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872111955	DG	On-Demand	Anodyne	ACACB	15	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCCC[C@@H]1CCOC1=O	ZINC000872111993	EF	On-Demand	Anodyne	DRD4	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCCC[C@@H]1CCOC1=O	ZINC000872111993	EF	On-Demand	Anodyne	ACHE	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCCC[C@H]1CCOC1=O	ZINC000872111995	EF	On-Demand	Anodyne	DRD4	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCCC[C@H]1CCOC1=O	ZINC000872111995	EF	On-Demand	Anodyne	ACHE	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCCC[C@H]1CCOC1=O	ZINC000872111998	EF	On-Demand	Anodyne	DRD4	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCCC[C@H]1CCOC1=O	ZINC000872111998	EF	On-Demand	Anodyne	ACHE	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCCC[C@@H]1CCOC1=O	ZINC000872112000	EF	On-Demand	Anodyne	DRD4	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCCC[C@@H]1CCOC1=O	ZINC000872112000	EF	On-Demand	Anodyne	ACHE	36	40
O=C1OCC[C@@H]1CCCN[C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112036	FI	On-Demand	Anodyne	LUXR	16	43
O=C1OCC[C@@H]1CCCN[C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112036	FI	On-Demand	Anodyne	TRAR	19	43
O=C1OCC[C@@H]1CCCN[C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112038	FI	On-Demand	Anodyne	LUXR	16	43
O=C1OCC[C@@H]1CCCN[C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112038	FI	On-Demand	Anodyne	TRAR	19	43
O=C1OCC[C@@H]1CCCN[C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112039	FI	On-Demand	Anodyne	LUXR	16	43
O=C1OCC[C@@H]1CCCN[C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112039	FI	On-Demand	Anodyne	TRAR	19	43
O=C1OCC[C@@H]1CCCN[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112040	FI	On-Demand	Anodyne	LUXR	16	43
O=C1OCC[C@@H]1CCCN[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872112040	FI	On-Demand	Anodyne	TRAR	19	43
CC[C@@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872112083	DF	On-Demand	Bother	LUXR	18	44
CC[C@@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872112085	DF	On-Demand	Bother	LUXR	18	44
O=C1OCC[C@@H]1CCCN[C@H]1CCCc2cccnc21	ZINC000872112110	CE	On-Demand	Anodyne	CXCR4	59	34
O=C1OCC[C@H]1CCCN[C@H]1CCCc2cccnc21	ZINC000872112111	CE	On-Demand	Anodyne	CXCR4	59	34
O=C1OCC[C@@H]1CCCN[C@@H]1CCCc2cccnc21	ZINC000872112112	CE	On-Demand	Anodyne	CXCR4	59	34
O=C1OCC[C@H]1CCCN[C@@H]1CCCc2cccnc21	ZINC000872112114	CE	On-Demand	Anodyne	CXCR4	59	34
CCCC[C@H](COC)NCCC[C@@H]1CCOC1=O	ZINC000872112184	CE	On-Demand	Anodyne	LASR	41	35
CCCC[C@@H](COC)NCCC[C@@H]1CCOC1=O	ZINC000872112185	CE	On-Demand	Anodyne	LASR	41	35
CCCC[C@H](COC)NCCC[C@H]1CCOC1=O	ZINC000872112186	CE	On-Demand	Anodyne	LASR	41	35
CCCC[C@@H](COC)NCCC[C@H]1CCOC1=O	ZINC000872112187	CE	On-Demand	Anodyne	LASR	41	35
CCCC[C@@H]1CCC[C@@H]1NCCC[C@H]1CCOC1=O	ZINC000872112204	CG	On-Demand	Anodyne	LASR	42	35
CCCC[C@@H]1CCC[C@@H]1NCCC[C@@H]1CCOC1=O	ZINC000872112205	CG	On-Demand	Anodyne	LASR	42	35
CCCC[C@@H]1CCC[C@H]1NCCC[C@H]1CCOC1=O	ZINC000872112206	CG	On-Demand	Anodyne	LASR	42	35
CCCC[C@@H]1CCC[C@H]1NCCC[C@@H]1CCOC1=O	ZINC000872112207	CG	On-Demand	Anodyne	LASR	42	35
CCS(=O)(=O)C[C@@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872112220	CC	On-Demand	Anodyne	LASR	42	35
CCS(=O)(=O)C[C@@H](C)NCCC[C@H]1CCOC1=O	ZINC000872112221	CC	On-Demand	Anodyne	LASR	42	35
CCS(=O)(=O)C[C@H](C)NCCC[C@H]1CCOC1=O	ZINC000872112222	CC	On-Demand	Anodyne	LASR	42	35
CCS(=O)(=O)C[C@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872112223	CC	On-Demand	Anodyne	LASR	42	35
C[C@@H](NCCC[C@@H]1CCOC1=O)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872112295	EE	On-Demand	Anodyne	GPR119	16	43
C[C@@H](NCCC[C@H]1CCOC1=O)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872112296	EE	On-Demand	Anodyne	GPR119	16	43
C[C@@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872112425	CF	On-Demand	Bother	LUXR	18	45
O=C1OCC[C@H]1CCCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112426	EH	On-Demand	Anodyne	NQO2	18	43
O=C1OCC[C@H]1CCCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112426	EH	On-Demand	Anodyne	TRAR	38	42
O=C1OCC[C@H]1CCCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112428	EH	On-Demand	Anodyne	NQO2	18	43
O=C1OCC[C@H]1CCCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112428	EH	On-Demand	Anodyne	TRAR	38	42
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112430	EH	On-Demand	Anodyne	NQO2	18	43
O=C1OCC[C@@H]1CCCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112430	EH	On-Demand	Anodyne	TRAR	38	42
C[C@@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872112431	CF	On-Demand	Bother	LUXR	18	45
O=C1OCC[C@@H]1CCCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112432	EH	On-Demand	Anodyne	NQO2	18	43
O=C1OCC[C@@H]1CCCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000872112432	EH	On-Demand	Anodyne	TRAR	38	42
CCC[C@H](C)[C@H](CC)NCCC[C@H]1CCOC1=O	ZINC000872112513	CG	On-Demand	Anodyne	LASR	40	34
CCC[C@H](C)[C@H](CC)NCCC[C@@H]1CCOC1=O	ZINC000872112515	CG	On-Demand	Anodyne	LASR	40	34
O=C1OCC[C@@H]1CCCNC1CC(c2ccc(Br)cc2)C1	ZINC000872112555	FH	On-Demand	Anodyne	TRAR	20	42
O=C1OCC[C@H]1CCCNC1CC(c2ccc(Br)cc2)C1	ZINC000872112556	FH	On-Demand	Anodyne	TRAR	20	42
C[C@@H](Cc1cccc(C(F)(F)F)c1)NCCC[C@@H]1CCOC1=O	ZINC000872112636	EH	On-Demand	Anodyne	LUXR	34	47
C[C@@H](Cc1cccc(C(F)(F)F)c1)NCCC[C@H]1CCOC1=O	ZINC000872112637	EH	On-Demand	Anodyne	LUXR	34	47
O=C1OCC[C@@H]1CCCNC(Cc1ccccc1)Cc1ccccc1	ZINC000872112957	EH	On-Demand	Anodyne	LUXR	43	34
O=C1OCC[C@H]1CCCNC(Cc1ccccc1)Cc1ccccc1	ZINC000872112958	EH	On-Demand	Anodyne	LUXR	43	34
CCC(CC)NCCC[C@H]1CCOC1=O	ZINC000872113134	BE	On-Demand	Anodyne	LASR	42	35
CCC(CC)NCCC[C@@H]1CCOC1=O	ZINC000872113135	BE	On-Demand	Anodyne	LASR	42	35
O=C1OCC[C@H]1CCCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000872113187	EG	On-Demand	Bother	LUXR	18	41
O=C1OCC[C@H]1CCCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000872113188	EG	On-Demand	Bother	LUXR	18	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000872113189	EG	On-Demand	Bother	LUXR	18	41
O=C1OCC[C@@H]1CCCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000872113190	EG	On-Demand	Bother	LUXR	18	41
CCC[C@H](NCCC[C@@H]1CCOC1=O)C1CCCC1	ZINC000872113207	CG	On-Demand	Anodyne	LASR	40	34
CCC[C@H](NCCC[C@H]1CCOC1=O)C1CCCC1	ZINC000872113208	CG	On-Demand	Anodyne	LASR	40	34
CCC[C@@H](NCCC[C@@H]1CCOC1=O)C1CCCC1	ZINC000872113209	CG	On-Demand	Anodyne	LASR	40	34
CCC[C@@H](NCCC[C@H]1CCOC1=O)C1CCCC1	ZINC000872113210	CG	On-Demand	Anodyne	LASR	40	34
CCOC(=O)C1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872113233	CE	On-Demand	Anodyne	LASR	40	33
CCOC(=O)C1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872113234	CE	On-Demand	Anodyne	LASR	40	33
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113333	DF	On-Demand	Anodyne	DRD4	45	46
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113333	DF	On-Demand	Anodyne	ACHE	49	49
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113333	DF	On-Demand	Anodyne	SIGMAR1	64	49
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113333	DF	On-Demand	Anodyne	CCR3	15	43
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113333	DF	On-Demand	Anodyne	MCHR1	32	41
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113334	DF	On-Demand	Anodyne	DRD4	45	46
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113334	DF	On-Demand	Anodyne	ACHE	49	49
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113334	DF	On-Demand	Anodyne	SIGMAR1	64	49
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113334	DF	On-Demand	Anodyne	CCR3	15	43
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2)CC1	ZINC000872113334	DF	On-Demand	Anodyne	MCHR1	32	41
CCC[C@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872113386	DG	On-Demand	Bother	LUXR	17	42
CCC[C@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872113387	DG	On-Demand	Bother	LUXR	17	42
CCC[C@@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872113388	DG	On-Demand	Bother	LUXR	17	42
CCC[C@@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872113389	DG	On-Demand	Bother	LUXR	17	42
CC[C@@H](NCCC[C@H]1CCOC1=O)C(C)C	ZINC000872113393	BE	On-Demand	Anodyne	LASR	40	34
CC[C@@H](NCCC[C@@H]1CCOC1=O)C(C)C	ZINC000872113395	BE	On-Demand	Anodyne	LASR	40	34
CCOC(=O)N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872113429	CD	On-Demand	Anodyne	LASR	42	35
CCOC(=O)N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872113430	CD	On-Demand	Anodyne	LASR	42	35
CCCC[C@@H](CC)NCCC[C@@H]1CCOC1=O	ZINC000872113589	BF	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](CC)NCCC[C@@H]1CCOC1=O	ZINC000872113590	BF	On-Demand	Anodyne	LASR	44	38
CCCC[C@@H](CC)NCCC[C@H]1CCOC1=O	ZINC000872113591	BF	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](CC)NCCC[C@H]1CCOC1=O	ZINC000872113592	BF	On-Demand	Anodyne	LASR	44	38
O=C(N1CC[C@@H](NCc2ncc(Cl)s2)c2ccccc2C1)C(F)(F)F	ZINC000872113713	GH	On-Demand	Anodyne	RBP4	51	37
O=C(N1CC[C@H](NCc2ncc(Cl)s2)c2ccccc2C1)C(F)(F)F	ZINC000872113714	GH	On-Demand	Anodyne	RBP4	51	37
O=C1OCC[C@H]1CCCNC1CCN(CCc2ccccc2)CC1	ZINC000872113723	EF	On-Demand	Anodyne	DRD4	18	47
O=C1OCC[C@H]1CCCNC1CCN(CCc2ccccc2)CC1	ZINC000872113723	EF	On-Demand	Anodyne	SIGMAR1	49	49
O=C1OCC[C@@H]1CCCNC1CCN(CCc2ccccc2)CC1	ZINC000872113724	EF	On-Demand	Anodyne	DRD4	18	47
O=C1OCC[C@@H]1CCCNC1CCN(CCc2ccccc2)CC1	ZINC000872113724	EF	On-Demand	Anodyne	SIGMAR1	49	49
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872113729	FF	On-Demand	Anodyne	L3MBTL3	39	40
O=C1OCC[C@H]1CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872113730	FF	On-Demand	Anodyne	L3MBTL3	39	40
C[C@@H](CCc1ccc2c(c1)OCO2)NCCC[C@@H]1CCOC1=O	ZINC000872113953	DF	On-Demand	Anodyne	LUXR	36	48
C[C@H](CCc1ccc2c(c1)OCO2)NCCC[C@H]1CCOC1=O	ZINC000872113954	DF	On-Demand	Anodyne	LUXR	36	48
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	GRIN2B	32	46
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	TGM2	37	44
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	F13A1	34	44
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	CCR8	27	40
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113972	FF	On-Demand	Anodyne	TRAR	56	38
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	GRIN2B	32	46
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	TGM2	37	44
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	F13A1	34	44
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	CCR8	27	40
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@H]1CCCNC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872113973	FF	On-Demand	Anodyne	TRAR	56	38
C[C@H](CCc1ccc2c(c1)OCO2)NCCC[C@@H]1CCOC1=O	ZINC000872113985	DF	On-Demand	Anodyne	LUXR	36	48
C[C@@H](CCc1ccc2c(c1)OCO2)NCCC[C@H]1CCOC1=O	ZINC000872113986	DF	On-Demand	Anodyne	LUXR	36	48
C[C@@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872114009	EH	On-Demand	Anodyne	LUXR	31	45
C[C@@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872114009	EH	On-Demand	Anodyne	TRAR	30	47
C[C@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872114010	EH	On-Demand	Anodyne	LUXR	31	45
C[C@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872114010	EH	On-Demand	Anodyne	TRAR	30	47
C[C@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872114011	EH	On-Demand	Anodyne	LUXR	31	45
C[C@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872114011	EH	On-Demand	Anodyne	TRAR	30	47
C[C@@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872114012	EH	On-Demand	Anodyne	LUXR	31	45
C[C@@H](CCc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872114012	EH	On-Demand	Anodyne	TRAR	30	47
COC(=O)C1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872114013	CD	On-Demand	Anodyne	LASR	47	33
COC(=O)C1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872114014	CD	On-Demand	Anodyne	LASR	47	33
O=C1OCC[C@@H]1CCCNC1CCC(c2ccccc2)CC1	ZINC000872114050	DH	On-Demand	Anodyne	LUXR	41	33
O=C1OCC[C@@H]1CCCNC1CCC(c2ccccc2)CC1	ZINC000872114050	DH	On-Demand	Anodyne	TRAR	40	36
O=C1OCC[C@H]1CCCNC1CCC(c2ccccc2)CC1	ZINC000872114051	DH	On-Demand	Anodyne	LUXR	41	33
O=C1OCC[C@H]1CCCNC1CCC(c2ccccc2)CC1	ZINC000872114051	DH	On-Demand	Anodyne	TRAR	40	36
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114078	FG	On-Demand	Anodyne	DRD4	35	45
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114078	FG	On-Demand	Anodyne	SIGMAR1	21	45
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114078	FG	On-Demand	Anodyne	CXCR3	17	44
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114078	FG	On-Demand	Anodyne	MCHR1	36	44
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114079	FG	On-Demand	Anodyne	DRD4	35	45
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114079	FG	On-Demand	Anodyne	SIGMAR1	21	45
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114079	FG	On-Demand	Anodyne	CXCR3	17	44
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872114079	FG	On-Demand	Anodyne	MCHR1	36	44
O=C1OCC[C@@H]1CCCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000872114115	FG	On-Demand	Anodyne	SIGMAR1	17	44
O=C1OCC[C@H]1CCCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000872114116	FG	On-Demand	Anodyne	SIGMAR1	17	44
O=C1OCC[C@@H]1CCCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872114117	EF	On-Demand	Anodyne	SIGMAR1	15	42
O=C1OCC[C@H]1CCCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872114120	EF	On-Demand	Anodyne	SIGMAR1	15	42
CCCC[C@H](C)[C@@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872114136	CG	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](C)[C@H](C)NCCC[C@H]1CCOC1=O	ZINC000872114142	CG	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](C)[C@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872114146	CG	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](C)[C@@H](C)NCCC[C@H]1CCOC1=O	ZINC000872114149	CG	On-Demand	Anodyne	LASR	44	38
COC(=O)N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872114163	CD	On-Demand	Anodyne	TRAR	41	34
COC(=O)N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872114163	CD	On-Demand	Anodyne	LASR	40	34
COC(=O)N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872114165	CD	On-Demand	Anodyne	TRAR	41	34
COC(=O)N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872114165	CD	On-Demand	Anodyne	LASR	40	34
C[C@@H](CCCc1cccnc1)NCCC[C@@H]1CCOC1=O	ZINC000872114284	CF	On-Demand	Anodyne	PTAFR	30	41
C[C@@H](CCCc1cccnc1)NCCC[C@H]1CCOC1=O	ZINC000872114286	CF	On-Demand	Anodyne	PTAFR	30	41
CCCCC[C@@H](C)NCCC[C@@H]1CCOC1=O	ZINC000872114294	BF	On-Demand	Anodyne	LASR	48	43
CCCCC[C@@H](C)NCCC[C@H]1CCOC1=O	ZINC000872114296	BF	On-Demand	Anodyne	LASR	48	43
Cn1ccnc1[C@H](NCCC[C@@H]1CCOC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000872114347	FE	On-Demand	Bother	LUXR	17	40
Cn1ccnc1[C@H](NCCC[C@H]1CCOC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000872114349	FE	On-Demand	Bother	LUXR	17	40
Cn1ccnc1[C@@H](NCCC[C@H]1CCOC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000872114351	FE	On-Demand	Bother	LUXR	17	40
Cn1ccnc1[C@@H](NCCC[C@@H]1CCOC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000872114354	FE	On-Demand	Bother	LUXR	17	40
C[C@@H](CCc1cccc(C(F)(F)F)c1)NCCC[C@@H]1CCOC1=O	ZINC000872114435	EH	On-Demand	Anodyne	LUXR	32	50
C[C@H](CCc1cccc(C(F)(F)F)c1)NCCC[C@H]1CCOC1=O	ZINC000872114437	EH	On-Demand	Anodyne	LUXR	32	50
C[C@H](CCc1cccc(C(F)(F)F)c1)NCCC[C@@H]1CCOC1=O	ZINC000872114439	EH	On-Demand	Anodyne	LUXR	32	50
C[C@@H](CCc1cccc(C(F)(F)F)c1)NCCC[C@H]1CCOC1=O	ZINC000872114440	EH	On-Demand	Anodyne	LUXR	32	50
O=C1OCC[C@@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114471	EE	On-Demand	Anodyne	GRIN2B	24	42
O=C1OCC[C@@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114471	EE	On-Demand	Anodyne	TGM2	34	45
O=C1OCC[C@@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114471	EE	On-Demand	Anodyne	F13A1	30	45
O=C1OCC[C@@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114471	EE	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114471	EE	On-Demand	Anodyne	TRAR	40	37
O=C1OCC[C@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114472	EE	On-Demand	Anodyne	GRIN2B	24	42
O=C1OCC[C@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114472	EE	On-Demand	Anodyne	TGM2	34	45
O=C1OCC[C@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114472	EE	On-Demand	Anodyne	F13A1	30	45
O=C1OCC[C@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114472	EE	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@H]1CCCN[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114472	EE	On-Demand	Anodyne	TRAR	40	37
O=C1OCC[C@@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114473	EE	On-Demand	Anodyne	GRIN2B	24	42
O=C1OCC[C@@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114473	EE	On-Demand	Anodyne	TGM2	34	45
O=C1OCC[C@@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114473	EE	On-Demand	Anodyne	F13A1	30	45
O=C1OCC[C@@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114473	EE	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114473	EE	On-Demand	Anodyne	TRAR	40	37
O=C1OCC[C@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114474	EE	On-Demand	Anodyne	GRIN2B	24	42
O=C1OCC[C@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114474	EE	On-Demand	Anodyne	TGM2	34	45
O=C1OCC[C@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114474	EE	On-Demand	Anodyne	F13A1	30	45
O=C1OCC[C@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114474	EE	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@H]1CCCN[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872114474	EE	On-Demand	Anodyne	TRAR	40	37
O=C1OCC[C@H]1CCCN[C@H]1Cc2[nH]c3ccccc3c2C1	ZINC000872114582	CF	On-Demand	Anodyne	SSTR4	40	31
O=C1OCC[C@H]1CCCN[C@@H]1Cc2[nH]c3ccccc3c2C1	ZINC000872114583	CF	On-Demand	Anodyne	SSTR4	40	31
O=C1OCC[C@@H]1CCCN[C@H]1Cc2[nH]c3ccccc3c2C1	ZINC000872114584	CF	On-Demand	Anodyne	SSTR4	40	31
O=C1OCC[C@@H]1CCCN[C@@H]1Cc2[nH]c3ccccc3c2C1	ZINC000872114585	CF	On-Demand	Anodyne	SSTR4	40	31
C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)NCCC[C@H]1CCOC1=O	ZINC000872114599	FI	On-Demand	Anodyne	LUXR	19	41
C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)NCCC[C@@H]1CCOC1=O	ZINC000872114602	FI	On-Demand	Anodyne	LUXR	19	41
CC(=O)Nc1ccc([C@@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872114793	DF	On-Demand	Anodyne	LASR	40	30
CC(=O)Nc1ccc([C@@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872114794	DF	On-Demand	Anodyne	LASR	40	30
CC(=O)Nc1ccc([C@H](C)NCCC[C@@H]2CCOC2=O)cc1	ZINC000872114795	DF	On-Demand	Anodyne	LASR	40	30
CC(=O)Nc1ccc([C@H](C)NCCC[C@H]2CCOC2=O)cc1	ZINC000872114796	DF	On-Demand	Anodyne	LASR	40	30
O=C1OCC[C@@H]1CCCN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872114817	EG	On-Demand	Anodyne	LTA4H	15	42
O=C1OCC[C@@H]1CCCN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872114818	EG	On-Demand	Anodyne	LTA4H	15	42
O=C1OCC[C@H]1CCCN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872114819	EG	On-Demand	Anodyne	LTA4H	15	42
O=C1OCC[C@H]1CCCN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872114820	EG	On-Demand	Anodyne	LTA4H	15	42
Cn1ccnc1[C@@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872114847	FE	On-Demand	Bother	LUXR	17	42
Cn1ccnc1[C@@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872114849	FE	On-Demand	Bother	LUXR	17	42
Cn1ccnc1[C@H](NCCC[C@@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872114851	FE	On-Demand	Bother	LUXR	17	42
Cn1ccnc1[C@H](NCCC[C@H]1CCOC1=O)c1cccc([N+](=O)[O-])c1	ZINC000872114852	FE	On-Demand	Bother	LUXR	17	42
C[C@@H](NCCC[C@@H]1CCOC1=O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872114868	FF	On-Demand	Anodyne	GPR119	29	48
C[C@@H](NCCC[C@H]1CCOC1=O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872114874	FF	On-Demand	Anodyne	GPR119	29	48
CC[C@@H](NCCC[C@H]1CCOC1=O)c1ccc(OC(F)(F)F)cc1	ZINC000872114876	EH	On-Demand	Anodyne	TRAR	48	44
CC[C@@H](NCCC[C@@H]1CCOC1=O)c1ccc(OC(F)(F)F)cc1	ZINC000872114880	EH	On-Demand	Anodyne	TRAR	48	44
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ncc(Cl)s1	ZINC000872114929	EH	On-Demand	Anodyne	ENPP1	50	34
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ncc(Cl)s1	ZINC000872114930	EH	On-Demand	Anodyne	ENPP1	50	34
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1NCCC[C@@H]1CCOC1=O	ZINC000872114985	FF	On-Demand	Anodyne	GPR119	26	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1NCCC[C@@H]1CCOC1=O	ZINC000872114986	FF	On-Demand	Anodyne	GPR119	26	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1NCCC[C@H]1CCOC1=O	ZINC000872114987	FF	On-Demand	Anodyne	GPR119	26	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1NCCC[C@H]1CCOC1=O	ZINC000872114988	FF	On-Demand	Anodyne	GPR119	26	46
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115001	EG	On-Demand	Anodyne	LUXR	45	33
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115001	EG	On-Demand	Anodyne	TRAR	61	33
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115001	EG	On-Demand	Anodyne	LASR	52	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115002	EG	On-Demand	Anodyne	LUXR	45	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115002	EG	On-Demand	Anodyne	TRAR	61	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115002	EG	On-Demand	Anodyne	LASR	52	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115003	EG	On-Demand	Anodyne	LUXR	45	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115003	EG	On-Demand	Anodyne	TRAR	61	33
CCOC(=O)[C@@H]1CC[C@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115003	EG	On-Demand	Anodyne	LASR	52	33
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115004	EG	On-Demand	Anodyne	LUXR	45	33
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115004	EG	On-Demand	Anodyne	TRAR	61	33
CCOC(=O)[C@@H]1CC[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115004	EG	On-Demand	Anodyne	LASR	52	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115041	FH	On-Demand	Anodyne	LUXR	54	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115041	FH	On-Demand	Anodyne	TRAR	67	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@H]2CCOC2=O)c2ccccc21	ZINC000872115041	FH	On-Demand	Anodyne	LASR	46	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115044	FH	On-Demand	Anodyne	LUXR	54	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115044	FH	On-Demand	Anodyne	TRAR	67	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCCC[C@@H]2CCOC2=O)c2ccccc21	ZINC000872115044	FH	On-Demand	Anodyne	LASR	46	33
O=C(c1ccccc1Cl)N1CCC(NCc2ncc(Cl)s2)CC1	ZINC000872115187	FH	On-Demand	Anodyne	SFRP1	24	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCC[C@@H]2CCOC2=O)C1	ZINC000872115194	DD	On-Demand	Anodyne	GPR119	24	44
CC(C)(C)OC(=O)N1CC[C@H](NCCC[C@@H]2CCOC2=O)C1	ZINC000872115199	DD	On-Demand	Anodyne	GPR119	24	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCC[C@H]2CCOC2=O)C1	ZINC000872115200	DD	On-Demand	Anodyne	GPR119	24	44
CC(C)(C)OC(=O)N1CC[C@H](NCCC[C@H]2CCOC2=O)C1	ZINC000872115203	DD	On-Demand	Anodyne	GPR119	24	44
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC[C@H]1CCOC1=O	ZINC000872115253	EF	On-Demand	Anodyne	GPR119	23	43
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC[C@@H]1CCOC1=O	ZINC000872115257	EF	On-Demand	Anodyne	GPR119	23	43
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC[C@H]1CCOC1=O	ZINC000872115259	EF	On-Demand	Anodyne	GPR119	23	43
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC[C@@H]1CCOC1=O	ZINC000872115260	EF	On-Demand	Anodyne	GPR119	23	43
Cc1cccc(NC(=O)C[C@H](C)NCc2ncc(Cl)s2)c1	ZINC000872115264	DH	On-Demand	Anodyne	KCNK3	44	35
C[C@H](NCc1cc(C(F)(F)F)cc(Cl)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000872115351	GG	On-Demand	Anodyne	PTGS2	33	40
CC(C)(C)CC(=O)N1CCC(NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000872115352	GI	On-Demand	Anodyne	SFRP1	47	35
C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1ncc(Cl)s1	ZINC000872115429	EH	On-Demand	Bother	COLA	104	35
C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1ncc(Cl)s1	ZINC000872115431	EH	On-Demand	Bother	COLA	104	35
Fc1ccc(CCN2CCC(NCc3ncc(Cl)s3)CC2)cc1	ZINC000872115480	FH	On-Demand	Anodyne	SIGMAR1	24	47
CC(C)(C)OC(=O)N1CCC[C@H](NCCC[C@@H]2CCOC2=O)CC1	ZINC000872115530	EF	On-Demand	Anodyne	GPR119	27	45
CC(C)(C)OC(=O)N1CCC[C@H](NCCC[C@H]2CCOC2=O)CC1	ZINC000872115531	EF	On-Demand	Anodyne	GPR119	27	45
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC[C@@H]2CCOC2=O)CC1	ZINC000872115532	EF	On-Demand	Anodyne	GPR119	27	45
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC[C@H]2CCOC2=O)CC1	ZINC000872115533	EF	On-Demand	Anodyne	GPR119	27	45
C[C@@H](Cn1cncn1)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872115606	DF	On-Demand	Anodyne	HIS3	68	33
COC[C@@H](NCc1cc(C(F)(F)F)cc(Cl)n1)C1CC1	ZINC000872115654	DG	On-Demand	Anodyne	CRHR1	15	45
COC[C@H](NCc1cc(C(F)(F)F)cc(Cl)n1)C1CC1	ZINC000872115655	DG	On-Demand	Anodyne	CRHR1	15	45
CCC[C@@H](CCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872115689	DH	On-Demand	Anodyne	LASR	41	34
CCC[C@H](CCc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872115690	DH	On-Demand	Anodyne	LASR	41	34
CCC[C@@H](CCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872115691	DH	On-Demand	Anodyne	LASR	41	34
CCC[C@H](CCc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872115692	DH	On-Demand	Anodyne	LASR	41	34
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	HTR1A	83	43
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	DRD2	63	43
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	ADRA1D	79	41
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	ADRA1A	71	41
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	ADRA1B	62	41
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	DRD3	52	43
COc1ccccc1N1CCC(NCC2(OC(C)C)CCC2)CC1	ZINC000872115953	EH	On-Demand	Anodyne	HTR7	45	40
O=[N+]([O-])c1ccccc1C[C@@H](NCc1ncc(Cl)s1)C1CC1	ZINC000872115954	EH	On-Demand	Bother	COLA	51	32
O=[N+]([O-])c1ccccc1C[C@H](NCc1ncc(Cl)s1)C1CC1	ZINC000872115955	EH	On-Demand	Bother	COLA	51	32
C[C@@H](NCCC[C@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000872115977	CG	On-Demand	Anodyne	AMY2	43	29
C[C@@H](NCCC[C@@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000872115979	CG	On-Demand	Anodyne	AMY2	43	29
CC(C)[C@H](CCc1ccc(Cl)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872116138	EI	On-Demand	Anodyne	LUXR	23	42
CC(C)[C@H](CCc1ccc(Cl)cc1)NCCC[C@H]1CCOC1=O	ZINC000872116150	EI	On-Demand	Anodyne	LUXR	23	42
N#Cc1ccc(CN2CCC(NCc3ncc(Cl)s3)CC2)cc1	ZINC000872116332	EG	On-Demand	Mild	SIGMAR1	21	45
N#Cc1ccc(CN2CCC(NCc3ncc(Cl)s3)CC2)cc1	ZINC000872116332	EG	On-Demand	Mild	CXCR3	15	40
O=C1OCC[C@H]1CCCN[C@H]1CCCOc2c(Br)cccc21	ZINC000872116371	FH	On-Demand	Anodyne	METG	15	42
O=C1OCC[C@H]1CCCN[C@@H]1CCCOc2c(Br)cccc21	ZINC000872116373	FH	On-Demand	Anodyne	METG	15	42
O=C1OCC[C@@H]1CCCN[C@@H]1CCCOc2c(Br)cccc21	ZINC000872116375	FH	On-Demand	Anodyne	METG	15	42
O=C1OCC[C@@H]1CCCN[C@H]1CCCOc2c(Br)cccc21	ZINC000872116376	FH	On-Demand	Anodyne	METG	15	42
CC(=O)Nc1ccc([C@@H](C)NCc2ncc(Cl)s2)cc1	ZINC000872116477	DH	On-Demand	Anodyne	FFAR2	23	42
CC(=O)Nc1ccc([C@H](C)NCc2ncc(Cl)s2)cc1	ZINC000872116503	DH	On-Demand	Anodyne	FFAR2	23	42
COc1cccc([C@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)c1	ZINC000872116514	EJ	On-Demand	Anodyne	CASR	17	60
COc1cccc([C@@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)c1	ZINC000872116515	EJ	On-Demand	Anodyne	CASR	17	60
CC(=O)NCC1CCC(NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000872116708	FH	On-Demand	Anodyne	CACNA1I	50	38
O=C1OCC[C@@H]1CCCN[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116919	FI	On-Demand	Anodyne	LUXR	15	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116919	FI	On-Demand	Anodyne	TRAR	18	41
O=C1OCC[C@@H]1CCCN[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116920	FI	On-Demand	Anodyne	LUXR	15	41
O=C1OCC[C@@H]1CCCN[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116920	FI	On-Demand	Anodyne	TRAR	18	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116922	FI	On-Demand	Anodyne	LUXR	15	41
O=C1OCC[C@@H]1CCCN[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116922	FI	On-Demand	Anodyne	TRAR	18	41
O=C1OCC[C@@H]1CCCN[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116923	FI	On-Demand	Anodyne	LUXR	15	41
O=C1OCC[C@@H]1CCCN[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000872116923	FI	On-Demand	Anodyne	TRAR	18	41
CC(C)(C)OC(=O)N1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872116943	EE	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872116944	EE	On-Demand	Anodyne	GPR119	30	48
CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2ncc(Cl)s2)CC1	ZINC000872117094	FE	On-Demand	Anodyne	PTR1	48	35
CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2ncc(Cl)s2)CC1	ZINC000872117096	FE	On-Demand	Anodyne	PTR1	48	35
FC(F)(F)c1cc(Cl)nc(CNC2CCN(Cc3ccncc3)CC2)c1	ZINC000872117332	GH	On-Demand	Anodyne	SIGMAR1	15	43
FC(F)(F)c1cc(Cl)nc(CNC2CCN(Cc3ccncc3)CC2)c1	ZINC000872117332	GH	On-Demand	Anodyne	MCHR1	26	41
FC(F)(F)c1cc(Cl)nc(CNC2CCN(c3ccccn3)CC2)c1	ZINC000872117337	FH	On-Demand	Anodyne	DRD4	18	41
O=C1OCC[C@H]1CCCN[C@H]1CCCOc2c(Cl)cccc21	ZINC000872117339	DG	On-Demand	Anodyne	METG	24	43
O=C1OCC[C@H]1CCCN[C@@H]1CCCOc2c(Cl)cccc21	ZINC000872117340	DG	On-Demand	Anodyne	METG	24	43
O=C1OCC[C@@H]1CCCN[C@@H]1CCCOc2c(Cl)cccc21	ZINC000872117342	DG	On-Demand	Anodyne	METG	24	43
O=C1OCC[C@@H]1CCCN[C@H]1CCCOc2c(Cl)cccc21	ZINC000872117344	DG	On-Demand	Anodyne	METG	24	43
C[C@@H](CCc1ccccc1[N+](=O)[O-])NCCC[C@@H]1CCOC1=O	ZINC000872117444	DF	On-Demand	Bother	COLA	84	32
C[C@H](CCc1ccccc1[N+](=O)[O-])NCCC[C@H]1CCOC1=O	ZINC000872117446	DF	On-Demand	Bother	COLA	84	32
C[C@H](CCc1ccccc1[N+](=O)[O-])NCCC[C@@H]1CCOC1=O	ZINC000872117448	DF	On-Demand	Bother	COLA	84	32
C[C@@H](CCc1ccccc1[N+](=O)[O-])NCCC[C@H]1CCOC1=O	ZINC000872117449	DF	On-Demand	Bother	COLA	84	32
CCC[C@H](Cc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872117457	CG	On-Demand	Anodyne	LASR	42	35
CCC[C@H](Cc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872117459	CG	On-Demand	Anodyne	LASR	42	35
CCC[C@@H](Cc1ccccc1)NCCC[C@H]1CCOC1=O	ZINC000872117461	CG	On-Demand	Anodyne	LASR	42	35
CCC[C@@H](Cc1ccccc1)NCCC[C@@H]1CCOC1=O	ZINC000872117462	CG	On-Demand	Anodyne	LASR	42	35
COCc1cc([C@@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)ccc1OC	ZINC000872117543	GJ	On-Demand	Anodyne	CASR	20	41
COCc1cc([C@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)ccc1OC	ZINC000872117544	GJ	On-Demand	Anodyne	CASR	20	41
FC(F)(F)c1cc(Cl)nc(CN[C@@H]2CCCc3cccnc32)c1	ZINC000872117607	EI	On-Demand	Anodyne	CXCR4	65	39
FC(F)(F)c1cc(Cl)nc(CN[C@H]2CCCc3cccnc32)c1	ZINC000872117608	EI	On-Demand	Anodyne	CXCR4	65	39
O=C1OCC[C@H]1CCCN[C@@H](CCc1ccccc1)C(F)F	ZINC000872117646	DG	On-Demand	Anodyne	LUXR	49	33
O=C1OCC[C@@H]1CCCN[C@@H](CCc1ccccc1)C(F)F	ZINC000872117647	DG	On-Demand	Anodyne	LUXR	49	33
O=C1OCC[C@H]1CCCN[C@H](CCc1ccccc1)C(F)F	ZINC000872117648	DG	On-Demand	Anodyne	LUXR	49	33
O=C1OCC[C@@H]1CCCN[C@H](CCc1ccccc1)C(F)F	ZINC000872117649	DG	On-Demand	Anodyne	LUXR	49	33
CCCC[C@@H](NCCC[C@H]1CCOC1=O)c1ccccc1	ZINC000872117714	CH	On-Demand	Anodyne	LASR	45	34
CCCC[C@@H](NCCC[C@@H]1CCOC1=O)c1ccccc1	ZINC000872117715	CH	On-Demand	Anodyne	LASR	45	34
CCCC[C@H](NCCC[C@H]1CCOC1=O)c1ccccc1	ZINC000872117716	CH	On-Demand	Anodyne	LASR	45	34
CCCC[C@H](NCCC[C@@H]1CCOC1=O)c1ccccc1	ZINC000872117717	CH	On-Demand	Anodyne	LASR	45	34
COc1ccc2c(c1)C[C@@H](NCCC[C@H]1CCOC1=O)CC2	ZINC000872117734	DE	On-Demand	Anodyne	NQO2	21	42
COc1ccc2c(c1)C[C@@H](NCCC[C@@H]1CCOC1=O)CC2	ZINC000872117735	DE	On-Demand	Anodyne	NQO2	21	42
O=C1OCC[C@@H]1CCCNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872117844	EE	On-Demand	Bother	LUXR	17	42
O=C1OCC[C@H]1CCCNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872117845	EE	On-Demand	Bother	LUXR	17	42
O=C1OCC[C@@H]1CCCNC1CC(c2ccccc2)C1	ZINC000872117866	CF	On-Demand	Anodyne	LUXR	45	33
O=C1OCC[C@H]1CCCNC1CC(c2ccccc2)C1	ZINC000872117867	CF	On-Demand	Anodyne	LUXR	45	33
CCC[C@H](CC)NCCC[C@@H]1CCOC1=O	ZINC000872117896	BE	On-Demand	Anodyne	LASR	42	36
CCC[C@@H](CC)NCCC[C@H]1CCOC1=O	ZINC000872117897	BE	On-Demand	Anodyne	LASR	42	36
CCC[C@H](CC)NCCC[C@H]1CCOC1=O	ZINC000872117898	BE	On-Demand	Anodyne	LASR	42	36
CCC[C@@H](CC)NCCC[C@@H]1CCOC1=O	ZINC000872117899	BE	On-Demand	Anodyne	LASR	42	36
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872117908	EH	On-Demand	Anodyne	LUXR	24	46
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872117908	EH	On-Demand	Anodyne	TRAR	25	46
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872117909	EH	On-Demand	Anodyne	LUXR	24	46
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872117909	EH	On-Demand	Anodyne	TRAR	25	46
COC(=O)N1CCC(NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000872117941	FG	On-Demand	Anodyne	TACR1	29	40
COc1ccc([C@@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)cc1OC	ZINC000872117945	FJ	On-Demand	Anodyne	CASR	18	44
COc1ccc([C@@H](C)NCc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000872118013	EJ	On-Demand	Anodyne	CASR	15	45
CC(C)(C)OC(=O)NC1CCC(NCCC[C@H]2CCOC2=O)CC1	ZINC000872118084	EF	On-Demand	Anodyne	TRAR	45	33
CC(C)(C)OC(=O)NC1CCC(NCCC[C@@H]2CCOC2=O)CC1	ZINC000872118085	EF	On-Demand	Anodyne	TRAR	45	33
C[C@@H](Cc1ccc(Cl)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872118094	CG	On-Demand	Anodyne	LUXR	29	40
C[C@@H](Cc1ccc(Cl)cc1)NCCC[C@H]1CCOC1=O	ZINC000872118095	CG	On-Demand	Anodyne	LUXR	29	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCC[C@H]2CCOC2=O)C1	ZINC000872118335	EE	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC[C@H](NCCC[C@@H]2CCOC2=O)C1	ZINC000872118336	EE	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC[C@H]2CCOC2=O)C1	ZINC000872118337	EE	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC[C@@H]2CCOC2=O)C1	ZINC000872118338	EE	On-Demand	Anodyne	GPR119	21	41
O=C1OCC[C@@H]1CCCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872118357	EG	On-Demand	Anodyne	LTA4H	15	42
O=C1OCC[C@H]1CCCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872118358	EG	On-Demand	Anodyne	LTA4H	15	42
C[C@@H](CCc1ccc(F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872118389	CG	On-Demand	Anodyne	LEF	47	35
C[C@H](CCc1ccc(F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872118390	CG	On-Demand	Anodyne	LEF	47	35
C[C@H](CCc1ccc(F)cc1)NCCC[C@@H]1CCOC1=O	ZINC000872118391	CG	On-Demand	Anodyne	LEF	47	35
C[C@@H](CCc1ccc(F)cc1)NCCC[C@H]1CCOC1=O	ZINC000872118392	CG	On-Demand	Anodyne	LEF	47	35
N#Cc1ccc(CN2CCC(NCCC[C@@H]3CCOC3=O)CC2)cc1	ZINC000872118409	EE	On-Demand	Mild	SIGMAR1	17	40
N#Cc1ccc(CN2CCC(NCCC[C@@H]3CCOC3=O)CC2)cc1	ZINC000872118409	EE	On-Demand	Mild	MCHR1	21	41
N#Cc1ccc(CN2CCC(NCCC[C@H]3CCOC3=O)CC2)cc1	ZINC000872118410	EE	On-Demand	Mild	SIGMAR1	17	40
N#Cc1ccc(CN2CCC(NCCC[C@H]3CCOC3=O)CC2)cc1	ZINC000872118410	EE	On-Demand	Mild	MCHR1	21	41
O=C1OCC[C@H]1CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118411	FH	On-Demand	Bother	LUXR	22	44
O=C1OCC[C@H]1CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118411	FH	On-Demand	Bother	TRAR	18	44
O=C1OCC[C@@H]1CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118412	FH	On-Demand	Bother	LUXR	22	44
O=C1OCC[C@@H]1CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118412	FH	On-Demand	Bother	TRAR	18	44
O=C1OCC[C@@H]1CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118413	FH	On-Demand	Bother	LUXR	22	44
O=C1OCC[C@@H]1CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118413	FH	On-Demand	Bother	TRAR	18	44
O=C1OCC[C@H]1CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118414	FH	On-Demand	Bother	LUXR	22	44
O=C1OCC[C@H]1CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000872118414	FH	On-Demand	Bother	TRAR	18	44
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1CCCc3cccnc31)C2	ZINC000872118555	DE	On-Demand	Anodyne	CXCR4	66	36
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1CCCc3cccnc31)C2	ZINC000872118556	DE	On-Demand	Anodyne	CXCR4	66	36
C[C@H](CCc1c[nH]c2ccccc12)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872118776	FG	On-Demand	Anodyne	ECE1	41	35
C[C@H](CCc1c[nH]c2ccccc12)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872118776	FG	On-Demand	Anodyne	CCKBR	51	35
C[C@@H](CCc1c[nH]c2ccccc12)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872118777	FG	On-Demand	Anodyne	ECE1	41	35
C[C@@H](CCc1c[nH]c2ccccc12)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872118777	FG	On-Demand	Anodyne	CCKBR	51	35
O=[N+]([O-])c1ccccc1C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)C1CC1	ZINC000872118977	GF	On-Demand	Bother	COLA	83	33
O=[N+]([O-])c1ccccc1C[C@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)C1CC1	ZINC000872118978	GF	On-Demand	Bother	COLA	83	33
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccc(F)cc3)CC1)C2	ZINC000872119005	GF	On-Demand	Anodyne	SIGMAR1	19	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccc(F)cc3)CC1)C2	ZINC000872119005	GF	On-Demand	Anodyne	CCR3	42	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccc(F)cc3)CC1)C2	ZINC000872119005	GF	On-Demand	Anodyne	CACNA1G	16	40
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872119029	GG	On-Demand	Anodyne	DRD2	16	40
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872119029	GG	On-Demand	Anodyne	LTA4H	15	45
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872119031	GG	On-Demand	Anodyne	DRD2	16	40
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872119031	GG	On-Demand	Anodyne	LTA4H	15	45
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872119056	GF	On-Demand	Anodyne	SIGMAR1	37	41
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872119057	GF	On-Demand	Anodyne	SIGMAR1	37	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccncc3)CC1)C2	ZINC000872119080	FD	On-Demand	Anodyne	SIGMAR1	20	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccc(Cl)cc3)CC1)C2	ZINC000872119184	GG	On-Demand	Anodyne	DRD4	29	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccc(Cl)cc3)CC1)C2	ZINC000872119184	GG	On-Demand	Anodyne	SIGMAR1	29	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccc(Cl)cc3)CC1)C2	ZINC000872119184	GG	On-Demand	Anodyne	CXCR3	24	49
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccc(Cl)cc3)CC1)C2	ZINC000872119184	GG	On-Demand	Anodyne	MCHR1	25	42
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872119297	GF	On-Demand	Anodyne	GPR119	20	40
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872119299	GF	On-Demand	Anodyne	GPR119	20	40
N#Cc1ccc(CN2CCC(NCC3C[C@@H]4CC[C@H](C3)S4(=O)=O)CC2)cc1	ZINC000872119376	GE	On-Demand	Mild	SIGMAR1	24	45
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccccc3)CC1)C2	ZINC000872119529	GF	On-Demand	Anodyne	DRD4	15	45
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccccc3)CC1)C2	ZINC000872119529	GF	On-Demand	Anodyne	GRIN2B	22	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(CCc3ccccc3)CC1)C2	ZINC000872119529	GF	On-Demand	Anodyne	SIGMAR1	50	52
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	HTR1A	87	45
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	DRD2	69	45
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	ADRA1D	79	40
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	ADRA1A	70	40
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	ADRA1B	63	40
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	DRD3	60	45
COc1ccccc1N1CCC(NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000872119539	GF	On-Demand	Anodyne	HTR7	50	41
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)C(C)(C)c1ccccc1	ZINC000872119747	EG	On-Demand	Anodyne	AMY2	45	33
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872119779	GF	On-Demand	Anodyne	EPHX2	49	39
C[C@@H](CCCc1cccnc1)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872119874	EF	On-Demand	Anodyne	PTAFR	28	42
CCCOc1ccc([C@H](C)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872119974	FG	On-Demand	Anodyne	ACACA	15	47
CCCOc1ccc([C@H](C)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872119974	FG	On-Demand	Anodyne	ACACB	16	47
CCCOc1ccc([C@@H](C)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872119976	FG	On-Demand	Anodyne	ACACA	15	47
CCCOc1ccc([C@@H](C)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872119976	FG	On-Demand	Anodyne	ACACB	16	47
C[C@@H](Cc1ccc(F)cc1Cl)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120010	FG	On-Demand	Anodyne	P2RX7	32	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872120036	GG	On-Demand	Anodyne	DRD2	16	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1C[C@@H]3CC[C@H](C1)N3Cc1ccccc1)C2	ZINC000872120036	GG	On-Demand	Anodyne	LTA4H	15	45
O=C(OCc1ccccc1)N1CC[C@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120091	GE	On-Demand	Anodyne	GRIN2B	38	49
O=C(OCc1ccccc1)N1CC[C@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120091	GE	On-Demand	Anodyne	PREP	32	42
O=C(OCc1ccccc1)N1CC[C@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120091	GE	On-Demand	Anodyne	TGM2	36	47
O=C(OCc1ccccc1)N1CC[C@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120091	GE	On-Demand	Anodyne	F13A1	36	47
O=C(OCc1ccccc1)N1CC[C@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120091	GE	On-Demand	Anodyne	CCR8	21	40
O=C(OCc1ccccc1)N1CC[C@@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120093	GE	On-Demand	Anodyne	GRIN2B	38	49
O=C(OCc1ccccc1)N1CC[C@@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120093	GE	On-Demand	Anodyne	PREP	32	42
O=C(OCc1ccccc1)N1CC[C@@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120093	GE	On-Demand	Anodyne	TGM2	36	47
O=C(OCc1ccccc1)N1CC[C@@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120093	GE	On-Demand	Anodyne	F13A1	36	47
O=C(OCc1ccccc1)N1CC[C@@H](NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)C1	ZINC000872120093	GE	On-Demand	Anodyne	CCR8	21	40
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000872120205	FF	On-Demand	Anodyne	DRD4	27	41
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000872120205	FF	On-Demand	Anodyne	SIGMAR1	41	42
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000872120206	FF	On-Demand	Anodyne	DRD4	27	41
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000872120206	FF	On-Demand	Anodyne	SIGMAR1	41	42
C[C@@H](CCc1ccccc1[N+](=O)[O-])NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120256	FF	On-Demand	Bother	COLA	101	34
C[C@H](CCc1ccccc1[N+](=O)[O-])NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120257	FF	On-Demand	Bother	COLA	101	34
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872120266	GE	On-Demand	Anodyne	DRD4	22	41
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872120269	GE	On-Demand	Anodyne	DRD4	22	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3Cl)CC1)C2	ZINC000872120274	GG	On-Demand	Anodyne	SIGMAR1	19	46
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccsc1	ZINC000872120361	DJ	On-Demand	Anodyne	ROCK1	18	43
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccsc1	ZINC000872120362	DJ	On-Demand	Anodyne	ROCK1	18	43
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H](c1ccccc1)c1ccc(F)cc1)C2	ZINC000872120436	FH	On-Demand	Anodyne	SLC6A3	17	51
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H](c1ccccc1)c1ccc(F)cc1)C2	ZINC000872120437	FH	On-Demand	Anodyne	SLC6A3	17	51
CCOC(=O)C1CCC(NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872120583	EG	On-Demand	Anodyne	CD38	48	33
CCN(CC)C(=O)CN[C@@H](C)CC(=O)NCCc1ccccc1	ZINC000872120612	DD	On-Demand	Anodyne	ANPEP	21	42
CCN(CC)C(=O)CN[C@@H](C)CC(=O)NCCc1ccccc1	ZINC000872120612	DD	On-Demand	Anodyne	AMP1_PLAFQ	24	42
CCN(CC)C(=O)CN[C@H](C)CC(=O)NCCc1ccccc1	ZINC000872120613	DD	On-Demand	Anodyne	ANPEP	21	42
CCN(CC)C(=O)CN[C@H](C)CC(=O)NCCc1ccccc1	ZINC000872120613	DD	On-Demand	Anodyne	AMP1_PLAFQ	24	42
CCN(CC)C(=O)CN[C@@H](CCOC)Cc1cccc(F)c1	ZINC000872120624	DE	On-Demand	Anodyne	PIN1	27	40
CCN(CC)C(=O)CN[C@H](CCOC)Cc1cccc(F)c1	ZINC000872120625	DE	On-Demand	Anodyne	PIN1	27	40
C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1nc(-c2ccncc2)cs1	ZINC000872120642	FI	On-Demand	Bother	COLA	94	35
C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1nc(-c2ccncc2)cs1	ZINC000872120643	FI	On-Demand	Bother	COLA	94	35
CC[C@H](NCc1nc(-c2ccncc2)cs1)C1(C(=O)OC)CCC1	ZINC000872120675	EG	On-Demand	Anodyne	ROCK1	23	40
CC[C@H](NCc1nc(-c2ccncc2)cs1)C1(C(=O)OC)CCC1	ZINC000872120675	EG	On-Demand	Anodyne	ROCK2	15	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)C1(C(=O)OC)CCC1	ZINC000872120676	EG	On-Demand	Anodyne	ROCK1	23	40
CC[C@@H](NCc1nc(-c2ccncc2)cs1)C1(C(=O)OC)CCC1	ZINC000872120676	EG	On-Demand	Anodyne	ROCK2	15	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120752	GF	On-Demand	Anodyne	DRD4	31	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120752	GF	On-Demand	Anodyne	ACHE	35	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120753	GF	On-Demand	Anodyne	DRD4	31	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120753	GF	On-Demand	Anodyne	ACHE	35	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120754	GF	On-Demand	Anodyne	DRD4	31	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120754	GF	On-Demand	Anodyne	ACHE	35	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120755	GF	On-Demand	Anodyne	DRD4	31	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872120755	GF	On-Demand	Anodyne	ACHE	35	42
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1nccn1C	ZINC000872120824	DG	On-Demand	Anodyne	ROCK1	18	41
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1nccn1C	ZINC000872120825	DG	On-Demand	Anodyne	ROCK1	18	41
CCC[C@H](NCc1nc(-c2ccncc2)cs1)c1cccnc1	ZINC000872120832	DI	On-Demand	Anodyne	ROCK1	20	41
CCC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cccnc1	ZINC000872120833	DI	On-Demand	Anodyne	ROCK1	20	41
CCCC[C@@H](COC)NCc1nc(-c2ccncc2)cs1	ZINC000872120846	DG	On-Demand	Anodyne	ROCK1	16	40
CCCC[C@H](COC)NCc1nc(-c2ccncc2)cs1	ZINC000872120847	DG	On-Demand	Anodyne	ROCK1	16	40
CC(C)c1cccc([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121000	EK	On-Demand	Anodyne	ROCK1	24	46
CC(C)c1cccc([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121000	EK	On-Demand	Anodyne	ROCK2	15	46
CC(C)c1cccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121001	EK	On-Demand	Anodyne	ROCK1	24	46
CC(C)c1cccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121001	EK	On-Demand	Anodyne	ROCK2	15	46
CC(C)(C)OC(=O)N1CCC[C@H](NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872121023	GI	On-Demand	Anodyne	CPT1A	17	41
CC(C)(C)OC(=O)N1CCC[C@H](NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872121023	GI	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872121024	GI	On-Demand	Anodyne	CPT1A	17	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872121024	GI	On-Demand	Anodyne	GPR119	46	43
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1cc(OC)c(OC)c(OC)c1	ZINC000872121033	GI	On-Demand	Anodyne	ROCK1	20	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cc(OC)c(OC)c(OC)c1	ZINC000872121034	GI	On-Demand	Anodyne	ROCK1	20	41
c1ccc(C[C@@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872121049	EI	On-Demand	Anodyne	ROCK1	20	42
c1ccc(C[C@@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872121049	EI	On-Demand	Anodyne	GPR142	58	39
c1ccc(C[C@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872121050	EI	On-Demand	Anodyne	ROCK1	20	42
c1ccc(C[C@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872121050	EI	On-Demand	Anodyne	GPR142	58	39
COC[C@@H](CC(C)(C)C)NCc1nc(-c2ccncc2)cs1	ZINC000872121063	DH	On-Demand	Anodyne	ROCK1	18	41
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccc(-n2cccn2)cc1	ZINC000872121147	FF	On-Demand	Anodyne	AMP1_PLAFQ	57	42
COc1ccccc1NC(=O)C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121227	GH	On-Demand	Anodyne	ROCK1	24	42
COc1ccccc1NC(=O)C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121227	GH	On-Demand	Anodyne	ROCK2	17	49
COc1ccccc1NC(=O)C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121228	GH	On-Demand	Anodyne	ROCK1	24	42
COc1ccccc1NC(=O)C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121228	GH	On-Demand	Anodyne	ROCK2	17	49
NC(=O)N1CCC(NCCN(Cc2ccccc2)c2ccccn2)CC1	ZINC000872121258	FE	On-Demand	Anodyne	GRIN2B	24	42
C[C@@H](CCc1ccc(F)cc1)NCc1nc(-c2ccncc2)cs1	ZINC000872121280	EI	On-Demand	Anodyne	ROCK1	18	46
C[C@H](CCc1ccc(F)cc1)NCc1nc(-c2ccncc2)cs1	ZINC000872121282	EI	On-Demand	Anodyne	ROCK1	18	46
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccc(OCc2ccccc2)cc1	ZINC000872121344	GI	On-Demand	Anodyne	MAOB	16	41
C[C@@H](NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccc(OCc2ccccc2)cc1	ZINC000872121344	GI	On-Demand	Anodyne	LTA4H	24	40
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872121353	GD	On-Demand	Anodyne	NAMPT	53	47
COC(=O)c1cnc([C@H](C)NCc2nc(-c3ccncc3)cs2)s1	ZINC000872121411	FG	On-Demand	Anodyne	ROCK1	25	41
COC(=O)c1cnc([C@H](C)NCc2nc(-c3ccncc3)cs2)s1	ZINC000872121411	FG	On-Demand	Anodyne	ROCK2	17	41
COC(=O)c1cnc([C@@H](C)NCc2nc(-c3ccncc3)cs2)s1	ZINC000872121412	FG	On-Demand	Anodyne	ROCK1	25	41
COC(=O)c1cnc([C@@H](C)NCc2nc(-c3ccncc3)cs2)s1	ZINC000872121412	FG	On-Demand	Anodyne	ROCK2	17	41
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000872121415	EG	On-Demand	Anodyne	GRIA4	15	44
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000872121418	EG	On-Demand	Anodyne	GRIA4	15	44
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000872121420	EG	On-Demand	Anodyne	GRIA4	15	44
O=S1(=O)[C@H]2CC[C@H]1CC(CN[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000872121422	EG	On-Demand	Anodyne	GRIA4	15	44
CCC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1	ZINC000872121453	DJ	On-Demand	Anodyne	ROCK1	22	51
CCC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1	ZINC000872121453	DJ	On-Demand	Anodyne	ROCK2	15	51
CCC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1	ZINC000872121454	DJ	On-Demand	Anodyne	ROCK1	22	51
CCC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1	ZINC000872121454	DJ	On-Demand	Anodyne	ROCK2	15	51
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121481	FI	On-Demand	Anodyne	ROCK1	24	49
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121481	FI	On-Demand	Anodyne	KDR	15	40
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121481	FI	On-Demand	Anodyne	ROCK2	18	49
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872121481	FI	On-Demand	Anodyne	SLC1A2	43	32
COc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)cc1NC(C)=O	ZINC000872121489	GI	On-Demand	Anodyne	ROCK1	25	46
COc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)cc1NC(C)=O	ZINC000872121489	GI	On-Demand	Anodyne	ROCK2	17	46
COc1ccccc1C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121508	EH	On-Demand	Anodyne	ROCK1	22	40
COc1ccccc1C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121508	EH	On-Demand	Anodyne	ROCK2	15	52
COc1ccccc1C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121509	EH	On-Demand	Anodyne	ROCK1	22	40
COc1ccccc1C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121509	EH	On-Demand	Anodyne	ROCK2	15	52
COC(=O)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872121520	DD	On-Demand	Anodyne	SSTR5	51	39
COC(=O)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872121520	DD	On-Demand	Anodyne	PDK1	46	35
CO[C@@H](c1ccccc1)[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121564	EI	On-Demand	Anodyne	ROCK1	22	44
CO[C@@H](c1ccccc1)[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121564	EI	On-Demand	Anodyne	ROCK2	15	44
CO[C@@H](c1ccccc1)[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121565	EI	On-Demand	Anodyne	ROCK1	22	44
CO[C@@H](c1ccccc1)[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872121565	EI	On-Demand	Anodyne	ROCK2	15	44
C[C@@H](Cn1cncn1)NCc1nc(-c2ccncc2)cs1	ZINC000872121595	DD	On-Demand	Anodyne	HIS3	55	35
c1ccc(C2CC(NCc3nc(-c4ccncc4)cs3)C2)cc1	ZINC000872121601	DI	On-Demand	Anodyne	ROCK1	18	40
C[C@H](CCc1ccc2c(c1)OCO2)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872121605	FF	On-Demand	Anodyne	NOS2	42	33
C[C@@H](CCc1ccc2c(c1)OCO2)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872121606	FF	On-Demand	Anodyne	NOS2	42	33
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1nc(-c2ccncc2)cs1	ZINC000872121662	GI	On-Demand	Anodyne	DRD4	24	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1nc(-c2ccncc2)cs1	ZINC000872121663	GI	On-Demand	Anodyne	DRD4	24	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1nc(-c2ccncc2)cs1	ZINC000872121664	GI	On-Demand	Anodyne	DRD4	24	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1nc(-c2ccncc2)cs1	ZINC000872121665	GI	On-Demand	Anodyne	DRD4	24	43
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)cc1	ZINC000872121690	EI	On-Demand	Anodyne	ROCK1	21	45
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)cc1	ZINC000872121690	EI	On-Demand	Anodyne	ROCK2	15	45
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)cc1	ZINC000872121691	EI	On-Demand	Anodyne	ROCK1	21	45
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)cc1	ZINC000872121691	EI	On-Demand	Anodyne	ROCK2	15	45
COCCOc1ccc([C@H](C)NCc2nc(-c3ccncc3)cs2)cc1OC	ZINC000872121723	GI	On-Demand	Anodyne	ROCK1	18	40
COCCOc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)cc1OC	ZINC000872121724	GI	On-Demand	Anodyne	ROCK1	18	40
CC(C)(C)OC(=O)N1CCC[C@H](NCc2nc(-c3ccncc3)cs2)C1	ZINC000872121753	FH	On-Demand	Anodyne	CPT1A	17	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2nc(-c3ccncc3)cs2)C1	ZINC000872121754	FH	On-Demand	Anodyne	CPT1A	17	41
COc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000872121793	EI	On-Demand	Anodyne	ROCK1	19	43
Cc1ccccc1C1CC(NCc2nc(-c3ccncc3)cs2)C1	ZINC000872121802	EJ	On-Demand	Anodyne	ROCK1	16	41
COC[C@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C(F)(F)F)c1	ZINC000872121811	GJ	On-Demand	Anodyne	ROCK1	19	46
COC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C(F)(F)F)c1	ZINC000872121812	GJ	On-Demand	Anodyne	ROCK1	19	46
Fc1ccccc1C1CC(NCc2nc(-c3ccncc3)cs2)C1	ZINC000872121827	EI	On-Demand	Anodyne	ROCK1	16	41
CCCCCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc2c1=O	ZINC000872121834	IH	On-Demand	Clean	HTR1A	29	43
CCCCCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc2c1=O	ZINC000872121834	IH	On-Demand	Clean	CCKAR	32	41
c1ccc([C@@H](CC2CC2)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872121835	EJ	On-Demand	Anodyne	ROCK1	19	45
c1ccc([C@H](CC2CC2)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872121836	EJ	On-Demand	Anodyne	ROCK1	19	45
COC[C@@H](NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000872121851	CF	On-Demand	Anodyne	ROCK1	20	41
COC[C@H](NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000872121854	CF	On-Demand	Anodyne	ROCK1	20	41
C[C@H](CCc1ccc2c(c1)OCO2)NCc1ccc2oc(O)nc2c1	ZINC000872121946	EG	On-Demand	Anodyne	NOS2	82	34
C[C@@H](CCc1ccc2c(c1)OCO2)NCc1ccc2oc(O)nc2c1	ZINC000872121948	EG	On-Demand	Anodyne	NOS2	82	34
CCOC(=O)NC1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872122010	EF	On-Demand	Anodyne	SSTR5	41	35
COc1ccc(OC)c([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122037	FI	On-Demand	Anodyne	ROCK1	19	43
COc1ccc(OC)c([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122037	FI	On-Demand	Anodyne	ROCK2	15	43
CCN1CC[C@H](NCc2ccc3oc(O)nc3c2)[C@@H](C)C1	ZINC000872122106	CE	On-Demand	Anodyne	SSTR5	41	37
CCN1CC[C@H](NCc2ccc3oc(O)nc3c2)[C@H](C)C1	ZINC000872122109	CE	On-Demand	Anodyne	SSTR5	41	37
C[C@@H]1C[C@H](NCc2ccc3oc(O)nc3c2)CCN1Cc1ccccc1	ZINC000872122110	FH	On-Demand	Anodyne	SSTR5	41	37
C[C@H]1C[C@H](NCc2ccc3oc(O)nc3c2)CCN1Cc1ccccc1	ZINC000872122111	FH	On-Demand	Anodyne	SSTR5	41	37
CCOC(=O)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872122122	DE	On-Demand	Anodyne	SSTR5	70	40
CCC(CC)NCc1nc(-c2ccncc2)cs1	ZINC000872122149	CG	On-Demand	Anodyne	ROCK1	21	42
CCC(CC)NCc1nc(-c2ccncc2)cs1	ZINC000872122149	CG	On-Demand	Anodyne	ROCK2	15	42
Fc1cccc(C2CC(NCc3nc(-c4ccncc4)cs3)C2)c1	ZINC000872122245	EI	On-Demand	Anodyne	ROCK1	18	44
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	HTR1A	88	50
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	DRD2	63	50
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	DRD4	36	50
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	ADRA1D	75	42
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	HTR2A	18	43
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	ADRA1A	67	42
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	ADRA1B	59	42
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	DRD3	60	50
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	PDE3A	40	40
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	TACR1	20	43
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	HTR7	55	50
COc1ccccc1N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872122278	EI	On-Demand	Anodyne	PDE3B	43	40
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C)cc1O	ZINC000872122296	EI	On-Demand	Clean	ROCK1	18	40
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C)cc1O	ZINC000872122304	EI	On-Demand	Clean	ROCK1	18	40
CCOC(=O)C1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872122372	DF	On-Demand	Anodyne	SSTR5	44	37
C[C@@H](CCCc1cccnc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122385	EI	On-Demand	Anodyne	PTAFR	23	42
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc3oc(O)nc3c2)C1	ZINC000872122412	EF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc3oc(O)nc3c2)C1	ZINC000872122416	EF	On-Demand	Anodyne	GPR119	43	38
COC[C@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122432	EH	On-Demand	Anodyne	ROCK1	23	48
COC[C@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122432	EH	On-Demand	Anodyne	ROCK2	17	48
COC[C@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122432	EH	On-Demand	Anodyne	GPR142	58	38
COC[C@@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122433	EH	On-Demand	Anodyne	ROCK1	23	48
COC[C@@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122433	EH	On-Demand	Anodyne	ROCK2	17	48
COC[C@@H](Cc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122433	EH	On-Demand	Anodyne	GPR142	58	38
Oc1nc2cc(CN[C@@H]3CCCc4cccnc43)ccc2o1	ZINC000872122478	CG	On-Demand	Anodyne	CXCR4	60	34
Oc1nc2cc(CN[C@H]3CCCc4cccnc43)ccc2o1	ZINC000872122479	CG	On-Demand	Anodyne	CXCR4	60	34
COc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c(OC)c1	ZINC000872122490	FI	On-Demand	Anodyne	ROCK1	19	43
COc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c(OC)c1	ZINC000872122490	FI	On-Demand	Anodyne	ROCK2	15	43
Oc1nc2cc(CNC3CCN(CC(F)(F)F)CC3)ccc2o1	ZINC000872122496	EF	On-Demand	Anodyne	SSTR5	46	38
Oc1cccc2c1CCC[C@@H]2NCc1cccc2ncccc12	ZINC000872122503	DI	On-Demand	Anodyne	METG	27	41
Oc1cccc2c1CCC[C@H]2NCc1cccc2ncccc12	ZINC000872122505	DI	On-Demand	Anodyne	METG	27	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cccs1	ZINC000872122513	DJ	On-Demand	Anodyne	ROCK1	20	45
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1cccs1	ZINC000872122515	DJ	On-Demand	Anodyne	ROCK1	20	45
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(N(C)C)cc1	ZINC000872122517	FJ	On-Demand	Clean	ROCK1	18	44
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(N(C)C)cc1	ZINC000872122519	FJ	On-Demand	Clean	ROCK1	18	44
CCOc1cccc([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122538	EI	On-Demand	Anodyne	ROCK1	23	49
CCOc1cccc([C@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122538	EI	On-Demand	Anodyne	ROCK2	17	50
CCOc1cccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122540	EI	On-Demand	Anodyne	ROCK1	23	49
CCOc1cccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)c1	ZINC000872122540	EI	On-Demand	Anodyne	ROCK2	17	50
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc2c(c1)OCCO2	ZINC000872122550	FI	On-Demand	Anodyne	ROCK1	16	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc2c(c1)OCCO2	ZINC000872122552	FI	On-Demand	Anodyne	ROCK1	16	41
c1cc(CN2CCC(NCc3nc(-c4ccncc4)cs3)CC2)ccn1	ZINC000872122572	FG	On-Demand	Anodyne	DRD4	15	53
COc1ccc(N2CCC(NCc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000872122594	FG	On-Demand	Clean	SSTR5	47	38
COc1ccc(N2CCC(NCc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000872122594	FG	On-Demand	Clean	PDK1	41	37
Oc1nc2cc(CNC3CCN(CCc4ccccc4)CC3)ccc2o1	ZINC000872122627	FG	On-Demand	Anodyne	DRD4	23	44
Oc1nc2cc(CNC3CCN(CCc4ccccc4)CC3)ccc2o1	ZINC000872122627	FG	On-Demand	Anodyne	SIGMAR1	41	46
Oc1nc2cc(CNC3CCN(CCc4ccccc4)CC3)ccc2o1	ZINC000872122627	FG	On-Demand	Anodyne	SSTR5	47	39
CCN(CC)C(=O)CNC1CCN(Cc2ccccc2Br)CC1	ZINC000872122663	GF	On-Demand	Anodyne	DRD4	17	40
CCN(CC)C(=O)CNC1CCN(Cc2ccccc2Br)CC1	ZINC000872122663	GF	On-Demand	Anodyne	SIGMAR1	24	51
COc1ccc([C@@H](NCc2nc(-c3ccncc3)cs2)C(C)C)cc1	ZINC000872122692	FJ	On-Demand	Anodyne	ROCK1	21	42
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C)c1	ZINC000872122696	DJ	On-Demand	Anodyne	ROCK1	23	46
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C)c1	ZINC000872122696	DJ	On-Demand	Anodyne	ROCK2	15	46
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C)c1	ZINC000872122697	DJ	On-Demand	Anodyne	ROCK1	23	46
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1cccc(C)c1	ZINC000872122697	DJ	On-Demand	Anodyne	ROCK2	15	46
COC(=O)C1CCC(NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872122706	EG	On-Demand	Anodyne	ROCK1	26	40
COC(=O)C1CCC(NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872122706	EG	On-Demand	Anodyne	ROCK2	18	40
COC(=O)C1CCC(NCc2nc(-c3ccncc3)cs2)CC1	ZINC000872122706	EG	On-Demand	Anodyne	VCP	42	33
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C(=O)OC)cc1	ZINC000872122715	FI	On-Demand	Anodyne	ROCK1	23	48
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C(=O)OC)cc1	ZINC000872122715	FI	On-Demand	Anodyne	ROCK2	17	48
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C(=O)OC)cc1	ZINC000872122716	FI	On-Demand	Anodyne	ROCK1	23	48
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C(=O)OC)cc1	ZINC000872122716	FI	On-Demand	Anodyne	ROCK2	17	48
c1ccc([C@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872122772	DI	On-Demand	Anodyne	ROCK1	20	42
c1ccc([C@@H](NCc2nc(-c3ccncc3)cs2)C2CC2)cc1	ZINC000872122773	DI	On-Demand	Anodyne	ROCK1	20	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122778	GI	On-Demand	Anodyne	ROCK1	23	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122778	GI	On-Demand	Anodyne	ROCK2	20	43
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122778	GI	On-Demand	Anodyne	ENPP1	50	31
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122779	GI	On-Demand	Anodyne	ROCK1	23	42
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122779	GI	On-Demand	Anodyne	ROCK2	20	43
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872122779	GI	On-Demand	Anodyne	ENPP1	50	31
c1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](NCc2nc(-c4ccncc4)cs2)C3)cc1	ZINC000872122786	GI	On-Demand	Anodyne	ROCK1	17	40
c1ccc(CN2[C@H]3CC[C@H]2CC(NCc2nc(-c4ccncc4)cs2)C3)cc1	ZINC000872122788	GI	On-Demand	Anodyne	ROCK1	17	40
c1ccc(CN2[C@H]3CC[C@@H]2C[C@H](NCc2nc(-c4ccncc4)cs2)C3)cc1	ZINC000872122789	GI	On-Demand	Anodyne	ROCK1	17	40
c1cnc2c(c1)CCC[C@@H]2NCc1nc(-c2ccncc2)cs1	ZINC000872122790	DH	On-Demand	Anodyne	CXCR4	55	34
c1cnc2c(c1)CCC[C@H]2NCc1nc(-c2ccncc2)cs1	ZINC000872122791	DH	On-Demand	Anodyne	CXCR4	55	34
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	CHRM2	16	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	DRD2	17	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	DRD4	44	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	ACHE	47	44
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	CHRM3	19	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	SIGMAR1	67	50
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	CCR3	15	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC1CCN(Cc3ccccc3)CC1)C2	ZINC000872122793	FF	On-Demand	Anodyne	MCHR1	16	41
CO[C@H]1CCC[C@@H](NCc2ccc3oc(O)nc3c2)C1	ZINC000872122836	CF	On-Demand	Anodyne	SSTR5	41	35
C[C@@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122846	GG	On-Demand	Anodyne	ROCK1	25	55
C[C@@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122846	GG	On-Demand	Anodyne	ROCK2	19	47
C[C@@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122846	GG	On-Demand	Anodyne	GPR142	59	38
C[C@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122847	GG	On-Demand	Anodyne	ROCK1	25	55
C[C@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122847	GG	On-Demand	Anodyne	ROCK2	19	47
C[C@H](CC(=O)NCCc1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872122847	GG	On-Demand	Anodyne	GPR142	59	38
COC[C@@H](CC(C)C)NCc1nc(-c2ccncc2)cs1	ZINC000872122856	DG	On-Demand	Anodyne	ROCK1	19	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122896	FG	On-Demand	Anodyne	HPSE	30	40
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122896	FG	On-Demand	Anodyne	ENPP1	50	31
COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122896	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122898	FG	On-Demand	Anodyne	HPSE	30	40
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122898	FG	On-Demand	Anodyne	ENPP1	50	31
COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ccc2oc(O)nc2c1	ZINC000872122898	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
C[C@@H](CCc1ccccc1F)NCc1nc(-c2ccncc2)cs1	ZINC000872122915	EI	On-Demand	Anodyne	ROCK1	19	48
C[C@H](CCc1ccccc1F)NCc1nc(-c2ccncc2)cs1	ZINC000872122917	EI	On-Demand	Anodyne	ROCK1	19	48
N#Cc1ccc(CN2CCC(NCc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000872122924	FG	On-Demand	Mild	SSTR5	57	39
N#Cc1ccc(CN2CCC(NCc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000872122924	FG	On-Demand	Mild	MCHR1	20	47
C[C@@H](Cn1cncn1)NCCN(Cc1ccccc1)c1ccccn1	ZINC000872122966	EE	On-Demand	Anodyne	HIS3	42	37
Cc1ccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000872122989	GI	On-Demand	Anodyne	ROCK1	21	42
Cc1ccc(NC(=O)C[C@@H](C)NCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000872122990	GI	On-Demand	Anodyne	ROCK1	21	42
Oc1nc2cc(CNC3CCN(Cc4ccccn4)CC3)ccc2o1	ZINC000872123006	EF	On-Demand	Anodyne	SSTR5	56	42
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	HTR1A	75	42
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	DRD2	62	42
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	DRD4	36	40
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	ADRA1D	69	38
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	HTR2A	15	40
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	ADRA1A	60	40
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	ADRA1B	56	38
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	DRD3	58	41
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	HTR7	48	41
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	SSTR5	57	42
COc1ccccc1N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123098	FG	On-Demand	Anodyne	NPY1R	17	40
Oc1nc2cc(CNC3CCN(CCC(F)(F)F)CC3)ccc2o1	ZINC000872123114	EG	On-Demand	Anodyne	SSTR5	44	37
Oc1nc2cc(CN[C@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123116	EG	On-Demand	Anodyne	DRD4	36	40
Oc1nc2cc(CN[C@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123116	EG	On-Demand	Anodyne	SSTR5	52	40
Oc1nc2cc(CN[C@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123116	EG	On-Demand	Anodyne	CCR3	20	42
Oc1nc2cc(CN[C@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123116	EG	On-Demand	Anodyne	MCHR1	15	43
Oc1nc2cc(CN[C@@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123118	EG	On-Demand	Anodyne	DRD4	36	40
Oc1nc2cc(CN[C@@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123118	EG	On-Demand	Anodyne	SSTR5	52	40
Oc1nc2cc(CN[C@@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123118	EG	On-Demand	Anodyne	CCR3	20	42
Oc1nc2cc(CN[C@@H]3CCCN(Cc4ccccc4)C3)ccc2o1	ZINC000872123118	EG	On-Demand	Anodyne	MCHR1	15	43
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1OC(F)F	ZINC000872123131	GK	On-Demand	Anodyne	ROCK1	17	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccccc1OC(F)F	ZINC000872123132	GK	On-Demand	Anodyne	ROCK1	17	41
CCCOc1ccc([C@H](C)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872123142	FJ	On-Demand	Anodyne	ACACB	15	42
CCCOc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872123143	FJ	On-Demand	Anodyne	ACACB	15	42
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC(F)F)cc1	ZINC000872123149	GK	On-Demand	Anodyne	ROCK1	15	42
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC(F)F)cc1	ZINC000872123150	GK	On-Demand	Anodyne	ROCK1	15	42
C[C@@H](CCc1cccc(F)c1)NCc1nc(-c2ccncc2)cs1	ZINC000872123165	EI	On-Demand	Anodyne	ROCK1	22	49
C[C@@H](CCc1cccc(F)c1)NCc1nc(-c2ccncc2)cs1	ZINC000872123165	EI	On-Demand	Anodyne	ROCK2	15	49
C[C@H](CCc1cccc(F)c1)NCc1nc(-c2ccncc2)cs1	ZINC000872123166	EI	On-Demand	Anodyne	ROCK1	22	49
C[C@H](CCc1cccc(F)c1)NCc1nc(-c2ccncc2)cs1	ZINC000872123166	EI	On-Demand	Anodyne	ROCK2	15	49
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C)cc1	ZINC000872123167	DJ	On-Demand	Anodyne	ROCK1	19	47
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(C)cc1	ZINC000872123168	DJ	On-Demand	Anodyne	ROCK1	19	47
OC1CCC(NCCN(Cc2ccccc2)c2ccccn2)CC1	ZINC000872123173	EF	On-Demand	Anodyne	MERTK	19	40
COCCOc1ccc([C@H](C)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872123180	FI	On-Demand	Anodyne	ROCK1	20	45
COCCOc1ccc([C@@H](C)NCc2nc(-c3ccncc3)cs2)cc1	ZINC000872123181	FI	On-Demand	Anodyne	ROCK1	20	45
CCOc1ccc([C@@H](C)NCc2ccc3oc(O)nc3c2)cc1OCC	ZINC000872123253	FI	On-Demand	Anodyne	SSTR5	40	36
COC[C@@H](NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000872123307	CF	On-Demand	Anodyne	ROCK1	21	43
COC[C@H](NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000872123308	CF	On-Demand	Anodyne	ROCK1	21	43
C[C@@H](Cn1cncn1)NCc1ccc2oc(O)nc2c1	ZINC000872123316	CD	On-Demand	Anodyne	HIS3	69	33
Oc1nc2cc(CNC3CCN(C[C@@H]4CCCO4)CC3)ccc2o1	ZINC000872123325	EE	On-Demand	Anodyne	SSTR5	43	35
Oc1nc2cc(CNC3CCN(C[C@H]4CCCO4)CC3)ccc2o1	ZINC000872123326	EE	On-Demand	Anodyne	SSTR5	43	35
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1C	ZINC000872123353	GI	On-Demand	Anodyne	ROCK1	23	43
Cc1cccc(NC(=O)C[C@H](C)NCc2nc(-c3ccncc3)cs2)c1C	ZINC000872123353	GI	On-Demand	Anodyne	ROCK2	16	43
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(Cl)s1	ZINC000872123384	EK	On-Demand	Anodyne	ROCK1	15	40
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(Cl)s1	ZINC000872123385	EK	On-Demand	Anodyne	ROCK1	15	40
CC[C@@H](C)[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123394	CH	On-Demand	Anodyne	ROCK1	21	40
CC[C@H](C)[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123396	CH	On-Demand	Anodyne	ROCK1	21	40
C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123425	FF	On-Demand	Anodyne	SSTR5	41	36
C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123426	FF	On-Demand	Anodyne	SSTR5	41	36
C[C@H]1CN(Cc2ccccn2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123427	FF	On-Demand	Anodyne	SSTR5	41	36
C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123428	FF	On-Demand	Anodyne	SSTR5	41	36
CC(C)(C)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123458	DF	On-Demand	Anodyne	SSTR5	43	35
CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123486	FG	On-Demand	Anodyne	SSTR5	45	37
CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123486	FG	On-Demand	Anodyne	GPR119	45	38
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123487	FG	On-Demand	Anodyne	SSTR5	45	37
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123487	FG	On-Demand	Anodyne	GPR119	45	38
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	DRD4	47	51
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	ACHE	44	43
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	SIGMAR1	56	46
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	SSTR5	70	45
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	CCR3	24	54
Oc1nc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc2o1	ZINC000872123494	EG	On-Demand	Anodyne	MCHR1	37	50
C[C@@H](CCCc1cccnc1)NCc1ccc2oc(O)nc2c1	ZINC000872123512	DG	On-Demand	Anodyne	PTAFR	30	42
CC[C@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)c(OC)c1	ZINC000872123563	FI	On-Demand	Anodyne	ROCK1	20	41
CC[C@@H](NCc1nc(-c2ccncc2)cs1)c1ccc(OC)c(OC)c1	ZINC000872123564	FI	On-Demand	Anodyne	ROCK1	20	41
C[C@@H](CC(=O)N(C)c1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872123584	FH	On-Demand	Anodyne	ROCK1	23	46
C[C@@H](CC(=O)N(C)c1ccccc1)NCc1nc(-c2ccncc2)cs1	ZINC000872123584	FH	On-Demand	Anodyne	ROCK2	16	46
CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123617	GJ	On-Demand	Anodyne	ROCK1	22	42
CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123617	GJ	On-Demand	Anodyne	ROCK2	15	42
CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123617	GJ	On-Demand	Anodyne	GPR142	42	36
CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123630	GJ	On-Demand	Anodyne	ROCK1	22	42
CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123630	GJ	On-Demand	Anodyne	ROCK2	15	42
CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1nc(-c2ccncc2)cs1	ZINC000872123630	GJ	On-Demand	Anodyne	GPR142	42	36
NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1cccc3ncccc13)CCC2	ZINC000872123657	FG	On-Demand	Anodyne	HTR6	40	33
NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1cccc3ncccc13)CCC2	ZINC000872123658	FG	On-Demand	Anodyne	HTR6	40	33
CC[C@@H](NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000872123745	CH	On-Demand	Anodyne	ROCK1	21	40
CC[C@H](NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000872123746	CH	On-Demand	Anodyne	ROCK1	21	40
O=C(Oc1ccccc1)N1CCC[C@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123747	GH	On-Demand	Anodyne	NMT1	18	40
O=C(Oc1ccccc1)N1CCC[C@@H](NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123748	GH	On-Demand	Anodyne	NMT1	18	40
CC[C@H](NCc1ccc2oc(O)nc2c1)c1cc(Cl)ccc1OC	ZINC000872123774	EI	On-Demand	Anodyne	SSTR5	21	42
CC[C@@H](NCc1ccc2oc(O)nc2c1)c1cc(Cl)ccc1OC	ZINC000872123775	EI	On-Demand	Anodyne	SSTR5	21	42
Oc1nc2cc(CNC3CCN(Cc4ccncc4)CC3)ccc2o1	ZINC000872123780	EF	On-Demand	Anodyne	SSTR5	68	41
Oc1nc2cc(CNC3CCN(Cc4ccncc4)CC3)ccc2o1	ZINC000872123780	EF	On-Demand	Anodyne	PDK1	33	40
Oc1nc2cc(CNC3CCN(Cc4ccncc4)CC3)ccc2o1	ZINC000872123780	EF	On-Demand	Anodyne	MCHR1	26	49
CCN1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123781	CE	On-Demand	Anodyne	SSTR5	60	42
Oc1nc2cc(CNC3CCN(CC4CC4)CC3)ccc2o1	ZINC000872123799	DE	On-Demand	Anodyne	SSTR5	52	39
Oc1nc2cc(CN[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ccc2o1	ZINC000872123800	FH	On-Demand	Anodyne	LTA4H	18	42
Oc1nc2cc(CN[C@@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ccc2o1	ZINC000872123801	FH	On-Demand	Anodyne	LTA4H	18	42
Oc1nc2cc(CNC3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ccc2o1	ZINC000872123802	FH	On-Demand	Anodyne	LTA4H	18	42
O=C(c1ccccc1Cl)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123816	GH	On-Demand	Anodyne	NMT1	17	42
c1cnc2c(c1)CCC[C@H]2NCc1cccc2ncccc12	ZINC000872123829	CH	On-Demand	Anodyne	CXCR4	69	39
c1cnc2c(c1)CCC[C@@H]2NCc1cccc2ncccc12	ZINC000872123830	CH	On-Demand	Anodyne	CXCR4	69	39
C[C@@H](CC(=O)N1CCCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000872123860	EF	On-Demand	Anodyne	DPP7	30	42
Oc1nc2cc(CNC3CCN(CCN4CCOCC4)CC3)ccc2o1	ZINC000872123917	FD	On-Demand	Anodyne	SSTR5	48	37
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123965	FH	On-Demand	Anodyne	DRD4	41	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123965	FH	On-Demand	Anodyne	SSTR5	48	39
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123966	FH	On-Demand	Anodyne	DRD4	41	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123966	FH	On-Demand	Anodyne	SSTR5	48	39
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123967	FH	On-Demand	Anodyne	DRD4	41	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123967	FH	On-Demand	Anodyne	SSTR5	48	39
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123968	FH	On-Demand	Anodyne	DRD4	41	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc2oc(O)nc2c1	ZINC000872123968	FH	On-Demand	Anodyne	SSTR5	48	39
CC(C)(C)OC(=O)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123984	EG	On-Demand	Anodyne	SSTR5	42	37
CC(C)(C)OC(=O)N1CCC(NCc2ccc3oc(O)nc3c2)CC1	ZINC000872123984	EG	On-Demand	Anodyne	GPR119	47	39
C[C@@H](Cn1cncn1)NCc1cccc2ncccc12	ZINC000872124001	CE	On-Demand	Anodyne	HIS3	63	37
Oc1nc2cc(CNC3CCN(CCc4ccc(F)cc4)CC3)ccc2o1	ZINC000872124012	FG	On-Demand	Anodyne	SSTR5	50	35
Oc1nc2cc(CNC3CCN(CCc4ccc(F)cc4)CC3)ccc2o1	ZINC000872124012	FG	On-Demand	Anodyne	CCR3	30	45
O=C(c1ccccc1Cl)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124055	GI	On-Demand	Anodyne	CCR3	21	50
COc1ccc2c(c1)CC[C@H]2NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124059	EH	On-Demand	Anodyne	MTNR1A	17	42
C[C@@H](Cn1cncn1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124071	DD	On-Demand	Anodyne	HIS3	77	38
C[C@@H](CC(=O)N1CCCCCC1)NCc1cccc2ncccc12	ZINC000872124075	EH	On-Demand	Anodyne	HNMT	43	35
C[C@@H](CC(=O)N1CCCCCC1)NCc1cccc2ncccc12	ZINC000872124075	EH	On-Demand	Anodyne	DPP7	28	40
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	HTR1A	82	46
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	DRD2	74	53
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	DRD4	37	44
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	ADRA1D	81	42
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	ADRA1A	70	42
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	ADRA1B	63	42
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	DRD3	71	46
COc1ccccc1N1CCC(NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000872124107	GH	On-Demand	Anodyne	HTR7	50	44
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	PIK3CA	39	44
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	MTOR	75	44
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	EPHX2	18	42
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	PIK3CG	33	44
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	PIK3CB	15	43
O=C(CCCOc1ccc(F)cc1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000872124262	IJ	On-Demand	Anodyne	FLT3	15	46
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	ANPEP	20	40
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	BRS3	27	42
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	CA5A	15	40
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	MTNR1A	35	43
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	MTNR1B	32	43
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	CASP1	24	55
C[C@@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124317	EG	On-Demand	Anodyne	AMP1_PLAFQ	33	40
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	ANPEP	20	40
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	BRS3	27	42
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	CA5A	15	40
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	MTNR1A	35	43
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	MTNR1B	32	43
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	CASP1	24	55
C[C@H](CC(=O)NCCc1ccccc1)NCc1cccc2ncccc12	ZINC000872124318	EG	On-Demand	Anodyne	AMP1_PLAFQ	33	40
C[C@@H](CCc1ccsc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124336	EH	On-Demand	Anodyne	PAPA1_CARPA	30	45
CO[C@@H](c1ccccc1)[C@H](C)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124375	EH	On-Demand	Anodyne	FPR1	46	37
CO[C@@H](c1ccccc1)[C@@H](C)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124378	EH	On-Demand	Anodyne	FPR1	46	37
c1ccc(N2CCC(NCc3cccc4ncccc34)CC2)nc1	ZINC000872124391	DG	On-Demand	Anodyne	EBP	27	40
FC(F)(F)CCN1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124403	EH	On-Demand	Anodyne	HNMT	41	34
COC(=O)N1CCC(NCc2cc(F)cc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000872124467	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)NC1CC(CN[C@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872124475	FH	On-Demand	Anodyne	SSTR4	46	35
CC(C)(C)OC(=O)NC1CC(CN[C@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872124475	FH	On-Demand	Anodyne	FPR1	41	35
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872124476	FH	On-Demand	Anodyne	SSTR4	46	35
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872124476	FH	On-Demand	Anodyne	FPR1	41	35
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	DRD2	22	43
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	DRD4	30	47
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	HTR1D	55	43
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	HTR1B	43	43
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	HTR2A	19	47
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	HTR4	19	44
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	GRIN2B	22	42
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	SIGMAR1	46	52
c1ccc(CCN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124506	EI	On-Demand	Anodyne	HNMT	69	36
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872124513	IG	On-Demand	Anodyne	PIK3CA	47	42
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872124513	IG	On-Demand	Anodyne	PRNP	55	40
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872124513	IG	On-Demand	Anodyne	HDAC1	21	43
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872124513	IG	On-Demand	Anodyne	MTOR	82	39
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1ccc(-n2cccn2)nc1	ZINC000872124513	IG	On-Demand	Anodyne	DGAT1	19	41
C[C@@H](Cc1cnccn1)NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872124567	GF	On-Demand	Anodyne	GPR119	18	40
C[C@@H](Cc1cnccn1)NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872124569	GF	On-Demand	Anodyne	GPR119	18	40
c1cc(CNC2CCN(Cc3ccncc3)CC2)c2cccnc2c1	ZINC000872124580	EG	On-Demand	Anodyne	DRD4	25	42
c1cc(CNC2CCN(Cc3ccncc3)CC2)c2cccnc2c1	ZINC000872124580	EG	On-Demand	Anodyne	SIGMAR1	24	46
c1cc(CNC2CCN(Cc3ccncc3)CC2)c2cccnc2c1	ZINC000872124580	EG	On-Demand	Anodyne	SSTR5	45	38
COC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124599	CF	On-Demand	Anodyne	GRIN2B	25	40
COC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124599	CF	On-Demand	Anodyne	MAPK8	16	44
COC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124599	CF	On-Demand	Anodyne	CCR8	54	37
C[C@@H](CCc1cccnc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872124613	EG	On-Demand	Anodyne	FPR1	41	35
N#Cc1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124621	FH	On-Demand	Mild	SIGMAR1	24	43
N#Cc1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124621	FH	On-Demand	Mild	CCR3	15	49
N#Cc1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)cc1	ZINC000872124621	FH	On-Demand	Mild	MCHR1	19	42
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	DRD2	24	50
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	DRD4	27	46
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	ACHE	24	43
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	HTR2A	15	46
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	OPRM1	16	41
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	DRD3	17	40
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	HTR4	34	44
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	LTA4H	21	42
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	SIGMAR1	49	53
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	REN	41	37
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	FPR1	45	37
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)NC1CC(CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872124638	GH	On-Demand	Anodyne	BIRC2	34	40
C[C@@H](Cn1cncn1)NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872124651	GE	On-Demand	Anodyne	HIS3	48	33
C[C@@H](Cn1cncn1)NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872124653	GE	On-Demand	Anodyne	HIS3	48	33
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	HTR1A	17	42
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	HTR7	25	46
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	MMP13	40	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	CCR1	24	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	MMP2	23	44
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	SCD1	21	43
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	SFRP1	79	39
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	SCD	24	41
COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1	ZINC000872124717	JE	On-Demand	Clean	WNT3	50	39
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccccn3)CC2)C1	ZINC000872124765	FF	On-Demand	Anodyne	SSTR5	49	34
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000872124766	GG	On-Demand	Mild	SIGMAR1	27	42
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000872124766	GG	On-Demand	Mild	CCR3	19	43
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000872124766	GG	On-Demand	Mild	MCHR1	30	41
CCOC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124768	DF	On-Demand	Anodyne	GRIN2B	24	45
CCOC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124768	DF	On-Demand	Anodyne	ADAM17	42	36
CCOC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124768	DF	On-Demand	Anodyne	MAPK9	20	46
CCOC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124768	DF	On-Demand	Anodyne	MAPK8	16	46
CCOC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872124768	DF	On-Demand	Anodyne	CCR8	56	43
c1cc(CNC2CCN(CCN3CCOCC3)CC2)c2cccnc2c1	ZINC000872124784	FE	On-Demand	Anodyne	HNMT	47	35
CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2cccc3ncccc23)CC1	ZINC000872124800	GF	On-Demand	Anodyne	FDFT1	18	40
CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2cccc3ncccc23)CC1	ZINC000872124801	GF	On-Demand	Anodyne	FDFT1	18	40
C[C@@H](NCC1CC(NC(=O)OC(C)(C)C)C1)c1ccc(-n2cncn2)cc1	ZINC000872124882	FG	On-Demand	Anodyne	AMP1_PLAFQ	18	41
CC(C)(C)OC(=O)NC1CC(CNC2CCN(c3ccc(F)cc3F)CC2)C1	ZINC000872124925	GH	On-Demand	Anodyne	NPY2R	35	43
CC(C)(C)CC(=O)N1CCC(NCc2cccc3ncccc23)CC1	ZINC000872125051	EH	On-Demand	Anodyne	CCR8	67	41
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125061	GI	On-Demand	Anodyne	DRD2	21	46
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125061	GI	On-Demand	Anodyne	DRD3	16	44
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125061	GI	On-Demand	Anodyne	SIGMAR1	18	44
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125061	GI	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)NC1CC(CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125063	GI	On-Demand	Anodyne	DRD2	21	46
CC(C)(C)OC(=O)NC1CC(CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125063	GI	On-Demand	Anodyne	DRD3	16	44
CC(C)(C)OC(=O)NC1CC(CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125063	GI	On-Demand	Anodyne	SIGMAR1	18	44
CC(C)(C)OC(=O)NC1CC(CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872125063	GI	On-Demand	Anodyne	FPR1	44	36
C[C@@H](Cc1ccncc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125076	DF	On-Demand	Anodyne	FPR1	43	36
C[C@@H](Cn1cncn1)NCc1cc(F)cc(NC(=O)OC(C)(C)C)c1	ZINC000872125083	EF	On-Demand	Anodyne	HIS3	69	33
c1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)nc1	ZINC000872125086	EG	On-Demand	Anodyne	DRD4	17	46
c1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)nc1	ZINC000872125086	EG	On-Demand	Anodyne	SIGMAR1	16	42
c1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)nc1	ZINC000872125086	EG	On-Demand	Anodyne	HNMT	46	34
c1ccc(CN2CCC(NCc3cccc4ncccc34)CC2)nc1	ZINC000872125086	EG	On-Demand	Anodyne	SCN5A	52	42
c1ccc(N2CC[C@H](NCc3cccc4ncccc34)C2)cc1	ZINC000872125122	DH	On-Demand	Anodyne	METAP1	41	35
c1ccc(N2CC[C@@H](NCc3cccc4ncccc34)C2)cc1	ZINC000872125123	DH	On-Demand	Anodyne	METAP1	41	35
c1cc(CNC2CCN(CC3CC3)CC2)c2cccnc2c1	ZINC000872125140	CG	On-Demand	Anodyne	SIGMAR1	15	52
C[C@@H](CCCc1cccnc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125146	EH	On-Demand	Anodyne	PTAFR	32	43
COC[C@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125272	EG	On-Demand	Anodyne	PGC	53	35
COC[C@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125272	EG	On-Demand	Anodyne	PAPA1_CARPA	37	44
COC[C@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125272	EG	On-Demand	Anodyne	REN	59	41
COC[C@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125272	EG	On-Demand	Anodyne	FPR1	51	40
COC[C@@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125273	EG	On-Demand	Anodyne	PGC	53	35
COC[C@@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125273	EG	On-Demand	Anodyne	PAPA1_CARPA	37	44
COC[C@@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125273	EG	On-Demand	Anodyne	REN	59	41
COC[C@@H](Cc1ccccc1)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872125273	EG	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872125304	FF	On-Demand	Anodyne	ACHE	22	42
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872125304	FF	On-Demand	Anodyne	SSTR5	59	38
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872125304	FF	On-Demand	Anodyne	MCHR1	35	40
CC(C)(C)OC(=O)NC1CC(CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872125304	FF	On-Demand	Anodyne	CACNA1I	42	35
COC[C@H](NC[C@H]1C[C@H](O)C1)c1cccc(Cl)c1	ZINC000872125381	CE	On-Demand	Anodyne	MAN1B1	45	33
COC[C@@H](NC[C@H]1C[C@H](O)C1)c1cccc(Cl)c1	ZINC000872125382	CE	On-Demand	Anodyne	MAN1B1	45	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H]1C[C@H](O)C1	ZINC000872125451	CF	On-Demand	Anodyne	SLC16A1	53	36
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H]1C[C@H](O)C1	ZINC000872125452	CF	On-Demand	Anodyne	SLC16A1	53	36
O[C@H]1C[C@H](CN[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000872125486	BF	On-Demand	Anodyne	GRIA4	15	43
O[C@H]1C[C@H](CN[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000872125487	BF	On-Demand	Anodyne	GRIA4	15	43
O[C@H]1C[C@H](CN[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000872125488	BF	On-Demand	Anodyne	GRIA4	15	43
O[C@H]1C[C@H](CN[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000872125489	BF	On-Demand	Anodyne	GRIA4	15	43
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	TGM1	23	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	EPHX2	35	46
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	TGM2	94	43
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	F13A1	103	43
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	MERTK	30	41
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872125542	GD	On-Demand	Anodyne	NAMPT	34	41
O=C(N1CC[C@@H](NC[C@H]2C[C@H](O)C2)c2ccccc2C1)C(F)(F)F	ZINC000872125587	EE	On-Demand	Anodyne	RBP4	71	37
O=C(N1CC[C@H](NC[C@H]2C[C@H](O)C2)c2ccccc2C1)C(F)(F)F	ZINC000872125588	EE	On-Demand	Anodyne	RBP4	71	37
C[C@H](NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1ccccn1	ZINC000872125665	GH	On-Demand	Anodyne	GPR119	26	41
C[C@@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125686	CD	On-Demand	Anodyne	ANPEP	18	41
C[C@@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125686	CD	On-Demand	Anodyne	MMP3	19	40
C[C@@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125686	CD	On-Demand	Anodyne	AMP1_PLAFQ	20	41
C[C@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125687	CD	On-Demand	Anodyne	ANPEP	18	41
C[C@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125687	CD	On-Demand	Anodyne	MMP3	19	40
C[C@H](CC(=O)NCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872125687	CD	On-Demand	Anodyne	AMP1_PLAFQ	20	41
C[C@H]1C[C@H](NC[C@H]2C[C@H](O)C2)CCN1Cc1ccccc1	ZINC000872125714	CE	On-Demand	Anodyne	SIGMAR1	32	42
C[C@@H]1C[C@H](NC[C@H]2C[C@H](O)C2)CCN1Cc1ccccc1	ZINC000872125715	CE	On-Demand	Anodyne	SIGMAR1	32	42
O[C@H]1C[C@H](CN[C@@H](CC2CC2)c2ccccc2)C1	ZINC000872125749	BF	On-Demand	Anodyne	MAN1B1	65	36
O[C@H]1C[C@H](CN[C@H](CC2CC2)c2ccccc2)C1	ZINC000872125750	BF	On-Demand	Anodyne	MAN1B1	65	36
C[C@@H](NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1ccccn1	ZINC000872125823	GH	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNC1CCN(C(N)=O)CC1	ZINC000872125845	GE	On-Demand	Anodyne	PREP	19	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNC1CCN(C(N)=O)CC1	ZINC000872125847	GE	On-Demand	Anodyne	PREP	19	40
COc1ccc2c(c1)CC[C@H]2NC[C@H]1C[C@H](O)C1	ZINC000872125867	BE	On-Demand	Anodyne	PPARD	17	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126068	CE	On-Demand	Anodyne	DRD2	15	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126068	CE	On-Demand	Anodyne	DRD4	41	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126068	CE	On-Demand	Anodyne	ACHE	41	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126068	CE	On-Demand	Anodyne	SIGMAR1	51	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126068	CE	On-Demand	Anodyne	SLC18A3	22	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126070	CE	On-Demand	Anodyne	DRD2	15	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126070	CE	On-Demand	Anodyne	DRD4	41	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126070	CE	On-Demand	Anodyne	ACHE	41	46
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126070	CE	On-Demand	Anodyne	SIGMAR1	51	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126070	CE	On-Demand	Anodyne	SLC18A3	22	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126071	CE	On-Demand	Anodyne	DRD2	15	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126071	CE	On-Demand	Anodyne	DRD4	41	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126071	CE	On-Demand	Anodyne	ACHE	41	46
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126071	CE	On-Demand	Anodyne	SIGMAR1	51	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126071	CE	On-Demand	Anodyne	SLC18A3	22	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126073	CE	On-Demand	Anodyne	DRD2	15	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126073	CE	On-Demand	Anodyne	DRD4	41	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126073	CE	On-Demand	Anodyne	ACHE	41	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126073	CE	On-Demand	Anodyne	SIGMAR1	51	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872126073	CE	On-Demand	Anodyne	SLC18A3	22	41
O[C@H]1C[C@H](CN[C@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872126128	CD	On-Demand	Anodyne	DRD5	16	40
O[C@H]1C[C@H](CN[C@@H]2Cc3[nH]c4ccccc4c3C2)C1	ZINC000872126131	CD	On-Demand	Anodyne	DRD5	16	40
O[C@H]1C[C@H](CN[C@@H](Cc2ccccc2F)c2ccccc2)C1	ZINC000872126148	CG	On-Demand	Anodyne	MAN1B1	64	38
O[C@H]1C[C@H](CN[C@H](Cc2ccccc2F)c2ccccc2)C1	ZINC000872126149	CG	On-Demand	Anodyne	MAN1B1	64	38
CCOc1cccc([C@H](C)NC[C@H]2C[C@H](O)C2)c1	ZINC000872126270	BF	On-Demand	Anodyne	PDS	43	40
CCOc1cccc([C@@H](C)NC[C@H]2C[C@H](O)C2)c1	ZINC000872126271	BF	On-Demand	Anodyne	PDS	43	40
C[C@@H](CCc1ccccc1[N+](=O)[O-])NC[C@H]1C[C@H](O)C1	ZINC000872126345	CE	On-Demand	Bother	COLA	121	40
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@H]1C[C@H](O)C1	ZINC000872126346	CE	On-Demand	Bother	COLA	121	40
O[C@H]1C[C@H](CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)C1	ZINC000872126357	DF	On-Demand	Anodyne	NQO2	17	40
O[C@H]1C[C@H](CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)C1	ZINC000872126358	DF	On-Demand	Anodyne	NQO2	17	40
O[C@H]1C[C@H](CN[C@@H](CCc2ccccc2)c2ccccc2)C1	ZINC000872126368	CH	On-Demand	Anodyne	MAN1B1	65	40
O=[N+]([O-])c1ccccc1C[C@H](NC[C@H]1C[C@H](O)C1)C1CC1	ZINC000872126400	CE	On-Demand	Bother	COLA	108	37
O=[N+]([O-])c1ccccc1C[C@@H](NC[C@H]1C[C@H](O)C1)C1CC1	ZINC000872126401	CE	On-Demand	Bother	COLA	108	37
O[C@H]1C[C@H](CN[C@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000872126425	CF	On-Demand	Anodyne	MAN1B1	51	32
O[C@H]1C[C@H](CN[C@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000872126426	CF	On-Demand	Anodyne	MAN1B1	51	32
O[C@H]1C[C@H](CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000872126427	CF	On-Demand	Anodyne	MAN1B1	51	32
O[C@H]1C[C@H](CN[C@@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000872126428	CF	On-Demand	Anodyne	MAN1B1	51	32
O=[N+]([O-])c1cccc([C@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126463	DG	On-Demand	Bother	CACNA1C	41	38
O=[N+]([O-])c1cccc([C@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126463	DG	On-Demand	Bother	CACNA1D	64	37
O=[N+]([O-])c1cccc([C@@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126464	DG	On-Demand	Bother	CACNA1C	41	38
O=[N+]([O-])c1cccc([C@@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126464	DG	On-Demand	Bother	CACNA1D	64	37
O[C@H]1C[C@H](CN[C@H](CCc2ccccc2)c2ccccc2)C1	ZINC000872126515	CH	On-Demand	Anodyne	MAN1B1	65	40
O[C@H]1C[C@H](CNC2CCN(Cc3ccccn3)CC2)C1	ZINC000872126534	CD	On-Demand	Anodyne	SIGMAR1	15	41
Cc1ccc(NC(=O)C[C@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126549	DF	On-Demand	Anodyne	SLC1A1	40	37
Cc1ccc(NC(=O)C[C@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126549	DF	On-Demand	Anodyne	SLC1A3	46	37
Cc1ccc(NC(=O)C[C@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126549	DF	On-Demand	Anodyne	SLC1A2	52	37
Cc1ccc(NC(=O)C[C@@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126550	DF	On-Demand	Anodyne	SLC1A1	40	37
Cc1ccc(NC(=O)C[C@@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126550	DF	On-Demand	Anodyne	SLC1A3	46	37
Cc1ccc(NC(=O)C[C@@H](C)NC[C@H]2C[C@H](O)C2)cc1Cl	ZINC000872126550	DF	On-Demand	Anodyne	SLC1A2	52	37
COc1ccc([C@H](Cc2ccncc2)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126564	DF	On-Demand	Anodyne	PDE4A	25	46
COc1ccc([C@@H](Cc2ccncc2)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126565	DF	On-Demand	Anodyne	PDE4A	25	46
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	HTR1D	37	42
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	HTR1B	29	43
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	MPO	27	43
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	CCKBR	56	35
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	GHSR	40	35
C[C@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126584	CF	On-Demand	Anodyne	MMP9	17	40
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	HTR1D	37	42
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	HTR1B	29	43
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	MPO	27	43
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	CCKBR	56	35
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	GHSR	40	35
C[C@@H](CCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000872126585	CF	On-Demand	Anodyne	MMP9	17	40
O[C@H]1C[C@H](CNC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000872126602	DF	On-Demand	Anodyne	DRD4	44	45
O[C@H]1C[C@H](CNC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000872126602	DF	On-Demand	Anodyne	SIGMAR1	40	51
O[C@H]1C[C@H](CNC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000872126602	DF	On-Demand	Anodyne	CXCR3	29	55
O[C@H]1C[C@H](CNC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000872126602	DF	On-Demand	Anodyne	MCHR1	35	44
O[C@H]1C[C@H](CNC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000872126602	DF	On-Demand	Anodyne	CACNA1I	15	40
COCCOc1ccc([C@@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126617	CE	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126617	CE	On-Demand	Anodyne	ACACB	19	40
COCCOc1ccc([C@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126618	CE	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126618	CE	On-Demand	Anodyne	ACACB	19	40
O[C@H]1C[C@H](CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872126623	CD	On-Demand	Anodyne	ACHE	17	42
O[C@H]1C[C@H](CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872126623	CD	On-Demand	Anodyne	SIGMAR1	28	43
O[C@H]1C[C@H](CNC2CCN(Cc3ccncc3)CC2)C1	ZINC000872126623	CD	On-Demand	Anodyne	SSTR5	43	33
CCCCCOc1ccc([C@@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126630	CH	On-Demand	Anodyne	ACACB	15	41
CCCCCOc1ccc([C@@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126630	CH	On-Demand	Anodyne	PLA2G4B	77	36
CCCCCOc1ccc([C@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126631	CH	On-Demand	Anodyne	ACACB	15	41
CCCCCOc1ccc([C@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872126631	CH	On-Demand	Anodyne	PLA2G4B	77	36
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H](NC[C@H]3C[C@H](O)C3)c3ccccc3O2)C1	ZINC000872126701	GG	On-Demand	Anodyne	GHRHR	46	30
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H](NC[C@H]3C[C@H](O)C3)c3ccccc3O2)C1	ZINC000872126702	GG	On-Demand	Anodyne	GHRHR	46	30
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H](NC[C@H]3C[C@H](O)C3)c3ccccc3O2)C1	ZINC000872126703	GG	On-Demand	Anodyne	GHRHR	46	30
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H](NC[C@H]3C[C@H](O)C3)c3ccccc3O2)C1	ZINC000872126704	GG	On-Demand	Anodyne	GHRHR	46	30
COc1cccc(C[C@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126752	DG	On-Demand	Anodyne	MAN1B1	49	37
COc1cccc(C[C@@H](NC[C@H]2C[C@H](O)C2)c2ccccc2)c1	ZINC000872126753	DG	On-Demand	Anodyne	MAN1B1	49	37
C[C@@H](NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1cnccn1	ZINC000872126801	GF	On-Demand	Anodyne	GPR119	21	41
C[C@H](NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1cnccn1	ZINC000872126807	GF	On-Demand	Anodyne	GPR119	21	41
O=C(c1ccccc1Cl)N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872126824	DE	On-Demand	Anodyne	L3MBTL3	55	43
O[C@H]1C[C@H](CN[C@H](c2ccccc2)c2cccc(Br)c2)C1	ZINC000872126893	EH	On-Demand	Anodyne	MAN1B1	48	39
O[C@H]1C[C@H](CN[C@@H](c2ccccc2)c2cccc(Br)c2)C1	ZINC000872126894	EH	On-Demand	Anodyne	MAN1B1	48	39
O[C@H]1C[C@H](CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1	ZINC000872126918	DH	On-Demand	Anodyne	MAN1B1	41	44
O[C@H]1C[C@H](CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1	ZINC000872126919	DH	On-Demand	Anodyne	MAN1B1	41	44
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	DRD2	18	44
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	DRD4	24	48
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	ACHE	18	51
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	HTR2A	15	55
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	OPRM1	15	45
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	SLC18A2	43	36
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	GRIN2B	42	43
O[C@H]1C[C@H](CNC2CCN(CCc3ccccc3)CC2)C1	ZINC000872126952	CE	On-Demand	Anodyne	SIGMAR1	71	57
C[C@H](CCc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000872126958	DG	On-Demand	Anodyne	PTGFR	33	42
C[C@@H](CCc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000872126959	DG	On-Demand	Anodyne	PTGFR	33	42
O[C@H]1C[C@H](CNC2CCN(Cc3ccccc3Br)CC2)C1	ZINC000872126999	FF	On-Demand	Anodyne	SIGMAR1	18	49
N#Cc1ccc(CN2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872127050	CD	On-Demand	Mild	SIGMAR1	32	48
N#Cc1ccc(CN2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000872127050	CD	On-Demand	Mild	MCHR1	15	40
O[C@H]1C[C@H](CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1	ZINC000872127066	EH	On-Demand	Anodyne	MAN1B1	52	34
O[C@H]1C[C@H](CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1	ZINC000872127067	EH	On-Demand	Anodyne	MAN1B1	52	34
O[C@H]1C[C@H](CNC2CCN(Cc3c(F)cccc3Cl)CC2)C1	ZINC000872127094	EF	On-Demand	Anodyne	SIGMAR1	17	45
Cc1cccc(NC(=O)C[C@H](C)NC[C@H]2C[C@H](O)C2)c1	ZINC000872127098	CE	On-Demand	Anodyne	KCNK3	54	37
Cc1cccc(NC(=O)C[C@H](C)NC[C@H]2C[C@H](O)C2)c1	ZINC000872127098	CE	On-Demand	Anodyne	KCNK9	46	37
O[C@H]1C[C@H](CNC2CCN(Cc3ccccc3Cl)CC2)C1	ZINC000872127160	DF	On-Demand	Anodyne	DRD4	18	43
O[C@H]1C[C@H](CNC2CCN(Cc3ccccc3Cl)CC2)C1	ZINC000872127160	DF	On-Demand	Anodyne	SIGMAR1	28	50
O[C@H]1C[C@H](CNC2CCN(CCc3ccc(F)cc3)CC2)C1	ZINC000872127162	DE	On-Demand	Anodyne	HTR2A	17	50
O[C@H]1C[C@H](CNC2CCN(CCc3ccc(F)cc3)CC2)C1	ZINC000872127162	DE	On-Demand	Anodyne	SIGMAR1	26	51
O[C@H]1C[C@H](CNC2CCN(CCc3ccc(F)cc3)CC2)C1	ZINC000872127162	DE	On-Demand	Anodyne	CCR3	48	42
O[C@H]1C[C@H](CNC2CCN(CCc3ccc(F)cc3)CC2)C1	ZINC000872127162	DE	On-Demand	Anodyne	CACNA1G	18	43
COc1ccc([C@H](Cc2ccccc2)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872127211	DG	On-Demand	Anodyne	MAN1B1	47	36
COc1ccc([C@@H](Cc2ccccc2)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872127212	DG	On-Demand	Anodyne	MAN1B1	47	36
Cc1ccncc1[C@@H](C)NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872127219	GH	On-Demand	Anodyne	GPR119	26	41
Cc1ccncc1[C@@H](C)NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872127220	GH	On-Demand	Anodyne	GPR119	26	41
Cc1ccncc1[C@H](C)NC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872127221	GH	On-Demand	Anodyne	GPR119	26	41
Cc1ccncc1[C@H](C)NC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1	ZINC000872127222	GH	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@@H](c2ccccc2)[C@H](NC[C@H]2C[C@H](O)C2)C1	ZINC000872127337	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](NC[C@H]2C[C@H](O)C2)C1	ZINC000872127338	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@@H](NC[C@H]2C[C@H](O)C2)C1	ZINC000872127339	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](c2ccccc2)[C@@H](NC[C@H]2C[C@H](O)C2)C1	ZINC000872127340	FG	On-Demand	Anodyne	GPR119	39	42
NC(=O)C1CCN(C[C@@H](NC[C@H]2C[C@H](O)C2)c2ccc(Cl)cc2)CC1	ZINC000872127369	FD	On-Demand	Anodyne	AKT3	50	36
NC(=O)C1CCN(C[C@H](NC[C@H]2C[C@H](O)C2)c2ccc(Cl)cc2)CC1	ZINC000872127370	FD	On-Demand	Anodyne	AKT3	50	36
O[C@H]1C[C@H](CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127387	DF	On-Demand	Anodyne	DRD2	16	40
O[C@H]1C[C@H](CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127387	DF	On-Demand	Anodyne	KCNH2	17	40
O[C@H]1C[C@H](CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127387	DF	On-Demand	Anodyne	LTA4H	16	48
O[C@H]1C[C@H](CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127387	DF	On-Demand	Anodyne	SIGMAR1	22	49
O[C@H]1C[C@H](CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127387	DF	On-Demand	Anodyne	ACHP_LYMST	15	42
O[C@H]1C[C@H](CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127388	DF	On-Demand	Anodyne	DRD2	16	40
O[C@H]1C[C@H](CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127388	DF	On-Demand	Anodyne	KCNH2	17	40
O[C@H]1C[C@H](CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127388	DF	On-Demand	Anodyne	LTA4H	16	48
O[C@H]1C[C@H](CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127388	DF	On-Demand	Anodyne	SIGMAR1	22	49
O[C@H]1C[C@H](CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127388	DF	On-Demand	Anodyne	ACHP_LYMST	15	42
O[C@H]1C[C@H](CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127389	DF	On-Demand	Anodyne	DRD2	16	40
O[C@H]1C[C@H](CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127389	DF	On-Demand	Anodyne	KCNH2	17	40
O[C@H]1C[C@H](CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127389	DF	On-Demand	Anodyne	LTA4H	16	48
O[C@H]1C[C@H](CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127389	DF	On-Demand	Anodyne	SIGMAR1	22	49
O[C@H]1C[C@H](CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000872127389	DF	On-Demand	Anodyne	ACHP_LYMST	15	42
O[C@H]1C[C@H](CN[C@@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1	ZINC000872127394	DH	On-Demand	Anodyne	SLC6A3	15	40
O[C@H]1C[C@H](CN[C@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1	ZINC000872127395	DH	On-Demand	Anodyne	SLC6A3	15	40
O[C@H]1C[C@H](CN[C@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1	ZINC000872127396	DH	On-Demand	Anodyne	SLC6A3	15	40
O[C@H]1C[C@H](CN[C@@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1	ZINC000872127397	DH	On-Demand	Anodyne	SLC6A3	15	40
NS(=O)(=O)c1ccc2c(c1)[C@H](NC[C@H]1C[C@H](O)C1)CCC2	ZINC000872127414	DD	On-Demand	Anodyne	CA7	27	42
NS(=O)(=O)c1ccc2c(c1)[C@@H](NC[C@H]1C[C@H](O)C1)CCC2	ZINC000872127415	DD	On-Demand	Anodyne	CA7	27	42
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	HTR1A	92	51
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	DRD2	74	51
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	DRD4	37	45
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	ADRA1D	82	43
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	HTR2A	20	41
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	ADRA1A	71	43
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	ADRA1B	65	43
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	DRD3	67	47
COc1ccccc1N1CCC(NC[C@H]2C[C@H](O)C2)CC1	ZINC000872127441	CE	On-Demand	Anodyne	HTR7	52	45
C[C@@H](CCCc1cccnc1)NC[C@H]1C[C@H](O)C1	ZINC000872127461	BE	On-Demand	Anodyne	PTAFR	34	45
O[C@H]1C[C@H](CN[C@@H]2CCN(Cc3ccccc3)[C@H]3CCC[C@H]32)C1	ZINC000872127471	DF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1C[C@H](CN[C@@H]2CCN(Cc3ccccc3)[C@@H]3CCC[C@H]23)C1	ZINC000872127472	DF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1C[C@H](CN[C@@H]2CCN(Cc3ccccc3)[C@H]3CCC[C@@H]32)C1	ZINC000872127473	DF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1C[C@H](CN[C@@H]2CCN(Cc3ccccc3)[C@@H]3CCC[C@@H]23)C1	ZINC000872127474	DF	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127489	DE	On-Demand	Anodyne	GPR119	37	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127490	DE	On-Demand	Anodyne	GPR119	37	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127491	DE	On-Demand	Anodyne	GPR119	37	42
C[C@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127492	DE	On-Demand	Anodyne	GPR119	37	42
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CELA1	23	43
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CTSD	27	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	PGC	62	38
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CMA1	33	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CTRA_BOVIN	19	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	PAPA1_CARPA	57	45
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CTSK	18	49
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CTSL	24	45
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	REN	86	45
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	REN1	23	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	CAPN1	33	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000872127540	EF	On-Demand	Anodyne	FPR1	62	45
O[C@H]1C[C@H](CNC2CCC(c3cccc(C(F)(F)F)c3)CC2)C1	ZINC000872127559	EI	On-Demand	Anodyne	CCR2	32	40
O[C@H]1C[C@H](CN[C@H](Cc2ccccc2)c2ccccc2)C1	ZINC000872127578	CG	On-Demand	Anodyne	MAN1B1	67	42
O[C@H]1C[C@H](CN[C@@H](Cc2ccccc2)c2ccccc2)C1	ZINC000872127579	CG	On-Demand	Anodyne	MAN1B1	67	42
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127580	DF	On-Demand	Bother	COLA	40	32
O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127581	DF	On-Demand	Bother	COLA	40	32
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127582	DF	On-Demand	Bother	COLA	40	32
O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1NC[C@H]1C[C@H](O)C1	ZINC000872127583	DF	On-Demand	Bother	COLA	40	32
O[C@H]1C[C@H](CN[C@@H](CCc2ccccc2)Cc2ccccc2)C1	ZINC000872127586	DH	On-Demand	Anodyne	MME	42	36
O[C@H]1C[C@H](CN[C@H](CCc2ccccc2)Cc2ccccc2)C1	ZINC000872127587	DH	On-Demand	Anodyne	MME	42	36
O[C@H]1C[C@H](CN[C@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000872127617	CG	On-Demand	Anodyne	SLC6A3	24	53
O[C@H]1C[C@H](CN[C@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000872127617	CG	On-Demand	Anodyne	MAN1B1	56	37
O[C@H]1C[C@H](CN[C@@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000872127618	CG	On-Demand	Anodyne	SLC6A3	24	53
O[C@H]1C[C@H](CN[C@@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000872127618	CG	On-Demand	Anodyne	MAN1B1	56	37
O[C@H]1C[C@H](CN[C@H](CC2CCC2)c2ccccc2)C1	ZINC000872127634	CG	On-Demand	Anodyne	MAN1B1	63	35
O[C@H]1C[C@H](CN[C@@H](CC2CCC2)c2ccccc2)C1	ZINC000872127635	CG	On-Demand	Anodyne	MAN1B1	63	35
CC[C@@H](C)c1ccc([C@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872127653	CH	On-Demand	Anodyne	SCN2A	20	43
CC[C@@H](C)c1ccc([C@@H](C)NC[C@H]2C[C@H](O)C2)cc1	ZINC000872127654	CH	On-Demand	Anodyne	SCN2A	20	43
COc1cc2c(cc1OC)[C@@H](NC[C@H]1C[C@H](O)C1)CCCC2	ZINC000872127695	DF	On-Demand	Anodyne	SLC18A2	47	35
C[C@@H]1[C@@H](NC[C@H]2C[C@H](O)C2)CCCN1Cc1ccccc1	ZINC000872127784	CE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1[C@@H](NC[C@H]2C[C@H](O)C2)CCCN1Cc1ccccc1	ZINC000872127785	CE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1[C@H](NC[C@H]2C[C@H](O)C2)CCCN1Cc1ccccc1	ZINC000872127786	CE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H](Cc1ccc(F)cc1Cl)NC[C@H]1C[C@H](O)C1	ZINC000872127799	CF	On-Demand	Anodyne	P2RX7	41	38
COc1cccc(C[C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127977	EF	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(C[C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127977	EF	On-Demand	Anodyne	ADRB1	16	41
COc1cccc(C[C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127978	EF	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(C[C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127978	EF	On-Demand	Anodyne	ADRB1	16	41
COc1cccc(C[C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127979	EF	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(C[C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127979	EF	On-Demand	Anodyne	ADRB1	16	41
COc1cccc(C[C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127980	EF	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(C[C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000872127980	EF	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNC1CCN(CCC(F)(F)F)CC1)Cc1cccc(Cl)c1	ZINC000872127993	FG	On-Demand	Anodyne	SIGMAR1	15	45
O[C@@H](CNC1CCN(CCC(F)(F)F)CC1)Cc1cccc(Cl)c1	ZINC000872127994	FG	On-Demand	Anodyne	SIGMAR1	15	45
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872127999	GH	On-Demand	Anodyne	ADRB2	16	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872127999	GH	On-Demand	Anodyne	ADRB1	25	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872127999	GH	On-Demand	Anodyne	ADRB3	25	44
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128000	GH	On-Demand	Anodyne	ADRB2	16	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128000	GH	On-Demand	Anodyne	ADRB1	25	42
COc1cc(NC(C)=O)ccc1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128000	GH	On-Demand	Anodyne	ADRB3	25	44
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128001	GH	On-Demand	Anodyne	ADRB2	16	42
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128001	GH	On-Demand	Anodyne	ADRB1	25	42
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128001	GH	On-Demand	Anodyne	ADRB3	25	44
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128002	GH	On-Demand	Anodyne	ADRB2	16	42
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128002	GH	On-Demand	Anodyne	ADRB1	25	42
COc1cc(NC(C)=O)ccc1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128002	GH	On-Demand	Anodyne	ADRB3	25	44
COC1(C[C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128003	DG	On-Demand	Anodyne	ADRB2	19	40
COC1(C[C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128003	DG	On-Demand	Anodyne	ADRB1	20	40
COC1(C[C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128003	DG	On-Demand	Anodyne	ADRB3	24	40
COC1(C[C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128004	DG	On-Demand	Anodyne	ADRB2	19	40
COC1(C[C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128004	DG	On-Demand	Anodyne	ADRB1	20	40
COC1(C[C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128004	DG	On-Demand	Anodyne	ADRB3	24	40
COC1(C[C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128005	DG	On-Demand	Anodyne	ADRB2	19	40
COC1(C[C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128005	DG	On-Demand	Anodyne	ADRB1	20	40
COC1(C[C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128005	DG	On-Demand	Anodyne	ADRB3	24	40
COC1(C[C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128006	DG	On-Demand	Anodyne	ADRB2	19	40
COC1(C[C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128006	DG	On-Demand	Anodyne	ADRB1	20	40
COC1(C[C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)CCC1	ZINC000872128006	DG	On-Demand	Anodyne	ADRB3	24	40
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872128013	DG	On-Demand	Anodyne	ADRB3	15	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1F	ZINC000872128014	DG	On-Demand	Anodyne	ADRB3	15	42
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128037	DE	On-Demand	Anodyne	ADRB1	21	41
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128037	DE	On-Demand	Anodyne	MAOB	18	41
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128037	DE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128038	DE	On-Demand	Anodyne	ADRB1	21	41
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128038	DE	On-Demand	Anodyne	MAOB	18	41
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128038	DE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128039	DE	On-Demand	Anodyne	ADRB1	21	41
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128039	DE	On-Demand	Anodyne	MAOB	18	41
COC(=O)[C@@H]1C[C@@H]1[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128039	DE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128040	DE	On-Demand	Anodyne	ADRB1	21	41
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128040	DE	On-Demand	Anodyne	MAOB	18	41
COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128040	DE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)N1CCC(N[C@@H](C)c2ccccc2[N+](=O)[O-])CC1	ZINC000872128072	DE	On-Demand	Bother	COLA	64	32
C=CCC[C@@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872128085	BH	On-Demand	Mild	COLA	55	32
C=CCC[C@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872128086	BH	On-Demand	Mild	COLA	55	32
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C(C)(C)C(F)F	ZINC000872128150	DH	On-Demand	Anodyne	ADRB3	18	41
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C(C)(C)C(F)F	ZINC000872128151	DH	On-Demand	Anodyne	ADRB3	18	41
C[C@H](N[C@H](C)CCC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000872128253	CH	On-Demand	Bother	COLA	105	40
COC(=O)C[C@@H]1CC[C@@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000872128441	DG	On-Demand	Bother	COLA	44	31
COC(=O)C[C@@H]1CC[C@@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000872128443	DG	On-Demand	Bother	COLA	44	31
C[C@@H](CCc1cccnc1)N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C1	ZINC000872128444	DG	On-Demand	Anodyne	FKBP1A	23	40
C[C@@H](CCc1cccnc1)N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C1	ZINC000872128444	DG	On-Demand	Anodyne	C3AR1	40	40
C[C@@H](CCc1cccnc1)NC1CC(C(=O)OC(C)(C)C)C1	ZINC000872128449	DG	On-Demand	Anodyne	FKBP1A	23	40
C[C@@H](CCc1cccnc1)NC1CC(C(=O)OC(C)(C)C)C1	ZINC000872128449	DG	On-Demand	Anodyne	C3AR1	40	40
COc1ccccc1NC(=O)C[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128483	GG	On-Demand	Anodyne	ADRB2	31	44
COc1ccccc1NC(=O)C[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128483	GG	On-Demand	Anodyne	ADRB1	27	44
COc1ccccc1NC(=O)C[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128483	GG	On-Demand	Anodyne	ADRB3	32	46
COc1ccccc1NC(=O)C[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128484	GG	On-Demand	Anodyne	ADRB2	31	44
COc1ccccc1NC(=O)C[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128484	GG	On-Demand	Anodyne	ADRB1	27	44
COc1ccccc1NC(=O)C[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128484	GG	On-Demand	Anodyne	ADRB3	32	46
COc1ccccc1NC(=O)C[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128485	GG	On-Demand	Anodyne	ADRB2	31	44
COc1ccccc1NC(=O)C[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128485	GG	On-Demand	Anodyne	ADRB1	27	44
COc1ccccc1NC(=O)C[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128485	GG	On-Demand	Anodyne	ADRB3	32	46
COc1ccccc1NC(=O)C[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128486	GG	On-Demand	Anodyne	ADRB2	31	44
COc1ccccc1NC(=O)C[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128486	GG	On-Demand	Anodyne	ADRB1	27	44
COc1ccccc1NC(=O)C[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128486	GG	On-Demand	Anodyne	ADRB3	32	46
C[C@@H](Cn1cncn1)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2	ZINC000872128499	EE	On-Demand	Anodyne	HIS3	58	32
C[C@@H](Cn1cncn1)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2	ZINC000872128502	EE	On-Demand	Anodyne	HIS3	58	32
COc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128527	EG	On-Demand	Anodyne	ADRB2	26	53
COc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128527	EG	On-Demand	Anodyne	ADRB1	19	53
COc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128527	EG	On-Demand	Anodyne	ADRB3	27	56
COc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128528	EG	On-Demand	Anodyne	ADRB2	26	53
COc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128528	EG	On-Demand	Anodyne	ADRB1	19	53
COc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1O	ZINC000872128528	EG	On-Demand	Anodyne	ADRB3	27	56
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(CO)c1	ZINC000872128647	DG	On-Demand	Anodyne	ADRB1	24	42
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(CO)c1	ZINC000872128647	DG	On-Demand	Anodyne	ADRB3	32	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(CO)c1	ZINC000872128649	DG	On-Demand	Anodyne	ADRB1	24	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(CO)c1	ZINC000872128649	DG	On-Demand	Anodyne	ADRB3	32	42
O[C@@H](CN[C@H](c1cccnc1)C1CCC1)Cc1cccc(Cl)c1	ZINC000872128655	EH	On-Demand	Anodyne	C3AR1	35	42
O[C@H](CN[C@H](c1cccnc1)C1CCC1)Cc1cccc(Cl)c1	ZINC000872128656	EH	On-Demand	Anodyne	C3AR1	35	42
O[C@H](CN[C@@H](c1cccnc1)C1CCC1)Cc1cccc(Cl)c1	ZINC000872128657	EH	On-Demand	Anodyne	C3AR1	35	42
O[C@@H](CN[C@@H](c1cccnc1)C1CCC1)Cc1cccc(Cl)c1	ZINC000872128658	EH	On-Demand	Anodyne	C3AR1	35	42
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872128660	FG	On-Demand	Anodyne	GPR119	18	43
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872128662	FG	On-Demand	Anodyne	GPR119	18	43
C[C@@H](CCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128698	DG	On-Demand	Anodyne	ADRB2	18	42
C[C@@H](CCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128698	DG	On-Demand	Anodyne	ADRB1	26	42
C[C@@H](CCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872128698	DG	On-Demand	Anodyne	ADRB3	31	42
C[C@@H](CCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128700	DG	On-Demand	Anodyne	ADRB2	18	42
C[C@@H](CCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128700	DG	On-Demand	Anodyne	ADRB1	26	42
C[C@@H](CCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872128700	DG	On-Demand	Anodyne	ADRB3	31	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128707	FG	On-Demand	Anodyne	ADRB1	20	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128707	FG	On-Demand	Anodyne	ADRB3	28	42
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128707	FG	On-Demand	Anodyne	PTGER4	17	41
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128708	FG	On-Demand	Anodyne	ADRB1	20	42
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128708	FG	On-Demand	Anodyne	ADRB3	28	42
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(C(=O)N(C)C)cc1	ZINC000872128708	FG	On-Demand	Anodyne	PTGER4	17	41
C[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872128776	DE	On-Demand	Bother	COLA	93	34
COC(=O)[C@@H]1C[C@H]1[C@@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872128797	CE	On-Demand	Bother	COLA	57	33
C[C@@H](Cn1cncn1)N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C1	ZINC000872128826	CD	On-Demand	Anodyne	HIS3	78	36
C[C@@H](Cn1cncn1)NC1CC(C(=O)OC(C)(C)C)C1	ZINC000872128827	CD	On-Demand	Anodyne	HIS3	78	36
CN1[C@H]2CC[C@H]1CC(NC1CC(C(=O)OC(C)(C)C)C1)C2	ZINC000872128847	CE	On-Demand	Anodyne	GLRA1	41	31
CN1[C@H]2CC[C@H]1CC(N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C1)C2	ZINC000872128848	CE	On-Demand	Anodyne	GLRA1	41	31
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccnn1C	ZINC000872128865	CE	On-Demand	Anodyne	CTSV	31	41
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccnn1C	ZINC000872128866	CE	On-Demand	Anodyne	CTSV	31	41
CC(=O)Nc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128886	EH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)Nc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128886	EH	On-Demand	Anodyne	ADRB1	32	41
CC(=O)Nc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128886	EH	On-Demand	Anodyne	ADRB3	36	45
CC(=O)Nc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128886	EH	On-Demand	Anodyne	F7	16	44
CC(=O)Nc1ccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128887	EH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)Nc1ccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128887	EH	On-Demand	Anodyne	ADRB1	32	41
CC(=O)Nc1ccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128887	EH	On-Demand	Anodyne	ADRB3	36	45
CC(=O)Nc1ccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128887	EH	On-Demand	Anodyne	F7	16	44
CC(=O)Nc1ccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128888	EH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)Nc1ccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128888	EH	On-Demand	Anodyne	ADRB1	32	41
CC(=O)Nc1ccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128888	EH	On-Demand	Anodyne	ADRB3	36	45
CC(=O)Nc1ccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128888	EH	On-Demand	Anodyne	F7	16	44
CC(=O)Nc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128889	EH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)Nc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128889	EH	On-Demand	Anodyne	ADRB1	32	41
CC(=O)Nc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128889	EH	On-Demand	Anodyne	ADRB3	36	45
CC(=O)Nc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872128889	EH	On-Demand	Anodyne	F7	16	44
O[C@H](CNC1CCN(CCN2CCOCC2)CC1)Cc1cccc(Cl)c1	ZINC000872128908	GD	On-Demand	Anodyne	ADRB3	16	41
O[C@H](CNC1CCN(CCN2CCOCC2)CC1)Cc1cccc(Cl)c1	ZINC000872128908	GD	On-Demand	Anodyne	SIGMAR1	15	44
O[C@@H](CNC1CCN(CCN2CCOCC2)CC1)Cc1cccc(Cl)c1	ZINC000872128909	GD	On-Demand	Anodyne	ADRB3	16	41
O[C@@H](CNC1CCN(CCN2CCOCC2)CC1)Cc1cccc(Cl)c1	ZINC000872128909	GD	On-Demand	Anodyne	SIGMAR1	15	44
Cc1nc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c(C)s1	ZINC000872128943	DH	On-Demand	Anodyne	CTSV	23	41
Cc1nc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c(C)s1	ZINC000872128945	DH	On-Demand	Anodyne	CTSV	23	41
O[C@H](CNC1CCN(c2cnccn2)CC1)Cc1cccc(Cl)c1	ZINC000872128957	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNC1CCN(c2cnccn2)CC1)Cc1cccc(Cl)c1	ZINC000872128957	EE	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNC1CCN(c2cnccn2)CC1)Cc1cccc(Cl)c1	ZINC000872128958	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNC1CCN(c2cnccn2)CC1)Cc1cccc(Cl)c1	ZINC000872128958	EE	On-Demand	Anodyne	ADRB3	21	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128962	CF	On-Demand	Anodyne	ADRB2	17	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128962	CF	On-Demand	Anodyne	ADRB1	20	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128962	CF	On-Demand	Anodyne	ADRB3	22	42
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128964	CF	On-Demand	Anodyne	ADRB2	17	40
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128964	CF	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000872128964	CF	On-Demand	Anodyne	ADRB3	22	42
COc1cccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128972	EG	On-Demand	Clean	ADRB2	24	45
COc1cccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128972	EG	On-Demand	Clean	ADRB1	20	45
COc1cccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128972	EG	On-Demand	Clean	ADRB3	22	48
COc1cccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128973	EG	On-Demand	Clean	ADRB2	24	45
COc1cccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128973	EG	On-Demand	Clean	ADRB1	20	45
COc1cccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128973	EG	On-Demand	Clean	ADRB3	22	48
COc1cccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128974	EG	On-Demand	Clean	ADRB2	24	45
COc1cccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128974	EG	On-Demand	Clean	ADRB1	20	45
COc1cccc([C@H](C)NC[C@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128974	EG	On-Demand	Clean	ADRB3	22	48
COc1cccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128975	EG	On-Demand	Clean	ADRB2	24	45
COc1cccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128975	EG	On-Demand	Clean	ADRB1	20	45
COc1cccc([C@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)c1O	ZINC000872128975	EG	On-Demand	Clean	ADRB3	22	48
O[C@H](CN[C@@H]1CCCc2cccnc21)Cc1cccc(Cl)c1	ZINC000872129039	DG	On-Demand	Anodyne	CXCR4	47	33
O[C@@H](CN[C@@H]1CCCc2cccnc21)Cc1cccc(Cl)c1	ZINC000872129040	DG	On-Demand	Anodyne	CXCR4	47	33
O[C@H](CN[C@H]1CCCc2cccnc21)Cc1cccc(Cl)c1	ZINC000872129041	DG	On-Demand	Anodyne	CXCR4	47	33
O[C@@H](CN[C@H]1CCCc2cccnc21)Cc1cccc(Cl)c1	ZINC000872129042	DG	On-Demand	Anodyne	CXCR4	47	33
O[C@H](CN[C@@H]1CCc2cccnc2CC1)Cc1cccc(Cl)c1	ZINC000872129047	EG	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CN[C@@H]1CCc2cccnc2CC1)Cc1cccc(Cl)c1	ZINC000872129048	EG	On-Demand	Anodyne	ADRB3	19	43
O[C@H](CN[C@H]1CCc2cccnc2CC1)Cc1cccc(Cl)c1	ZINC000872129049	EG	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CN[C@H]1CCc2cccnc2CC1)Cc1cccc(Cl)c1	ZINC000872129050	EG	On-Demand	Anodyne	ADRB3	19	43
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)C1CCS(=O)(=O)CC1	ZINC000872129087	EE	On-Demand	Anodyne	ADRB3	24	40
C[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)C1CCS(=O)(=O)CC1	ZINC000872129090	EE	On-Demand	Anodyne	ADRB3	24	40
N#Cc1ccc(CN2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129113	GG	On-Demand	Mild	DRD4	20	43
N#Cc1ccc(CN2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129113	GG	On-Demand	Mild	SIGMAR1	29	48
N#Cc1ccc(CN2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129113	GG	On-Demand	Mild	CCR3	21	61
N#Cc1ccc(CN2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129113	GG	On-Demand	Mild	MCHR1	34	48
N#Cc1ccc(CN2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129114	GG	On-Demand	Mild	DRD4	20	43
N#Cc1ccc(CN2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129114	GG	On-Demand	Mild	SIGMAR1	29	48
N#Cc1ccc(CN2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129114	GG	On-Demand	Mild	CCR3	21	61
N#Cc1ccc(CN2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000872129114	GG	On-Demand	Mild	MCHR1	34	48
COc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1NC(C)=O	ZINC000872129123	GH	On-Demand	Anodyne	ADRB1	23	49
COc1ccc([C@@H](C)NC[C@@H](O)Cc2cccc(Cl)c2)cc1NC(C)=O	ZINC000872129123	GH	On-Demand	Anodyne	ADRB3	34	52
COc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1NC(C)=O	ZINC000872129124	GH	On-Demand	Anodyne	ADRB1	23	49
COc1ccc([C@@H](C)NC[C@H](O)Cc2cccc(Cl)c2)cc1NC(C)=O	ZINC000872129124	GH	On-Demand	Anodyne	ADRB3	34	52
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	F2	16	40
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	ADRB3	43	39
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	PTGER4	15	40
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	TRY2_BOVIN	75	34
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	DPP7	24	41
NC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129127	DD	On-Demand	Anodyne	ST14	80	39
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	F2	16	40
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	ADRB3	43	39
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	PTGER4	15	40
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	TRY2_BOVIN	75	34
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	DPP7	24	41
NC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129128	DD	On-Demand	Anodyne	ST14	80	39
COCCC[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129133	CF	On-Demand	Anodyne	ADRB2	23	43
COCCC[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129133	CF	On-Demand	Anodyne	ADRB1	18	41
COCCC[C@@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129133	CF	On-Demand	Anodyne	ADRB3	20	43
COCCC[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129134	CF	On-Demand	Anodyne	ADRB2	23	43
COCCC[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129134	CF	On-Demand	Anodyne	ADRB1	18	41
COCCC[C@@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129134	CF	On-Demand	Anodyne	ADRB3	20	43
COCCC[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129135	CF	On-Demand	Anodyne	ADRB2	23	43
COCCC[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129135	CF	On-Demand	Anodyne	ADRB1	18	41
COCCC[C@H](C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129135	CF	On-Demand	Anodyne	ADRB3	20	43
COCCC[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129136	CF	On-Demand	Anodyne	ADRB2	23	43
COCCC[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129136	CF	On-Demand	Anodyne	ADRB1	18	41
COCCC[C@H](C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129136	CF	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)CC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129203	FG	On-Demand	Anodyne	EPHX2	17	45
CC(C)(C)CC(=O)N1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129203	FG	On-Demand	Anodyne	CCR8	46	36
CC(C)(C)CC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129204	FG	On-Demand	Anodyne	EPHX2	17	45
CC(C)(C)CC(=O)N1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129204	FG	On-Demand	Anodyne	CCR8	46	36
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129213	FF	On-Demand	Anodyne	ADRB1	23	42
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872129213	FF	On-Demand	Anodyne	ADRB3	32	44
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129214	FF	On-Demand	Anodyne	ADRB1	23	42
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872129214	FF	On-Demand	Anodyne	ADRB3	32	44
CCC[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129323	DH	On-Demand	Anodyne	ADRB1	19	46
CCC[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129323	DH	On-Demand	Anodyne	ADRB3	32	46
CCC[C@@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129324	DH	On-Demand	Anodyne	ADRB1	19	46
CCC[C@@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129324	DH	On-Demand	Anodyne	ADRB3	32	46
CCC[C@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129325	DH	On-Demand	Anodyne	ADRB1	19	46
CCC[C@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129325	DH	On-Demand	Anodyne	ADRB3	32	46
CCC[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129326	DH	On-Demand	Anodyne	ADRB1	19	46
CCC[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000872129326	DH	On-Demand	Anodyne	ADRB3	32	46
CC(=O)NCC1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129373	EF	On-Demand	Anodyne	CACNA1I	42	37
CC(=O)NCC1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872129374	EF	On-Demand	Anodyne	CACNA1I	42	37
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(-n2cccn2)cc1	ZINC000872129393	FJ	On-Demand	Anodyne	AMP1_PLAFQ	60	40
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(OCCN(C)C)cc1	ZINC000872129431	GI	On-Demand	Anodyne	ESRRG	44	33
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129464	EG	On-Demand	Anodyne	GRIN2B	19	42
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129464	EG	On-Demand	Anodyne	TRPV1	40	33
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129464	EG	On-Demand	Anodyne	GPR119	60	37
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129464	EG	On-Demand	Anodyne	SFRP1	87	37
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129464	EG	On-Demand	Anodyne	WNT3	67	33
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129480	EG	On-Demand	Bother	DRD4	25	40
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129480	EG	On-Demand	Bother	ACHE	20	45
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129480	EG	On-Demand	Bother	SIGMAR1	32	43
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129480	EG	On-Demand	Bother	MCHR1	16	40
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129481	EG	On-Demand	Bother	DRD4	25	40
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129481	EG	On-Demand	Bother	ACHE	20	45
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129481	EG	On-Demand	Bother	SIGMAR1	32	43
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129481	EG	On-Demand	Bother	MCHR1	16	40
COC(=O)N1CCC(N[C@H](C)c2ccccc2[N+](=O)[O-])CC1	ZINC000872129484	DE	On-Demand	Bother	COLA	64	32
C=CCC[C@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129487	BH	On-Demand	Mild	COLA	55	32
C=CCC[C@@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129488	BH	On-Demand	Mild	COLA	55	32
COc1ccccc1NC(=O)C[C@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129499	FH	On-Demand	Bother	COLA	74	38
COc1ccccc1NC(=O)C[C@@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129500	FH	On-Demand	Bother	COLA	74	38
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129542	EH	On-Demand	Bother	COLA	107	34
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129542	EH	On-Demand	Bother	CCR8	49	38
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129542	EH	On-Demand	Bother	SFRP1	70	37
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129542	EH	On-Demand	Bother	WNT3	56	37
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129569	EH	On-Demand	Bother	COLA	107	34
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129569	EH	On-Demand	Bother	CCR8	49	38
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129569	EH	On-Demand	Bother	SFRP1	70	37
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129569	EH	On-Demand	Bother	WNT3	56	37
C[C@H](N[C@H](C)CC(=O)Nc1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000872129590	EH	On-Demand	Bother	COLA	111	37
COC(=O)C[C@@H]1CC[C@@H](N[C@H](C)c2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000872129591	DG	On-Demand	Bother	COLA	44	31
COC(=O)C[C@@H]1CC[C@@H](N[C@H](C)c2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000872129592	DG	On-Demand	Bother	COLA	44	31
C[C@H](N[C@H](C)CC(=O)Nc1cccc(F)c1)c1ccccc1[N+](=O)[O-]	ZINC000872129596	EH	On-Demand	Bother	COLA	86	38
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872129608	GJ	On-Demand	Anodyne	EPHX2	56	48
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000872129630	GI	On-Demand	Anodyne	TRPV1	92	36
COC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129631	EF	On-Demand	Anodyne	GPR119	43	35
COC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129631	EF	On-Demand	Anodyne	SFRP1	88	38
COC(=O)N1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129631	EF	On-Demand	Anodyne	WNT3	65	33
COc1ccccc1NC(=O)C[C@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129634	FH	On-Demand	Bother	COLA	74	38
COc1ccccc1NC(=O)C[C@@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129635	FH	On-Demand	Bother	COLA	74	38
CC(=O)NCC1CCC(N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129655	EG	On-Demand	Anodyne	TRPV1	43	35
CC(=O)NCC1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129656	EG	On-Demand	Anodyne	TRPV1	43	35
C[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872129694	FJ	On-Demand	Anodyne	AMP1_PLAFQ	60	40
C[C@H](N[C@H](C)c1ccc(OCCN(C)C)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872129734	GI	On-Demand	Anodyne	ESRRG	44	33
C[C@H](N[C@H](C)CC(=O)N(C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000872129786	EH	On-Demand	Bother	COLA	111	37
C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129787	EH	On-Demand	Bother	COLA	111	37
C[C@@H](CC(=O)N(C)c1ccccc1)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129789	EH	On-Demand	Bother	COLA	111	37
C[C@@H](N[C@H]1CC[C@@H]1C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129807	CG	On-Demand	Bother	COLA	44	32
C[C@@H](N[C@H]1CC[C@H]1C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129809	CG	On-Demand	Bother	COLA	44	32
C[C@@H](NC1CCN(CC(F)(F)F)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129810	EG	On-Demand	Bother	HPGDS	35	40
C[C@H](NC1CCN(CC(F)(F)F)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129811	EG	On-Demand	Bother	HPGDS	35	40
C[C@H](N[C@H](C)CC(=O)N1CCCCCC1)c1ccccc1[N+](=O)[O-]	ZINC000872129812	EG	On-Demand	Bother	COLA	99	33
C[C@H](N[C@H](C)CC(=O)N1CCCCCC1)c1ccccc1[N+](=O)[O-]	ZINC000872129812	EG	On-Demand	Bother	DPP7	26	40
C[C@@H](CC(=O)N1CCCCCC1)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129813	EG	On-Demand	Bother	COLA	99	33
C[C@@H](CC(=O)N1CCCCCC1)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129813	EG	On-Demand	Bother	DPP7	26	40
C[C@@H](CC(=O)N1CCCCCC1)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129815	EG	On-Demand	Bother	COLA	99	33
C[C@@H](CC(=O)N1CCCCCC1)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129815	EG	On-Demand	Bother	DPP7	26	40
C[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000872129816	DE	On-Demand	Bother	COLA	93	34
COC(=O)[C@@H]1C[C@H]1[C@@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872129830	CE	On-Demand	Bother	COLA	57	33
C[C@H](N[C@H](C)CC(=O)Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-]	ZINC000872129845	EH	On-Demand	Bother	COLA	97	48
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1cccc(NS(C)(=O)=O)c1	ZINC000872129859	GH	On-Demand	Anodyne	TRPV1	90	35
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(S(N)(=O)=O)cc1	ZINC000872129868	FG	On-Demand	Anodyne	CA12	21	40
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(S(N)(=O)=O)cc1	ZINC000872129868	FG	On-Demand	Anodyne	CA9	25	40
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(S(N)(=O)=O)cc1	ZINC000872129868	FG	On-Demand	Anodyne	P96878_MYCTU	24	40
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872129870	FI	On-Demand	Anodyne	GPR119	78	46
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872129870	FI	On-Demand	Anodyne	SFRP1	117	46
C[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872129870	FI	On-Demand	Anodyne	WNT3	84	40
C[C@@H](NC1CCC(CS(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872129933	FG	On-Demand	Anodyne	TRPV1	48	37
C[C@@H](NC1CCN(c2nccs2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872129940	FH	On-Demand	Anodyne	NPBWR1	24	45
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(N2CCOCC2)c(F)c1	ZINC000872129943	GI	On-Demand	Clean	TRPV1	26	41
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129960	EG	On-Demand	Anodyne	GRIN2B	19	42
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129960	EG	On-Demand	Anodyne	TRPV1	40	33
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129960	EG	On-Demand	Anodyne	GPR119	60	37
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129960	EG	On-Demand	Anodyne	SFRP1	87	37
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872129960	EG	On-Demand	Anodyne	WNT3	67	33
C[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872129991	GJ	On-Demand	Anodyne	EPHX2	56	48
Cc1nccnc1[C@@H](C)N[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872129995	DH	On-Demand	Anodyne	MPO	25	42
Cc1nccnc1[C@@H](C)N[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872129995	DH	On-Demand	Anodyne	GRPR	49	32
Cc1nccnc1[C@H](C)N[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872129996	DH	On-Demand	Anodyne	MPO	25	42
Cc1nccnc1[C@H](C)N[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872129996	DH	On-Demand	Anodyne	GRPR	49	32
Cc1nccnc1[C@@H](C)N[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872129997	DH	On-Demand	Anodyne	MPO	25	42
Cc1nccnc1[C@@H](C)N[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872129997	DH	On-Demand	Anodyne	GRPR	49	32
Cc1nccnc1[C@H](C)N[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872129998	DH	On-Demand	Anodyne	MPO	25	42
Cc1nccnc1[C@H](C)N[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872129998	DH	On-Demand	Anodyne	GRPR	49	32
C[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000872130025	GI	On-Demand	Anodyne	TRPV1	92	36
COC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872130027	EF	On-Demand	Anodyne	GPR119	43	35
COC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872130027	EF	On-Demand	Anodyne	SFRP1	88	38
COC(=O)N1CCC(N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000872130027	EF	On-Demand	Anodyne	WNT3	65	33
C[C@@H](CCCc1cccnc1)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872130059	EJ	On-Demand	Anodyne	PTAFR	23	42
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130103	FH	On-Demand	Anodyne	SIGMAR1	15	42
C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130103	FH	On-Demand	Anodyne	SSTR5	63	36
C[C@H](N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccc(NS(C)(=O)=O)cc1	ZINC000872130162	GH	On-Demand	Anodyne	TRPV1	85	34
C[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872130174	FG	On-Demand	Anodyne	CA12	21	40
C[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872130174	FG	On-Demand	Anodyne	CA9	25	40
C[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872130174	FG	On-Demand	Anodyne	P96878_MYCTU	24	40
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130185	FI	On-Demand	Anodyne	GPR119	78	46
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130185	FI	On-Demand	Anodyne	SFRP1	117	46
C[C@H](NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130185	FI	On-Demand	Anodyne	WNT3	84	40
C[C@@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130265	FE	On-Demand	Anodyne	SFRP1	59	36
C[C@@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130265	FE	On-Demand	Anodyne	RORC	21	41
COCc1cc([C@@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)ccc1OC	ZINC000872130273	FJ	On-Demand	Anodyne	CASR	17	42
COCc1cc([C@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)ccc1OC	ZINC000872130274	FJ	On-Demand	Anodyne	CASR	17	42
C[C@@H](NC1CCN(CC(F)(F)F)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130326	FH	On-Demand	Anodyne	HPGDS	37	41
Cc1nccnc1[C@@H](C)N[C@@H](C)Cc1ccc(F)cc1Cl	ZINC000872130370	DH	On-Demand	Anodyne	P2RX7	40	40
Cc1nccnc1[C@H](C)N[C@@H](C)Cc1ccc(F)cc1Cl	ZINC000872130372	DH	On-Demand	Anodyne	P2RX7	40	40
Cc1nccnc1[C@H](C)N[C@H](C)Cc1ccc(F)cc1Cl	ZINC000872130373	DH	On-Demand	Anodyne	P2RX7	40	40
Cc1nccnc1[C@@H](C)N[C@H](C)Cc1ccc(F)cc1Cl	ZINC000872130374	DH	On-Demand	Anodyne	P2RX7	40	40
C[C@H](NC1CCC(CS(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130378	FG	On-Demand	Anodyne	TRPV1	48	37
C[C@H](NC1CCN(c2nccs2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130418	FH	On-Demand	Anodyne	NPBWR1	24	45
C[C@H](N[C@H](C)c1ccc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000872130422	GI	On-Demand	Clean	TRPV1	26	41
C[C@@H](CCCc1cccnc1)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872130442	EJ	On-Demand	Anodyne	PTAFR	23	42
C[C@H](N[C@H](C)CCCc1cccnc1)c1ccc(C(F)(F)F)nc1	ZINC000872130443	EJ	On-Demand	Anodyne	PTAFR	23	42
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130494	FI	On-Demand	Anodyne	TRPV1	46	32
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130494	FI	On-Demand	Anodyne	EPHX2	25	42
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130494	FI	On-Demand	Anodyne	SFRP1	124	41
C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130494	FI	On-Demand	Anodyne	WNT3	86	40
COc1ccc(N2CCN(C(=O)/C=C\c3ccc(I)o3)CC2)cc1	ZINC000872130532	IG	On-Demand	Clean	PDK1	18	43
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130550	FH	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130550	FH	On-Demand	Anodyne	SSTR5	63	36
C[C@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872130599	GH	On-Demand	Anodyne	TRPV1	85	34
C[C@@H](N[C@H]1CCN(c2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872130600	EI	On-Demand	Anodyne	SFRP1	42	36
C[C@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130629	FE	On-Demand	Anodyne	SFRP1	59	36
C[C@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130629	FE	On-Demand	Anodyne	RORC	21	41
COCc1cc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)ccc1OC	ZINC000872130634	FJ	On-Demand	Anodyne	CASR	17	42
COCc1cc([C@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)ccc1OC	ZINC000872130635	FJ	On-Demand	Anodyne	CASR	17	42
C[C@H](NC1CCN(CC(F)(F)F)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130697	FH	On-Demand	Anodyne	HPGDS	37	41
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	GRIN2B	38	52
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	PTAFR	20	40
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CTSB	29	44
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CTSK	34	44
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CTSL	29	44
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	GHSR	28	43
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CAPN1	43	35
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CAPN2	78	35
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	EPHX2	28	44
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	TGM2	48	48
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	NPR	58	33
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	F13A1	36	48
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	CCR8	50	46
Cc1nccnc1[C@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130770	EF	On-Demand	Anodyne	BIRC2	27	54
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	GRIN2B	38	52
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	PTAFR	20	40
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CTSB	29	44
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CTSK	34	44
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CTSL	29	44
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	GHSR	28	43
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CAPN1	43	35
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CAPN2	78	35
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	EPHX2	28	44
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	TGM2	48	48
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	NPR	58	33
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	F13A1	36	48
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	CCR8	50	46
Cc1nccnc1[C@@H](C)N[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130771	EF	On-Demand	Anodyne	BIRC2	27	54
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	GRIN2B	38	52
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	PTAFR	20	40
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CTSB	29	44
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CTSK	34	44
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CTSL	29	44
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	GHSR	28	43
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CAPN1	43	35
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CAPN2	78	35
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	EPHX2	28	44
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	TGM2	48	48
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	NPR	58	33
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	F13A1	36	48
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	CCR8	50	46
Cc1nccnc1[C@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130773	EF	On-Demand	Anodyne	BIRC2	27	54
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	GRIN2B	38	52
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	PTAFR	20	40
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CTSB	29	44
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CTSK	34	44
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CTSL	29	44
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	GHSR	28	43
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CAPN1	43	35
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CAPN2	78	35
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	EPHX2	28	44
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	TGM2	48	48
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	NPR	58	33
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	F13A1	36	48
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	CCR8	50	46
Cc1nccnc1[C@@H](C)N[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000872130774	EF	On-Demand	Anodyne	BIRC2	27	54
C[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130776	EF	On-Demand	Anodyne	SFRP1	87	39
C[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130776	EF	On-Demand	Anodyne	WNT3	68	39
COCCOc1ccc([C@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1OC	ZINC000872130802	GJ	On-Demand	Anodyne	CASR	19	41
COCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1OC	ZINC000872130808	GJ	On-Demand	Anodyne	CASR	19	41
C[C@@H](NC1CCN(c2ccccc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130822	EI	On-Demand	Anodyne	SFRP1	61	36
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130959	FI	On-Demand	Anodyne	TRPV1	46	32
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130959	FI	On-Demand	Anodyne	EPHX2	25	42
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130959	FI	On-Demand	Anodyne	SFRP1	124	41
C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872130959	FI	On-Demand	Anodyne	WNT3	86	40
C[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872130978	EI	On-Demand	Anodyne	DRD4	35	44
C[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872130978	EI	On-Demand	Anodyne	SLC6A3	18	41
C[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872130978	EI	On-Demand	Anodyne	SIGMAR1	34	43
C[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872130978	EI	On-Demand	Anodyne	CCR2	20	42
C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131025	GI	On-Demand	Mild	SIGMAR1	15	44
C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131025	GI	On-Demand	Mild	SSTR5	47	34
C[C@H](N[C@@H]1CCN(c2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872131075	EI	On-Demand	Anodyne	SFRP1	42	36
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131181	GI	On-Demand	Anodyne	ENPP1	50	30
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131182	GI	On-Demand	Anodyne	ENPP1	50	30
CC(=O)Nc1ccc([C@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872131209	FI	On-Demand	Anodyne	IDO1	27	40
CC(=O)Nc1ccc([C@@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872131210	FI	On-Demand	Anodyne	IDO1	27	40
C[C@@H](NC1CCN(C(N)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131227	DE	On-Demand	Anodyne	SFRP1	89	38
C[C@@H](NC1CCN(C(N)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131227	DE	On-Demand	Anodyne	WNT3	67	33
C[C@@H](Cn1cncn1)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131241	CE	On-Demand	Anodyne	HIS3	58	32
C[C@@H](Cn1cncn1)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131242	CE	On-Demand	Anodyne	HIS3	58	32
C[C@H](N[C@H](C)Cn1cncn1)c1ccc(C(F)(F)F)nc1	ZINC000872131243	CE	On-Demand	Anodyne	HIS3	58	32
C[C@H](CS(C)(=O)=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131305	DE	On-Demand	Anodyne	TRPV1	41	32
C[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131310	FH	On-Demand	Anodyne	SFRP1	58	42
C[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131313	EF	On-Demand	Anodyne	SFRP1	87	39
C[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131313	EF	On-Demand	Anodyne	WNT3	68	39
COCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1OC	ZINC000872131343	GJ	On-Demand	Anodyne	CASR	19	41
COCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1OC	ZINC000872131344	GJ	On-Demand	Anodyne	CASR	19	41
C[C@H](NC1CCN(c2ccccc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131366	EI	On-Demand	Anodyne	SFRP1	61	36
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872131458	EI	On-Demand	Anodyne	DRD4	35	44
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872131458	EI	On-Demand	Anodyne	SLC6A3	18	41
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872131458	EI	On-Demand	Anodyne	SIGMAR1	34	43
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)nc1	ZINC000872131458	EI	On-Demand	Anodyne	CCR2	20	42
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131489	GI	On-Demand	Mild	SIGMAR1	15	44
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131489	GI	On-Demand	Mild	SSTR5	47	34
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131565	GI	On-Demand	Anodyne	ENPP1	50	30
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872131566	GI	On-Demand	Anodyne	ENPP1	50	30
CC(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872131593	FI	On-Demand	Anodyne	IDO1	27	40
CC(=O)Nc1ccc([C@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872131594	FI	On-Demand	Anodyne	IDO1	27	40
C[C@H](NC1CCN(C(N)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131615	DE	On-Demand	Anodyne	SFRP1	89	38
C[C@H](NC1CCN(C(N)=O)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131615	DE	On-Demand	Anodyne	WNT3	67	33
C[C@H](N[C@H](C)CS(C)(=O)=O)c1ccc(C(F)(F)F)nc1	ZINC000872131684	DE	On-Demand	Anodyne	TRPV1	41	32
C[C@H](NC1CCN(C(=O)c2ccoc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000872131694	FH	On-Demand	Anodyne	SFRP1	58	42
CC[C@@H](NC1CCN(CC(F)(F)F)CC1)[C@@H](O)c1ccccc1	ZINC000872131698	EG	On-Demand	Anodyne	HPGDS	36	44
CC[C@@H](NC1CCN(CC(F)(F)F)CC1)[C@H](O)c1ccccc1	ZINC000872131700	EG	On-Demand	Anodyne	HPGDS	36	44
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	CHRM2	20	42
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	CHRM1	27	54
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	SLC6A3	19	43
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	CHRM3	17	42
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	GRIN2B	25	43
CCOC(=O)N1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131716	DF	On-Demand	Anodyne	CCR8	51	46
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	CHRM2	20	42
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	CHRM1	27	54
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	SLC6A3	19	43
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	CHRM3	17	42
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	GRIN2B	25	43
CCOC(=O)N1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872131717	DF	On-Demand	Anodyne	CCR8	51	46
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	CHRM2	20	42
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	CHRM1	27	54
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	SLC6A3	19	43
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	CHRM3	17	42
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	GRIN2B	25	43
CCOC(=O)N1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131718	DF	On-Demand	Anodyne	CCR8	51	46
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	CHRM2	20	42
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	CHRM1	27	54
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	SLC6A3	19	43
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	CHRM3	17	42
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	GRIN2B	25	43
CCOC(=O)N1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872131719	DF	On-Demand	Anodyne	CCR8	51	46
C[C@H](NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000872131730	CG	On-Demand	Anodyne	PTAFR	15	45
C[C@@H](NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000872131731	CG	On-Demand	Anodyne	PTAFR	15	45
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA2	83	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA1	62	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA7	49	43
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA5B	40	37
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA4	64	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA5A	46	37
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA14	33	43
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA12	40	41
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	CA9	49	41
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131732	EE	On-Demand	Anodyne	P96878_MYCTU	33	40
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA2	83	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA1	62	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA7	49	43
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA5B	40	37
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA4	64	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA5A	46	37
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA14	33	43
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA12	40	41
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	CA9	49	41
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131733	EE	On-Demand	Anodyne	P96878_MYCTU	33	40
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA2	83	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA1	62	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA7	49	43
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA5B	40	37
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA4	64	50
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA5A	46	37
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA14	33	43
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA12	40	41
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	CA9	49	41
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872131734	EE	On-Demand	Anodyne	P96878_MYCTU	33	40
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA2	83	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA1	62	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA7	49	43
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA5B	40	37
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA4	64	50
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA5A	46	37
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA14	33	43
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA12	40	41
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	CA9	49	41
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872131735	EE	On-Demand	Anodyne	P96878_MYCTU	33	40
CC[C@H](N[C@@H](C)CS(C)(=O)=O)[C@H](O)c1ccccc1	ZINC000872131900	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@H](C)CS(C)(=O)=O)[C@H](O)c1ccccc1	ZINC000872131901	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@@H](C)CS(C)(=O)=O)[C@@H](O)c1ccccc1	ZINC000872131903	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@H](C)CS(C)(=O)=O)[C@@H](O)c1ccccc1	ZINC000872131905	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@H](C)CC(=O)N(C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872131974	EH	On-Demand	Anodyne	NPY5R	20	41
CC[C@H](N[C@@H](C)CC(=O)N(C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872131975	EH	On-Demand	Anodyne	NPY5R	20	41
CC[C@H](N[C@@H](C)CC(=O)N(C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872131976	EH	On-Demand	Anodyne	NPY5R	20	41
CC[C@H](N[C@H](C)CC(=O)N(C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872131977	EH	On-Demand	Anodyne	NPY5R	20	41
Cc1nccnc1[C@@H](C)N[C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872132034	DG	On-Demand	Bother	COLA	116	39
Cc1nccnc1[C@H](C)N[C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872132035	DG	On-Demand	Bother	COLA	116	39
Cc1nccnc1[C@H](C)N[C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872132037	DG	On-Demand	Bother	COLA	116	39
Cc1nccnc1[C@@H](C)N[C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000872132038	DG	On-Demand	Bother	COLA	116	39
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	DRD4	28	41
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	ACHE	20	41
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	SIGMAR1	39	42
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	CCR3	16	44
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	CCR5	17	46
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	MLNR	16	40
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@H](O)c1ccccc1	ZINC000872132052	FH	On-Demand	Mild	MCHR1	15	40
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	DRD4	28	41
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	ACHE	20	41
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	SIGMAR1	39	42
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	CCR3	16	44
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	CCR5	17	46
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	MLNR	16	40
CC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132056	FH	On-Demand	Mild	MCHR1	15	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000872132111	EG	On-Demand	Anodyne	PTGS2	16	41
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000872132112	EG	On-Demand	Anodyne	PTGS2	16	41
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000872132143	EG	On-Demand	Anodyne	DRD4	34	41
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000872132143	EG	On-Demand	Anodyne	ACHE	32	43
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000872132143	EG	On-Demand	Anodyne	SLC6A3	16	46
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000872132143	EG	On-Demand	Anodyne	SIGMAR1	40	44
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000872132143	EG	On-Demand	Anodyne	SSTR5	62	36
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132145	EG	On-Demand	Anodyne	DRD4	34	41
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132145	EG	On-Demand	Anodyne	ACHE	32	43
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132145	EG	On-Demand	Anodyne	SLC6A3	16	46
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132145	EG	On-Demand	Anodyne	SIGMAR1	40	44
CC[C@@H](NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000872132145	EG	On-Demand	Anodyne	SSTR5	62	36
CCOC(=O)C1CCN(C(=O)C[C@H](C)NC2CC(Nc3ccccc3)C2)CC1	ZINC000872132176	GF	On-Demand	Anodyne	FDFT1	21	42
CCOC(=O)C1CCN(C(=O)C[C@@H](C)NC2CC(Nc3ccccc3)C2)CC1	ZINC000872132178	GF	On-Demand	Anodyne	FDFT1	21	42
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(F)c1	ZINC000872132187	DF	On-Demand	Anodyne	KISS1R	24	40
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(F)c1	ZINC000872132189	DF	On-Demand	Anodyne	KISS1R	24	40
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(F)c1	ZINC000872132191	DF	On-Demand	Anodyne	KISS1R	24	40
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(F)c1	ZINC000872132193	DF	On-Demand	Anodyne	KISS1R	24	40
CC[C@H](N[C@H](C)c1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132234	CG	On-Demand	Anodyne	KCNA5	25	40
CC[C@H](N[C@@H](C)c1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132235	CG	On-Demand	Anodyne	KCNA5	25	40
CC[C@H](N[C@@H](C)c1cccnc1)[C@H](O)c1ccccc1	ZINC000872132236	CG	On-Demand	Anodyne	KCNA5	25	40
CC[C@H](N[C@H](C)c1cccnc1)[C@H](O)c1ccccc1	ZINC000872132237	CG	On-Demand	Anodyne	KCNA5	25	40
CC[C@H](N[C@@H]1C[C@H](C)N(C2CC2)C1)[C@@H](O)c1ccccc1	ZINC000872132277	CF	On-Demand	Anodyne	XIAP	17	41
CC[C@H](N[C@@H]1C[C@@H](C)N(C2CC2)C1)[C@H](O)c1ccccc1	ZINC000872132278	CF	On-Demand	Anodyne	XIAP	17	41
CC[C@H](N[C@@H]1C[C@H](C)N(C2CC2)C1)[C@H](O)c1ccccc1	ZINC000872132279	CF	On-Demand	Anodyne	XIAP	17	41
CC[C@H](N[C@@H]1C[C@@H](C)N(C2CC2)C1)[C@@H](O)c1ccccc1	ZINC000872132281	CF	On-Demand	Anodyne	XIAP	17	41
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000872132300	DE	On-Demand	Anodyne	CHRM1	21	44
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000872132300	DE	On-Demand	Anodyne	SLC6A3	20	40
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000872132300	DE	On-Demand	Anodyne	GRIN2B	21	43
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000872132300	DE	On-Demand	Anodyne	CCR5	21	42
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000872132300	DE	On-Demand	Anodyne	CCR8	60	39
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000872132302	DE	On-Demand	Anodyne	CHRM1	21	44
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000872132302	DE	On-Demand	Anodyne	SLC6A3	20	40
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000872132302	DE	On-Demand	Anodyne	GRIN2B	21	43
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000872132302	DE	On-Demand	Anodyne	CCR5	21	42
CC[C@@H](NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000872132302	DE	On-Demand	Anodyne	CCR8	60	39
Cc1nccnc1[C@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872132306	EF	On-Demand	Mild	SIGMAR1	19	43
Cc1nccnc1[C@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872132306	EF	On-Demand	Mild	SSTR5	51	36
Cc1nccnc1[C@@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872132307	EF	On-Demand	Mild	SIGMAR1	19	43
Cc1nccnc1[C@@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872132307	EF	On-Demand	Mild	SSTR5	51	36
c1ccc(NC2CC(N[C@H]3CCCc4cccnc43)C2)cc1	ZINC000872132359	CH	On-Demand	Anodyne	CXCR4	68	37
c1ccc(NC2CC(N[C@@H]3CCCc4cccnc43)C2)cc1	ZINC000872132361	CH	On-Demand	Anodyne	CXCR4	68	37
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132409	DH	On-Demand	Anodyne	TBXAS1	29	40
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132409	DH	On-Demand	Anodyne	PTAFR	35	48
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132409	DH	On-Demand	Anodyne	KCNA5	18	40
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132411	DH	On-Demand	Anodyne	TBXAS1	29	40
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132411	DH	On-Demand	Anodyne	PTAFR	35	48
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872132411	DH	On-Demand	Anodyne	KCNA5	18	40
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132412	DH	On-Demand	Anodyne	TBXAS1	29	40
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132412	DH	On-Demand	Anodyne	PTAFR	35	48
CC[C@H](N[C@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132412	DH	On-Demand	Anodyne	KCNA5	18	40
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132413	DH	On-Demand	Anodyne	TBXAS1	29	40
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132413	DH	On-Demand	Anodyne	PTAFR	35	48
CC[C@H](N[C@@H](C)CCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872132413	DH	On-Demand	Anodyne	KCNA5	18	40
CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@@H](O)c1ccccc1	ZINC000872132441	DH	On-Demand	Clean	THRA	43	37
CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@@H](O)c1ccccc1	ZINC000872132441	DH	On-Demand	Clean	THRB	52	37
CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@@H](O)c1ccccc1	ZINC000872132443	DH	On-Demand	Clean	THRA	43	37
CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@@H](O)c1ccccc1	ZINC000872132443	DH	On-Demand	Clean	THRB	52	37
CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@H](O)c1ccccc1	ZINC000872132444	DH	On-Demand	Clean	THRA	43	37
CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@H](O)c1ccccc1	ZINC000872132444	DH	On-Demand	Clean	THRB	52	37
CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@H](O)c1ccccc1	ZINC000872132445	DH	On-Demand	Clean	THRA	43	37
CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@H](O)c1ccccc1	ZINC000872132445	DH	On-Demand	Clean	THRB	52	37
CC[C@@H](NC1CCN(C(N)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872132452	CD	On-Demand	Anodyne	CHRM1	17	40
CC[C@@H](NC1CCN(C(N)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872132452	CD	On-Demand	Anodyne	XIAP	41	38
CC[C@@H](NC1CCN(C(N)=O)CC1)[C@H](O)c1ccccc1	ZINC000872132458	CD	On-Demand	Anodyne	CHRM1	17	40
CC[C@@H](NC1CCN(C(N)=O)CC1)[C@H](O)c1ccccc1	ZINC000872132458	CD	On-Demand	Anodyne	XIAP	41	38
C[C@H](NC1CC(Nc2ccccc2)C1)c1cccc(S(N)(=O)=O)c1	ZINC000872132479	EF	On-Demand	Anodyne	CA2	17	41
C[C@@H](NC1CC(Nc2ccccc2)C1)c1cccc(S(N)(=O)=O)c1	ZINC000872132486	EF	On-Demand	Anodyne	CA2	17	41
Cc1nccnc1[C@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132501	EG	On-Demand	Anodyne	SIGMAR1	15	41
Cc1nccnc1[C@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132501	EG	On-Demand	Anodyne	CCR3	47	39
Cc1nccnc1[C@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132501	EG	On-Demand	Anodyne	CACNA1G	19	41
Cc1nccnc1[C@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132501	EG	On-Demand	Anodyne	BIRC2	21	41
Cc1nccnc1[C@@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132503	EG	On-Demand	Anodyne	SIGMAR1	15	41
Cc1nccnc1[C@@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132503	EG	On-Demand	Anodyne	CCR3	47	39
Cc1nccnc1[C@@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132503	EG	On-Demand	Anodyne	CACNA1G	19	41
Cc1nccnc1[C@@H](C)NC1CCN(CCc2ccc(F)cc2)CC1	ZINC000872132503	EG	On-Demand	Anodyne	BIRC2	21	41
Cc1nccnc1[C@@H](C)N[C@H](C)c1ccc(OCCN(C)C)cc1	ZINC000872132529	EG	On-Demand	Anodyne	ESRRG	46	34
Cc1nccnc1[C@@H](C)N[C@@H](C)c1ccc(OCCN(C)C)cc1	ZINC000872132531	EG	On-Demand	Anodyne	ESRRG	46	34
Cc1nccnc1[C@H](C)N[C@@H](C)c1ccc(OCCN(C)C)cc1	ZINC000872132533	EG	On-Demand	Anodyne	ESRRG	46	34
CC[C@@H](NC1CCN(CCN2CCOCC2)CC1)[C@H](O)c1ccccc1	ZINC000872132534	FD	On-Demand	Anodyne	CASR	48	37
Cc1nccnc1[C@H](C)N[C@H](C)c1ccc(OCCN(C)C)cc1	ZINC000872132535	EG	On-Demand	Anodyne	ESRRG	46	34
CC[C@@H](NC1CCN(CCN2CCOCC2)CC1)[C@@H](O)c1ccccc1	ZINC000872132536	FD	On-Demand	Anodyne	CASR	48	37
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1ccccc1	ZINC000872132549	EH	On-Demand	Bother	COLA	68	32
CC[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1ccccc1	ZINC000872132550	EH	On-Demand	Bother	COLA	68	32
CC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1ccccc1	ZINC000872132551	EH	On-Demand	Bother	COLA	68	32
CC[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1ccccc1	ZINC000872132552	EH	On-Demand	Bother	COLA	68	32
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872132583	EF	On-Demand	Anodyne	G2YM83_BOTF4	65	32
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872132584	EF	On-Demand	Anodyne	G2YM83_BOTF4	65	32
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872132585	EF	On-Demand	Anodyne	G2YM83_BOTF4	65	32
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872132586	EF	On-Demand	Anodyne	G2YM83_BOTF4	65	32
Cc1nccnc1[C@H](C)N[C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872132589	EG	On-Demand	Anodyne	GPR119	64	44
Cc1nccnc1[C@H](C)N[C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872132590	EG	On-Demand	Anodyne	GPR119	64	44
Cc1nccnc1[C@H](C)N[C@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872132591	EG	On-Demand	Anodyne	GPR119	64	44
Cc1nccnc1[C@H](C)N[C@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872132592	EG	On-Demand	Anodyne	GPR119	64	44
CC[C@H](N[C@@H](C)CC(=O)Nc1cccnc1Cl)[C@H](O)c1ccccc1	ZINC000872132614	FH	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC[C@H](N[C@H](C)CC(=O)Nc1cccnc1Cl)[C@H](O)c1ccccc1	ZINC000872132615	FH	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC[C@H](N[C@H](C)CC(=O)Nc1cccnc1Cl)[C@@H](O)c1ccccc1	ZINC000872132616	FH	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC[C@H](N[C@@H](C)CC(=O)Nc1cccnc1Cl)[C@@H](O)c1ccccc1	ZINC000872132617	FH	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872132650	EH	On-Demand	Anodyne	NPY5R	34	43
CC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000872132653	EH	On-Demand	Anodyne	NPY5R	34	43
CC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872132655	EH	On-Demand	Anodyne	NPY5R	34	43
CC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000872132657	EH	On-Demand	Anodyne	NPY5R	34	43
CC[C@H](N[C@H](C)c1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000872132771	EH	On-Demand	Anodyne	ACACA	19	41
CC[C@H](N[C@H](C)c1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000872132771	EH	On-Demand	Anodyne	ACACB	19	41
CC[C@H](N[C@@H](C)c1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000872132772	EH	On-Demand	Anodyne	ACACA	19	41
CC[C@H](N[C@@H](C)c1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000872132772	EH	On-Demand	Anodyne	ACACB	19	41
CC[C@H](N[C@@H](C)c1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000872132773	EH	On-Demand	Anodyne	ACACA	19	41
CC[C@H](N[C@@H](C)c1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000872132773	EH	On-Demand	Anodyne	ACACB	19	41
CC[C@H](N[C@H](C)c1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000872132774	EH	On-Demand	Anodyne	ACACA	19	41
CC[C@H](N[C@H](C)c1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000872132774	EH	On-Demand	Anodyne	ACACB	19	41
CC[C@H](N[C@H]1Cc2[nH]c3ccccc3c2C1)[C@H](O)c1ccccc1	ZINC000872132775	DH	On-Demand	Anodyne	SSTR4	49	35
CC[C@H](N[C@@H]1Cc2[nH]c3ccccc3c2C1)[C@H](O)c1ccccc1	ZINC000872132776	DH	On-Demand	Anodyne	SSTR4	49	35
CC[C@H](N[C@@H]1Cc2[nH]c3ccccc3c2C1)[C@@H](O)c1ccccc1	ZINC000872132777	DH	On-Demand	Anodyne	SSTR4	49	35
CC[C@H](N[C@H]1Cc2[nH]c3ccccc3c2C1)[C@@H](O)c1ccccc1	ZINC000872132778	DH	On-Demand	Anodyne	SSTR4	49	35
CC(=O)Nc1cccc([C@H](C)NC2CC(Nc3ccccc3)C2)c1	ZINC000872132819	DH	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc([C@H](C)NC2CC(Nc3ccccc3)C2)c1	ZINC000872132819	DH	On-Demand	Anodyne	KCNK3	57	33
CC(=O)Nc1cccc([C@@H](C)NC2CC(Nc3ccccc3)C2)c1	ZINC000872132820	DH	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc([C@@H](C)NC2CC(Nc3ccccc3)C2)c1	ZINC000872132820	DH	On-Demand	Anodyne	KCNK3	57	33
Cc1nccnc1[C@H](C)N[C@H](C)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872132872	GF	On-Demand	Anodyne	GRIN2B	20	41
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132873	EG	On-Demand	Anodyne	GRIN2B	18	42
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132873	EG	On-Demand	Anodyne	CCR8	50	43
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132873	EG	On-Demand	Anodyne	GPR119	39	45
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132873	EG	On-Demand	Anodyne	SFRP1	92	42
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132873	EG	On-Demand	Anodyne	WNT3	68	37
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132874	EG	On-Demand	Anodyne	GRIN2B	18	42
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132874	EG	On-Demand	Anodyne	CCR8	50	43
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132874	EG	On-Demand	Anodyne	GPR119	39	45
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132874	EG	On-Demand	Anodyne	SFRP1	92	42
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132874	EG	On-Demand	Anodyne	WNT3	68	37
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132875	EG	On-Demand	Anodyne	GRIN2B	18	42
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132875	EG	On-Demand	Anodyne	CCR8	50	43
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132875	EG	On-Demand	Anodyne	GPR119	39	45
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132875	EG	On-Demand	Anodyne	SFRP1	92	42
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)c1ccccc1	ZINC000872132875	EG	On-Demand	Anodyne	WNT3	68	37
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132876	EG	On-Demand	Anodyne	GRIN2B	18	42
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132876	EG	On-Demand	Anodyne	CCR8	50	43
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132876	EG	On-Demand	Anodyne	GPR119	39	45
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132876	EG	On-Demand	Anodyne	SFRP1	92	42
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)c1ccccc1	ZINC000872132876	EG	On-Demand	Anodyne	WNT3	68	37
Cc1nccnc1[C@H](C)N[C@H](C)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872132880	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@H](C)N[C@@H](C)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872132881	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@H](C)N[C@@H](C)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872132883	GF	On-Demand	Anodyne	GRIN2B	20	41
COC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872132898	DE	On-Demand	Anodyne	GRIN2B	17	41
COC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872132898	DE	On-Demand	Anodyne	CCR8	64	36
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872132910	EH	On-Demand	Anodyne	EPHX2	24	43
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872132910	EH	On-Demand	Anodyne	CCR8	71	42
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872132910	EH	On-Demand	Anodyne	SFRP1	74	38
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872132910	EH	On-Demand	Anodyne	WNT3	56	38
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872132912	EH	On-Demand	Anodyne	EPHX2	24	43
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872132912	EH	On-Demand	Anodyne	CCR8	71	42
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872132912	EH	On-Demand	Anodyne	SFRP1	74	38
CC[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872132912	EH	On-Demand	Anodyne	WNT3	56	38
NC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872132947	CD	On-Demand	Anodyne	EPHX2	21	40
CC[C@H](N[C@H](COC)C(C)C)[C@H](O)c1ccccc1	ZINC000872132960	CF	On-Demand	Anodyne	AOC3	15	42
CC[C@H](N[C@@H](COC)C(C)C)[C@H](O)c1ccccc1	ZINC000872132961	CF	On-Demand	Anodyne	AOC3	15	42
CC[C@H](N[C@@H](COC)C(C)C)[C@@H](O)c1ccccc1	ZINC000872132962	CF	On-Demand	Anodyne	AOC3	15	42
CC[C@H](N[C@H](COC)C(C)C)[C@@H](O)c1ccccc1	ZINC000872132965	CF	On-Demand	Anodyne	AOC3	15	42
CC[C@H](N[C@@H]1CCN(CCOC)C1)[C@@H](O)c1ccccc1	ZINC000872132968	CD	On-Demand	Anodyne	SLC6A3	28	44
CC[C@H](N[C@@H]1CCN(CCOC)C1)[C@H](O)c1ccccc1	ZINC000872132972	CD	On-Demand	Anodyne	SLC6A3	28	44
CC[C@H](N[C@H]1CCN(CCOC)C1)[C@@H](O)c1ccccc1	ZINC000872132974	CD	On-Demand	Anodyne	SLC6A3	28	44
CC[C@H](N[C@H]1CCN(CCOC)C1)[C@H](O)c1ccccc1	ZINC000872132975	CD	On-Demand	Anodyne	SLC6A3	28	44
FC(F)(F)CN1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872133074	EG	On-Demand	Anodyne	HPGDS	35	42
CC[C@@H](NC1CCN(c2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000872133086	EG	On-Demand	Anodyne	EBP	27	41
CC[C@@H](NC1CCN(c2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000872133087	EG	On-Demand	Anodyne	EBP	27	41
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133096	EE	On-Demand	Anodyne	CA2	41	43
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133096	EE	On-Demand	Anodyne	CA1	28	43
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133096	EE	On-Demand	Anodyne	CA4	41	43
COCCOc1ccc([C@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872133120	DG	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872133120	DG	On-Demand	Anodyne	ACACB	18	40
COCCOc1ccc([C@@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872133121	DG	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872133121	DG	On-Demand	Anodyne	ACACB	18	40
COCCOc1ccc([C@@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872133122	DG	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872133122	DG	On-Demand	Anodyne	ACACB	18	40
COCCOc1ccc([C@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872133123	DG	On-Demand	Anodyne	ACACA	18	40
COCCOc1ccc([C@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872133123	DG	On-Demand	Anodyne	ACACB	18	40
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133143	GH	On-Demand	Anodyne	P2RY1	41	39
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133143	GH	On-Demand	Anodyne	EPHX2	48	40
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133143	GH	On-Demand	Anodyne	SHH	45	36
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133144	GH	On-Demand	Anodyne	P2RY1	41	39
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133144	GH	On-Demand	Anodyne	EPHX2	48	40
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133144	GH	On-Demand	Anodyne	SHH	45	36
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133145	GH	On-Demand	Anodyne	P2RY1	41	39
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133145	GH	On-Demand	Anodyne	EPHX2	48	40
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133145	GH	On-Demand	Anodyne	SHH	45	36
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133146	GH	On-Demand	Anodyne	P2RY1	41	39
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133146	GH	On-Demand	Anodyne	EPHX2	48	40
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000872133146	GH	On-Demand	Anodyne	SHH	45	36
Cc1nccnc1[C@H](C)N[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-]	ZINC000872133159	EH	On-Demand	Bother	COLA	101	34
Cc1nccnc1[C@H](C)N[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-]	ZINC000872133160	EH	On-Demand	Bother	COLA	101	34
Cc1nccnc1[C@H](C)N[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-]	ZINC000872133161	EH	On-Demand	Bother	COLA	101	34
Cc1nccnc1[C@H](C)N[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-]	ZINC000872133162	EH	On-Demand	Bother	COLA	101	34
Cc1nccnc1[C@H](C)N[C@@H]1CCCc2cccnc21	ZINC000872133195	CF	On-Demand	Anodyne	CXCR4	46	36
Cc1nccnc1[C@H](C)N[C@H]1CCCc2cccnc21	ZINC000872133196	CF	On-Demand	Anodyne	CXCR4	46	36
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133197	EE	On-Demand	Anodyne	CA2	41	43
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133197	EE	On-Demand	Anodyne	CA1	28	43
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133197	EE	On-Demand	Anodyne	CA4	41	43
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133198	EE	On-Demand	Anodyne	CA2	41	43
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133198	EE	On-Demand	Anodyne	CA1	28	43
CC[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000872133198	EE	On-Demand	Anodyne	CA4	41	43
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133199	EE	On-Demand	Anodyne	CA2	41	43
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133199	EE	On-Demand	Anodyne	CA1	28	43
CC[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000872133199	EE	On-Demand	Anodyne	CA4	41	43
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc2c(c1)CCC(=O)N2	ZINC000872133215	EH	On-Demand	Anodyne	PKM	34	41
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc2c(c1)CCC(=O)N2	ZINC000872133216	EH	On-Demand	Anodyne	PKM	34	41
Cc1nccnc1[C@@H](C)N[C@H]1CCCc2cccnc21	ZINC000872133297	CF	On-Demand	Anodyne	CXCR4	46	36
Cc1nccnc1[C@@H](C)N[C@@H]1CCCc2cccnc21	ZINC000872133299	CF	On-Demand	Anodyne	CXCR4	46	36
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	CHRM1	19	41
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	GRIN2B	19	43
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	EPHX2	19	40
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	CCR8	41	44
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	GPR119	48	47
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	SFRP1	72	42
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872133311	EG	On-Demand	Anodyne	WNT3	53	36
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	CHRM1	19	41
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	GRIN2B	19	43
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	EPHX2	19	40
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	CCR8	41	44
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	GPR119	48	47
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	SFRP1	72	42
CC[C@@H](NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872133312	EG	On-Demand	Anodyne	WNT3	53	36
CC[C@H](N[C@H](C)CCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872133395	CH	On-Demand	Anodyne	PTAFR	26	41
CC[C@H](N[C@H](C)CCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872133397	CH	On-Demand	Anodyne	PTAFR	26	41
CC[C@H](N[C@@H](C)CCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872133399	CH	On-Demand	Anodyne	PTAFR	26	41
Cc1nccnc1[C@H](C)NC1CCN(C(=O)CC(C)(C)C)CC1	ZINC000872133400	DF	On-Demand	Anodyne	CCR8	45	36
CC[C@H](N[C@@H](C)CCc1cccnc1)[C@H](O)c1ccccc1	ZINC000872133401	CH	On-Demand	Anodyne	PTAFR	26	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)CC(C)(C)C)CC1	ZINC000872133402	DF	On-Demand	Anodyne	CCR8	45	36
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	PLG	18	40
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	OPRD1	15	43
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	P2RY12	47	37
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	GRIN2B	42	55
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	ELANE	27	42
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CTSB	31	44
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CTSK	30	44
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CTSL	28	44
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	C3AR1	41	41
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	PREP	29	40
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CAPNS1	46	30
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	LGMN	48	36
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CTSS	15	41
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CAPN1	52	34
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CAPN2	82	34
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	EPHX2	34	40
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	TGM2	60	49
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	NPR	46	31
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	F13A1	52	49
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	CCR8	38	48
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	BIRC2	21	49
Cc1nccnc1[C@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133418	FG	On-Demand	Anodyne	SLC12A5	45	34
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	PLG	18	40
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	OPRD1	15	43
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	P2RY12	47	37
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	GRIN2B	42	55
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	ELANE	27	42
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CTSB	31	44
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CTSK	30	44
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CTSL	28	44
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	C3AR1	41	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	PREP	29	40
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CAPNS1	46	30
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	LGMN	48	36
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CTSS	15	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CAPN1	52	34
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CAPN2	82	34
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	EPHX2	34	40
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	TGM2	60	49
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	NPR	46	31
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	F13A1	52	49
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	CCR8	38	48
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	BIRC2	21	49
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872133427	FG	On-Demand	Anodyne	SLC12A5	45	34
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)N1CCCCCC1	ZINC000872133430	DF	On-Demand	Anodyne	PTAFR	22	40
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)N1CCCCCC1	ZINC000872133432	DF	On-Demand	Anodyne	PTAFR	22	40
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)N1CCCCCC1	ZINC000872133435	DF	On-Demand	Anodyne	PTAFR	22	40
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)N1CCCCCC1	ZINC000872133437	DF	On-Demand	Anodyne	PTAFR	22	40
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)NCCc1ccccc1	ZINC000872133444	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	40
CC[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872133445	EG	On-Demand	Anodyne	PTGS2	21	40
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)NCCc1ccccc1	ZINC000872133446	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	40
CC[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000872133447	EG	On-Demand	Anodyne	PTGS2	21	40
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)NCCc1ccccc1	ZINC000872133448	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	40
CC[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872133449	EG	On-Demand	Anodyne	PTGS2	21	40
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)NCCc1ccccc1	ZINC000872133450	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	40
CC[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000872133451	EG	On-Demand	Anodyne	PTGS2	21	40
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@H](O)c1ccccc1	ZINC000872133528	GI	On-Demand	Anodyne	CHRM2	22	44
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@H](O)c1ccccc1	ZINC000872133528	GI	On-Demand	Anodyne	CCR8	41	34
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@H](O)c1ccccc1	ZINC000872133528	GI	On-Demand	Anodyne	SFRP1	21	42
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@H](O)c1ccccc1	ZINC000872133528	GI	On-Demand	Anodyne	L3MBTL3	63	42
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H](O)c1ccccc1	ZINC000872133529	GI	On-Demand	Anodyne	CHRM2	22	44
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H](O)c1ccccc1	ZINC000872133529	GI	On-Demand	Anodyne	CCR8	41	34
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H](O)c1ccccc1	ZINC000872133529	GI	On-Demand	Anodyne	SFRP1	21	42
CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H](O)c1ccccc1	ZINC000872133529	GI	On-Demand	Anodyne	L3MBTL3	63	42
CC[C@H](N[C@@H](C)c1ccc(C(=O)N(C)C)cc1)[C@H](O)c1ccccc1	ZINC000872133539	EH	On-Demand	Anodyne	AOC3	15	40
CC[C@H](N[C@H](C)c1ccc(C(=O)N(C)C)cc1)[C@H](O)c1ccccc1	ZINC000872133540	EH	On-Demand	Anodyne	AOC3	15	40
CC[C@H](N[C@H](C)c1ccc(C(=O)N(C)C)cc1)[C@@H](O)c1ccccc1	ZINC000872133541	EH	On-Demand	Anodyne	AOC3	15	40
CC[C@H](N[C@@H](C)c1ccc(C(=O)N(C)C)cc1)[C@@H](O)c1ccccc1	ZINC000872133542	EH	On-Demand	Anodyne	AOC3	15	40
c1ccc(NC2CC(NC3CCN(c4ccccn4)CC3)C2)cc1	ZINC000872133589	DG	On-Demand	Anodyne	DRD4	23	44
c1ccc(NC2CC(NC3CCN(c4ccccn4)CC3)C2)cc1	ZINC000872133589	DG	On-Demand	Anodyne	EBP	28	46
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](C)c2nccnc2C)CC1	ZINC000872133598	FE	On-Demand	Anodyne	PTR1	43	32
CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@@H](C)c2nccnc2C)CC1	ZINC000872133599	FE	On-Demand	Anodyne	PTR1	43	32
CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H](C)c2nccnc2C)CC1	ZINC000872133600	FE	On-Demand	Anodyne	PTR1	43	32
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](C)c2nccnc2C)CC1	ZINC000872133601	FE	On-Demand	Anodyne	PTR1	43	32
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133677	FH	On-Demand	Anodyne	KDR	17	41
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133677	FH	On-Demand	Anodyne	SLC1A1	21	43
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133677	FH	On-Demand	Anodyne	SLC1A3	19	43
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133677	FH	On-Demand	Anodyne	SLC1A2	34	43
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133678	FH	On-Demand	Anodyne	KDR	17	41
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133678	FH	On-Demand	Anodyne	SLC1A1	21	43
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133678	FH	On-Demand	Anodyne	SLC1A3	19	43
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133678	FH	On-Demand	Anodyne	SLC1A2	34	43
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133679	FH	On-Demand	Anodyne	KDR	17	41
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133679	FH	On-Demand	Anodyne	SLC1A1	21	43
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133679	FH	On-Demand	Anodyne	SLC1A3	19	43
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133679	FH	On-Demand	Anodyne	SLC1A2	34	43
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133680	FH	On-Demand	Anodyne	KDR	17	41
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133680	FH	On-Demand	Anodyne	SLC1A1	21	43
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133680	FH	On-Demand	Anodyne	SLC1A3	19	43
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872133680	FH	On-Demand	Anodyne	SLC1A2	34	43
Cc1nccnc1[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872133691	GG	On-Demand	Anodyne	NAMPT	25	41
Cc1nccnc1[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872133692	GG	On-Demand	Anodyne	NAMPT	25	41
Cc1nccnc1[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872133693	GG	On-Demand	Anodyne	NAMPT	25	41
Cc1nccnc1[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872133694	GG	On-Demand	Anodyne	NAMPT	25	41
CC[C@H](N[C@H](C)c1ccc(C#N)cc1)[C@@H](O)c1ccccc1	ZINC000872133772	CH	On-Demand	Mild	CTRB_BOVIN	45	32
CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)[C@@H](O)c1ccccc1	ZINC000872133773	CH	On-Demand	Mild	CTRB_BOVIN	45	32
CC[C@H](N[C@H](C)c1ccc(C#N)cc1)[C@H](O)c1ccccc1	ZINC000872133774	CH	On-Demand	Mild	CTRB_BOVIN	45	32
CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)[C@H](O)c1ccccc1	ZINC000872133775	CH	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@@H](Cn1cncn1)NC1CC(Nc2ccccc2)C1	ZINC000872133878	CD	On-Demand	Anodyne	HIS3	52	37
Cc1nccnc1[C@H](C)NC1CCN(Cc2ccccc2Cl)CC1	ZINC000872133880	EH	On-Demand	Anodyne	SIGMAR1	17	45
Cc1nccnc1[C@@H](C)NC1CCN(Cc2ccccc2Cl)CC1	ZINC000872133881	EH	On-Demand	Anodyne	SIGMAR1	17	45
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872133918	GF	On-Demand	Anodyne	FDFT1	20	46
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872133919	GF	On-Demand	Anodyne	FDFT1	20	46
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872133920	GF	On-Demand	Anodyne	FDFT1	20	46
CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872133921	GF	On-Demand	Anodyne	FDFT1	20	46
CC[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)[C@@H](O)c1ccccc1	ZINC000872133946	EF	On-Demand	Anodyne	L3MBTL3	56	34
CC[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)[C@H](O)c1ccccc1	ZINC000872133949	EF	On-Demand	Anodyne	L3MBTL3	56	34
NS(=O)(=O)c1ccc2c(c1)[C@H](NC1CC(Nc3ccccc3)C1)CCC2	ZINC000872133958	FF	On-Demand	Anodyne	CA7	25	40
NS(=O)(=O)c1ccc2c(c1)[C@H](NC1CC(Nc3ccccc3)C1)CCC2	ZINC000872133958	FF	On-Demand	Anodyne	CA14	15	40
NS(=O)(=O)c1ccc2c(c1)[C@@H](NC1CC(Nc3ccccc3)C1)CCC2	ZINC000872133959	FF	On-Demand	Anodyne	CA7	25	40
NS(=O)(=O)c1ccc2c(c1)[C@@H](NC1CC(Nc3ccccc3)C1)CCC2	ZINC000872133959	FF	On-Demand	Anodyne	CA14	15	40
CC[C@H](N[C@@H](C)Cn1cncn1)[C@H](O)c1ccccc1	ZINC000872134090	CD	On-Demand	Anodyne	HIS3	71	39
CC[C@H](N[C@@H](C)Cn1cncn1)[C@@H](O)c1ccccc1	ZINC000872134091	CD	On-Demand	Anodyne	HIS3	71	39
CC[C@H](N[C@H](C)Cn1cncn1)[C@@H](O)c1ccccc1	ZINC000872134094	CD	On-Demand	Anodyne	HIS3	71	39
CC[C@H](N[C@H](C)Cn1cncn1)[C@H](O)c1ccccc1	ZINC000872134097	CD	On-Demand	Anodyne	HIS3	71	39
CC[C@@H](NC1CCC2(CC1)C(=O)Nc1ccccc12)[C@H](O)c1ccccc1	ZINC000872134152	FH	On-Demand	Anodyne	GALR1	40	35
CC[C@@H](NC1CCC2(CC1)C(=O)Nc1ccccc12)[C@@H](O)c1ccccc1	ZINC000872134155	FH	On-Demand	Anodyne	GALR1	40	35
c1ccc(NC2CC(NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872134183	EG	On-Demand	Anodyne	DRD4	36	46
c1ccc(NC2CC(NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872134183	EG	On-Demand	Anodyne	ACHE	31	45
c1ccc(NC2CC(NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872134183	EG	On-Demand	Anodyne	LTA4H	23	46
c1ccc(NC2CC(NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872134183	EG	On-Demand	Anodyne	SIGMAR1	43	44
c1ccc(NC2CC(NC3CCN(Cc4ccncc4)CC3)C2)cc1	ZINC000872134183	EG	On-Demand	Anodyne	MCHR1	17	42
CC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000872134189	EH	On-Demand	Anodyne	KCNK3	56	32
CC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000872134189	EH	On-Demand	Anodyne	KCNK9	42	32
CC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000872134191	EH	On-Demand	Anodyne	KCNK3	56	32
CC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000872134191	EH	On-Demand	Anodyne	KCNK9	42	32
CC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000872134193	EH	On-Demand	Anodyne	KCNK3	56	32
CC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000872134193	EH	On-Demand	Anodyne	KCNK9	42	32
CC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000872134194	EH	On-Demand	Anodyne	KCNK3	56	32
CC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000872134194	EH	On-Demand	Anodyne	KCNK9	42	32
CC[C@H](N[C@H](C)CC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000872134202	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](N[C@H](C)CC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000872134202	EG	On-Demand	Anodyne	RIR1_HHV11	59	34
CC[C@H](N[C@H](C)CC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000872134204	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](N[C@H](C)CC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000872134204	EG	On-Demand	Anodyne	RIR1_HHV11	59	34
CC[C@H](N[C@@H](C)CC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000872134206	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](N[C@@H](C)CC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000872134206	EG	On-Demand	Anodyne	RIR1_HHV11	59	34
CC[C@H](N[C@@H](C)CC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000872134207	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](N[C@@H](C)CC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000872134207	EG	On-Demand	Anodyne	RIR1_HHV11	59	34
Cc1nccnc1[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872134304	GE	On-Demand	Anodyne	NAMPT	20	40
Cc1nccnc1[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872134305	GE	On-Demand	Anodyne	NAMPT	20	40
Cc1nccnc1[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872134306	GE	On-Demand	Anodyne	NAMPT	20	40
Cc1nccnc1[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872134307	GE	On-Demand	Anodyne	NAMPT	20	40
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@@H](C)c1nccnc1C	ZINC000872134312	EG	On-Demand	Anodyne	GRM4	15	40
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@@H](C)c1nccnc1C	ZINC000872134312	EG	On-Demand	Anodyne	ENPP1	50	34
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H](C)c1nccnc1C	ZINC000872134313	EG	On-Demand	Anodyne	GRM4	15	40
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H](C)c1nccnc1C	ZINC000872134313	EG	On-Demand	Anodyne	ENPP1	50	34
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H](C)c1nccnc1C	ZINC000872134314	EG	On-Demand	Anodyne	GRM4	15	40
COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H](C)c1nccnc1C	ZINC000872134314	EG	On-Demand	Anodyne	ENPP1	50	34
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@@H](C)c1nccnc1C	ZINC000872134315	EG	On-Demand	Anodyne	GRM4	15	40
COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@@H](C)c1nccnc1C	ZINC000872134315	EG	On-Demand	Anodyne	ENPP1	50	34
CCCCCOc1ccc([C@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872134354	EJ	On-Demand	Anodyne	ACACB	15	40
CCCCCOc1ccc([C@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872134354	EJ	On-Demand	Anodyne	PLA2G4B	62	33
CCCCCOc1ccc([C@@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872134355	EJ	On-Demand	Anodyne	ACACB	15	40
CCCCCOc1ccc([C@@H](C)N[C@H](C)c2nccnc2C)cc1	ZINC000872134355	EJ	On-Demand	Anodyne	PLA2G4B	62	33
CCCCCOc1ccc([C@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872134356	EJ	On-Demand	Anodyne	ACACB	15	40
CCCCCOc1ccc([C@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872134356	EJ	On-Demand	Anodyne	PLA2G4B	62	33
CCCCCOc1ccc([C@@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872134357	EJ	On-Demand	Anodyne	ACACB	15	40
CCCCCOc1ccc([C@@H](C)N[C@@H](C)c2nccnc2C)cc1	ZINC000872134357	EJ	On-Demand	Anodyne	PLA2G4B	62	33
Cc1cccc(NC(=O)C[C@H](C)N[C@H](C)c2nccnc2C)c1	ZINC000872134386	DG	On-Demand	Anodyne	KCNK3	57	38
Cc1cccc(NC(=O)C[C@H](C)N[C@@H](C)c2nccnc2C)c1	ZINC000872134389	DG	On-Demand	Anodyne	KCNK3	57	38
CC[C@H](N[C@@H](C)CS(=O)(=O)CC)[C@H](O)c1ccccc1	ZINC000872134399	CD	On-Demand	Anodyne	AOC3	16	43
CC[C@H](N[C@@H](C)CS(=O)(=O)CC)[C@@H](O)c1ccccc1	ZINC000872134400	CD	On-Demand	Anodyne	AOC3	16	43
CC[C@H](N[C@H](C)CS(=O)(=O)CC)[C@@H](O)c1ccccc1	ZINC000872134401	CD	On-Demand	Anodyne	AOC3	16	43
CC[C@H](N[C@H](C)CS(=O)(=O)CC)[C@H](O)c1ccccc1	ZINC000872134402	CD	On-Demand	Anodyne	AOC3	16	43
CCOC(=O)NC1CCC(N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872134403	EG	On-Demand	Anodyne	XIAP	34	41
CCOC(=O)NC1CCC(N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000872134404	EG	On-Demand	Anodyne	XIAP	34	41
CCOC(=O)NC1CCC(N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872134405	EG	On-Demand	Anodyne	XIAP	34	41
CCOC(=O)NC1CCC(N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000872134406	EG	On-Demand	Anodyne	XIAP	34	41
CC[C@@H](NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000872134407	DF	On-Demand	Anodyne	SIGMAR1	24	41
CC[C@@H](NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000872134410	DF	On-Demand	Anodyne	SIGMAR1	24	41
CC(C)(C)CC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134411	EH	On-Demand	Anodyne	EPHX2	26	41
CC(C)(C)CC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134411	EH	On-Demand	Anodyne	CCR8	85	41
CC(C)(C)CC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134411	EH	On-Demand	Anodyne	SFRP1	104	40
CC(C)(C)CC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134411	EH	On-Demand	Anodyne	WNT3	83	40
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	CHRM1	17	59
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	P2RY12	114	39
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	GRIN2B	24	41
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	TGM2	32	40
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	F13A1	52	40
CCOC(=O)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134461	DF	On-Demand	Anodyne	CCR8	68	45
CC[C@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)[C@H](O)c1ccccc1	ZINC000872134477	EH	On-Demand	Anodyne	GRIN2B	19	47
CC[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)[C@@H](O)c1ccccc1	ZINC000872134478	EH	On-Demand	Anodyne	GRIN2B	19	47
CC[C@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)[C@@H](O)c1ccccc1	ZINC000872134479	EH	On-Demand	Anodyne	GRIN2B	19	47
CC[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)[C@H](O)c1ccccc1	ZINC000872134480	EH	On-Demand	Anodyne	GRIN2B	19	47
CC[C@@H](NC1CCN(C(=O)OCC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872134502	EG	On-Demand	Anodyne	CHRM1	16	45
CC[C@@H](NC1CCN(C(=O)OCC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000872134502	EG	On-Demand	Anodyne	GRIN2B	22	42
CC[C@@H](NC1CCN(C(=O)OCC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872134508	EG	On-Demand	Anodyne	CHRM1	16	45
CC[C@@H](NC1CCN(C(=O)OCC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000872134508	EG	On-Demand	Anodyne	GRIN2B	22	42
CC[C@H](N[C@H](C)c1ccncc1)[C@@H](O)c1ccccc1	ZINC000872134528	CG	On-Demand	Anodyne	CSNK1G1	17	42
CC[C@H](N[C@@H](C)c1ccncc1)[C@@H](O)c1ccccc1	ZINC000872134530	CG	On-Demand	Anodyne	CSNK1G1	17	42
CC[C@H](N[C@@H](C)c1ccncc1)[C@H](O)c1ccccc1	ZINC000872134532	CG	On-Demand	Anodyne	CSNK1G1	17	42
CC[C@H](N[C@H](C)c1ccncc1)[C@H](O)c1ccccc1	ZINC000872134534	CG	On-Demand	Anodyne	CSNK1G1	17	42
O=C(c1ccoc1)N1CCC(NC2CC(Nc3ccccc3)C2)CC1	ZINC000872134719	EG	On-Demand	Anodyne	L3MBTL3	54	39
c1ccc(NC2CC(NC3CCN(CC4CC4)CC3)C2)cc1	ZINC000872134762	CG	On-Demand	Anodyne	SIGMAR1	23	45
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	CA2	45	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	CA1	35	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	CA4	32	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	CA12	30	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	CA9	35	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	MTCA1	28	40
C[C@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134775	EF	On-Demand	Anodyne	P96878_MYCTU	35	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	CA2	45	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	CA1	35	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	CA4	32	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	CA12	30	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	CA9	35	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	MTCA1	28	40
C[C@@H](NC1CC(Nc2ccccc2)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000872134777	EF	On-Demand	Anodyne	P96878_MYCTU	35	40
COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872134850	ED	On-Demand	Anodyne	MTNR1B	15	40
COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872134851	ED	On-Demand	Anodyne	MTNR1B	15	40
COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872134852	ED	On-Demand	Anodyne	MTNR1B	15	40
COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872134853	ED	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)Cn2cncn2)c1	ZINC000872134884	DD	On-Demand	Anodyne	HIS3	67	38
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)Cn2cncn2)c1	ZINC000872134886	DD	On-Demand	Anodyne	HIS3	67	38
CC[C@H](N[C@H]1CCCc2cccnc21)[C@H](O)c1ccccc1	ZINC000872134915	CH	On-Demand	Anodyne	CXCR4	68	36
CC[C@H](N[C@H]1CCCc2cccnc21)[C@@H](O)c1ccccc1	ZINC000872134916	CH	On-Demand	Anodyne	CXCR4	68	36
CC[C@H](N[C@@H]1CCCc2cccnc21)[C@@H](O)c1ccccc1	ZINC000872134917	CH	On-Demand	Anodyne	CXCR4	68	36
CC[C@H](N[C@@H]1CCCc2cccnc21)[C@H](O)c1ccccc1	ZINC000872134918	CH	On-Demand	Anodyne	CXCR4	68	36
CC[C@@H](NCc1nonc1C)c1nccn1C	ZINC000872135046	BD	On-Demand	Anodyne	CASP3	48	37
CC[C@@H](NCc1nonc1C)c1nccn1C	ZINC000872135046	BD	On-Demand	Anodyne	CASP7	51	37
CC[C@H](NCc1nonc1C)c1nccn1C	ZINC000872135050	BD	On-Demand	Anodyne	CASP3	48	37
CC[C@H](NCc1nonc1C)c1nccn1C	ZINC000872135050	BD	On-Demand	Anodyne	CASP7	51	37
Cc1nonc1CN[C@H](C)c1nccn1C	ZINC000872135051	BC	On-Demand	Anodyne	CASP3	42	36
Cc1nonc1CN[C@H](C)c1nccn1C	ZINC000872135051	BC	On-Demand	Anodyne	CASP7	44	36
Cc1nonc1CN[C@@H](C)c1nccn1C	ZINC000872135054	BC	On-Demand	Anodyne	CASP3	42	36
Cc1nonc1CN[C@@H](C)c1nccn1C	ZINC000872135054	BC	On-Demand	Anodyne	CASP7	44	36
Cc1nccnc1[C@@H](C)N[C@@H](C)c1cnn(-c2ccccc2)c1	ZINC000872135065	DG	On-Demand	Anodyne	GRM4	22	40
Cc1nccnc1[C@H](C)N[C@H](C)c1cnn(-c2ccccc2)c1	ZINC000872135066	DG	On-Demand	Anodyne	GRM4	22	40
Cc1nccnc1[C@@H](C)N[C@H](C)c1cnn(-c2ccccc2)c1	ZINC000872135067	DG	On-Demand	Anodyne	GRM4	22	40
Cc1nccnc1[C@H](C)N[C@@H](C)c1cnn(-c2ccccc2)c1	ZINC000872135068	DG	On-Demand	Anodyne	GRM4	22	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)CC(=O)Nc2ccccc2)c1	ZINC000872135136	FG	On-Demand	Anodyne	MTNR1B	42	47
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)CC(=O)Nc2ccccc2)c1	ZINC000872135138	FG	On-Demand	Anodyne	MTNR1B	42	47
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)Cc2cccs2)c1	ZINC000872135166	EG	On-Demand	Anodyne	BMP1	19	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)Cc2cccs2)c1	ZINC000872135169	EG	On-Demand	Anodyne	BMP1	19	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccncc3)CC2)c1	ZINC000872135175	GF	On-Demand	Anodyne	DRD4	22	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccncc3)CC2)c1	ZINC000872135175	GF	On-Demand	Anodyne	SIGMAR1	25	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccncc3)CC2)c1	ZINC000872135175	GF	On-Demand	Anodyne	SSTR5	79	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccncc3)CC2)c1	ZINC000872135175	GF	On-Demand	Anodyne	PDK1	41	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccncc3)CC2)c1	ZINC000872135175	GF	On-Demand	Anodyne	MCHR1	25	43
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)CCc2cccnc2)c1	ZINC000872135182	EG	On-Demand	Anodyne	PTAFR	31	46
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)CCc2cccnc2)c1	ZINC000872135184	EG	On-Demand	Anodyne	PTAFR	31	46
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000872135195	CE	On-Demand	Anodyne	KCNQ2	47	38
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000872135195	CE	On-Demand	Anodyne	EPHX2	25	42
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000872135195	CE	On-Demand	Anodyne	XIAP	57	39
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000872135195	CE	On-Demand	Anodyne	CCR8	43	40
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872135197	CE	On-Demand	Anodyne	KCNQ2	47	38
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872135197	CE	On-Demand	Anodyne	EPHX2	25	42
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872135197	CE	On-Demand	Anodyne	XIAP	57	39
CC[C@@H](NC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000872135197	CE	On-Demand	Anodyne	CCR8	43	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCC(CNC(C)=O)CC2)c1	ZINC000872135198	FE	On-Demand	Anodyne	NQO2	31	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCC(CNC(C)=O)CC2)c1	ZINC000872135198	FE	On-Demand	Anodyne	MTNR1A	82	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCC(CNC(C)=O)CC2)c1	ZINC000872135198	FE	On-Demand	Anodyne	MTNR1B	79	43
Cc1nonc1CN[C@H](C)CC(=O)OC(C)(C)C	ZINC000872135269	CD	On-Demand	Anodyne	MLYCD	15	40
Cc1nonc1CN[C@@H](C)CC(=O)OC(C)(C)C	ZINC000872135270	CD	On-Demand	Anodyne	MLYCD	15	40
Cc1nonc1CN[C@H](C)c1cccc([N+](=O)[O-])c1C	ZINC000872135289	CE	On-Demand	Bother	GSTM2	45	32
Cc1nonc1CN[C@@H](C)c1cccc([N+](=O)[O-])c1C	ZINC000872135290	CE	On-Demand	Bother	GSTM2	45	32
Cc1nccnc1[C@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135347	FG	On-Demand	Anodyne	CHRM2	15	41
Cc1nccnc1[C@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135347	FG	On-Demand	Anodyne	P2RX7	17	41
Cc1nccnc1[C@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135347	FG	On-Demand	Anodyne	EPHX2	25	53
Cc1nccnc1[C@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135347	FG	On-Demand	Anodyne	CCR8	50	32
Cc1nccnc1[C@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135347	FG	On-Demand	Anodyne	SFRP1	29	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135348	FG	On-Demand	Anodyne	CHRM2	15	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135348	FG	On-Demand	Anodyne	P2RX7	17	41
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135348	FG	On-Demand	Anodyne	EPHX2	25	53
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135348	FG	On-Demand	Anodyne	CCR8	50	32
Cc1nccnc1[C@@H](C)NC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000872135348	FG	On-Demand	Anodyne	SFRP1	29	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(c3ccccn3)CC2)c1	ZINC000872135496	FF	On-Demand	Anodyne	DRD4	19	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(c3ccccn3)CC2)c1	ZINC000872135496	FF	On-Demand	Anodyne	EBP	27	43
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](O)c1ccccc1	ZINC000872135497	DH	On-Demand	Bother	CACNA1D	58	37
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H](O)c1ccccc1	ZINC000872135498	DH	On-Demand	Bother	CACNA1D	58	37
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@H](O)c1ccccc1	ZINC000872135501	DH	On-Demand	Bother	CACNA1D	58	37
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](O)c1ccccc1	ZINC000872135502	DH	On-Demand	Bother	CACNA1D	58	37
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C(C)C)CC2)c1	ZINC000872135541	EF	On-Demand	Anodyne	EHMT2	46	30
Cc1nonc1CN[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872135555	DF	On-Demand	Anodyne	GPR119	40	43
Cc1nonc1CN[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872135556	DF	On-Demand	Anodyne	GPR119	40	43
Cc1nonc1CN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872135677	DF	On-Demand	Anodyne	LTA4H	15	41
Cc1nonc1CN[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872135679	DF	On-Demand	Anodyne	LTA4H	15	41
Cc1nonc1CN[C@H](C)CCc1c[nH]c2ccccc12	ZINC000872135784	CF	On-Demand	Anodyne	MPO	22	41
Cc1nonc1CN[C@@H](C)CCc1c[nH]c2ccccc12	ZINC000872135785	CF	On-Demand	Anodyne	MPO	22	41
COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H](C)c2nccnc2C)c1	ZINC000872135845	FF	On-Demand	Anodyne	KCNK3	48	35
COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H](C)c2nccnc2C)c1	ZINC000872135846	FF	On-Demand	Anodyne	KCNK3	48	35
COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H](C)c2nccnc2C)c1	ZINC000872135848	FF	On-Demand	Anodyne	KCNK3	48	35
COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H](C)c2nccnc2C)c1	ZINC000872135851	FF	On-Demand	Anodyne	KCNK3	48	35
Cc1nccnc1[C@@H](C)N[C@@H](C)CCN1C(=O)c2ccccc2C1=O	ZINC000872136001	EF	On-Demand	Anodyne	MMP9	15	42
Cc1nccnc1[C@H](C)N[C@@H](C)CCN1C(=O)c2ccccc2C1=O	ZINC000872136005	EF	On-Demand	Anodyne	MMP9	15	42
Cc1nccnc1[C@H](C)N[C@H](C)CCN1C(=O)c2ccccc2C1=O	ZINC000872136007	EF	On-Demand	Anodyne	MMP9	15	42
Cc1nccnc1[C@@H](C)N[C@H](C)CCN1C(=O)c2ccccc2C1=O	ZINC000872136012	EF	On-Demand	Anodyne	MMP9	15	42
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2ccccc2O)c1	ZINC000872136098	EG	On-Demand	Clean	HDAC2	20	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2ccccc2O)c1	ZINC000872136100	EG	On-Demand	Clean	HDAC2	20	41
Cc1nccnc1[C@H](C)N[C@@H](C)CC(=O)Nc1cccc(Br)c1	ZINC000872136163	GH	On-Demand	Anodyne	EGFR	38	43
Cc1nccnc1[C@@H](C)N[C@H](C)CC(=O)Nc1cccc(Br)c1	ZINC000872136165	GH	On-Demand	Anodyne	EGFR	38	43
Cc1nccnc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cccc(Br)c1	ZINC000872136166	GH	On-Demand	Anodyne	EGFR	38	43
Cc1nccnc1[C@H](C)N[C@H](C)CC(=O)Nc1cccc(Br)c1	ZINC000872136167	GH	On-Demand	Anodyne	EGFR	38	43
Cc1nonc1CN[C@H](C)c1ccnn1-c1ccccc1	ZINC000872136322	CE	On-Demand	Anodyne	CASP3	49	38
Cc1nonc1CN[C@H](C)c1ccnn1-c1ccccc1	ZINC000872136322	CE	On-Demand	Anodyne	CASP7	51	33
Cc1nonc1CN[C@@H](C)c1ccnn1-c1ccccc1	ZINC000872136323	CE	On-Demand	Anodyne	CASP3	49	38
Cc1nonc1CN[C@@H](C)c1ccnn1-c1ccccc1	ZINC000872136323	CE	On-Demand	Anodyne	CASP7	51	33
CCC[C@@H](NCc1nonc1C)c1cccc([N+](=O)[O-])c1	ZINC000872136349	CF	On-Demand	Bother	CACNA1D	44	33
CCC[C@H](NCc1nonc1C)c1cccc([N+](=O)[O-])c1	ZINC000872136350	CF	On-Demand	Bother	CACNA1D	44	33
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	HTR1A	19	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	DRD2	26	45
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	DRD4	32	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	ACHE	16	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	HTR2A	22	49
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	DRD3	17	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	HTR7	17	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	SIGMAR1	55	48
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	BCHE	15	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	CCR3	24	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	EBP	34	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	ABCB1	52	39
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	MCHR1	22	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000872136400	GG	On-Demand	Anodyne	BIRC2	31	40
Cc1nonc1CN[C@@H](C)c1ccc(OCc2ccccc2)cc1	ZINC000872136524	DH	On-Demand	Anodyne	MAOB	16	43
Cc1nonc1CN[C@H](C)c1ccc(OCc2ccccc2)cc1	ZINC000872136526	DH	On-Demand	Anodyne	MAOB	16	43
CCOC(=O)N1CCC(N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136568	FE	On-Demand	Anodyne	MMP13	15	40
CCOC(=O)N1CCC(N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136568	FE	On-Demand	Anodyne	CCR8	22	40
CCOC(=O)N1CCC(N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136569	FE	On-Demand	Anodyne	MMP13	15	40
CCOC(=O)N1CCC(N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136569	FE	On-Demand	Anodyne	CCR8	22	40
CCOC(=O)N1CCC(N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136570	FE	On-Demand	Anodyne	MMP13	15	40
CCOC(=O)N1CCC(N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136570	FE	On-Demand	Anodyne	CCR8	22	40
CCOC(=O)N1CCC(N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136571	FE	On-Demand	Anodyne	MMP13	15	40
CCOC(=O)N1CCC(N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000872136571	FE	On-Demand	Anodyne	CCR8	22	40
O=C(Nc1ccc(N2CCCCC2)nc1)c1ccc(-n2cccn2)nc1	ZINC000872136774	EF	On-Demand	Anodyne	PRNP	54	48
O=C(Nc1ccc(N2CCCCC2)nc1)c1ccc(-n2cccn2)nc1	ZINC000872136774	EF	On-Demand	Anodyne	HDAC1	21	41
O=C(Nc1ccc(N2CCCCC2)nc1)c1ccc(-n2cccn2)nc1	ZINC000872136774	EF	On-Demand	Anodyne	DGAT1	43	47
O=C(Nc1ccc(N2CCCCC2)nc1)c1ccc(-n2cccn2)nc1	ZINC000872136774	EF	On-Demand	Anodyne	HPGDS	19	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	DRD2	32	50
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	DRD4	59	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	ACHE	51	48
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	DRD3	24	46
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	HTR4	16	46
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	SIGMAR1	67	60
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	SSTR5	72	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	BCHE	18	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	CCR3	35	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	SLC18A3	15	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	MCHR1	33	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000872136904	GG	On-Demand	Anodyne	CCR8	29	46
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136915	FG	On-Demand	Anodyne	MTNR1A	33	42
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136915	FG	On-Demand	Anodyne	MTNR1B	39	42
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136915	FG	On-Demand	Anodyne	KCNK3	38	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136915	FG	On-Demand	Anodyne	KCNK9	33	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136916	FG	On-Demand	Anodyne	MTNR1A	33	42
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136916	FG	On-Demand	Anodyne	MTNR1B	39	42
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136916	FG	On-Demand	Anodyne	KCNK3	38	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2cccc(NC(C)=O)c2)c1	ZINC000872136916	FG	On-Demand	Anodyne	KCNK9	33	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)Cc2ccc(OC)c(OC)c2)c1	ZINC000872136953	GG	On-Demand	Anodyne	ADRB2	18	56
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)Cc2ccc(OC)c(OC)c2)c1	ZINC000872136960	GG	On-Demand	Anodyne	ADRB2	18	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(c3nccs3)CC2)c1	ZINC000872137320	GF	On-Demand	Anodyne	NPBWR1	19	43
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	HTR1A	80	43
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	DRD2	60	43
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	DRD4	34	40
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	ADRA1D	69	41
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	ADRA1A	60	41
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	ADRA1B	55	41
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	DRD3	60	42
COc1ccccc1N1CCC(NCc2nonc2C)CC1	ZINC000872137371	DE	On-Demand	Anodyne	HTR7	49	41
CCOc1ccc([C@@H](C)Nc2cnn(CC)c2C)cc1	ZINC000872137397	CH	On-Demand	Anodyne	CACNA2D1	41	39
Cc1nonc1CN[C@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872137420	DD	On-Demand	Anodyne	G2YM83_BOTF4	65	33
Cc1nonc1CN[C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000872137422	DD	On-Demand	Anodyne	G2YM83_BOTF4	65	33
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C3CCCCC3)CC2)c1	ZINC000872137468	GH	On-Demand	Anodyne	CHRM2	25	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C3CCCCC3)CC2)c1	ZINC000872137468	GH	On-Demand	Anodyne	CHRM4	17	41
CCCCCOc1ccc([C@@H](C)NCc2nonc2C)cc1	ZINC000872137471	DH	On-Demand	Anodyne	PLA2G4B	47	32
CCCCCOc1ccc([C@H](C)NCc2nonc2C)cc1	ZINC000872137472	DH	On-Demand	Anodyne	PLA2G4B	47	32
Cc1ccc2c(c1)[C@@H](NCc1nonc1C)CCC2	ZINC000872137498	CF	On-Demand	Anodyne	KCNN3	15	46
Cc1ccc2c(c1)[C@H](NCc1nonc1C)CCC2	ZINC000872137499	CF	On-Demand	Anodyne	KCNN3	15	46
CC[C@H](N[C@H](C)CC(=O)Nc1ccccc1)[C@@H](O)c1ccccc1	ZINC000872137562	EH	On-Demand	Anodyne	NPY5R	32	40
CC[C@H](N[C@H](C)CC(=O)Nc1ccccc1)[C@H](O)c1ccccc1	ZINC000872137565	EH	On-Demand	Anodyne	NPY5R	32	40
CC[C@H](N[C@@H](C)CC(=O)Nc1ccccc1)[C@@H](O)c1ccccc1	ZINC000872137568	EH	On-Demand	Anodyne	NPY5R	32	40
CC[C@H](N[C@@H](C)CC(=O)Nc1ccccc1)[C@H](O)c1ccccc1	ZINC000872137572	EH	On-Demand	Anodyne	NPY5R	32	40
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	CHRM2	18	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	CHRM1	15	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	DRD2	19	46
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	DRD4	48	47
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	ACHE	47	48
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	SLC6A3	29	49
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	CHRM3	21	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	SIGMAR1	69	51
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	SSTR5	51	35
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000872137682	EH	On-Demand	Anodyne	MCHR1	22	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	CHRM2	18	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	CHRM1	15	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	DRD2	19	46
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	DRD4	48	47
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	ACHE	47	48
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	SLC6A3	29	49
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	CHRM3	21	43
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	SIGMAR1	69	51
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	SSTR5	51	35
CC[C@@H](NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000872137687	EH	On-Demand	Anodyne	MCHR1	22	43
Cc1nonc1CN[C@@H]1CCCc2ccc(Cl)cc21	ZINC000872137816	CG	On-Demand	Anodyne	KCNN3	15	44
Cc1nonc1CN[C@H]1CCCc2ccc(Cl)cc21	ZINC000872137817	CG	On-Demand	Anodyne	KCNN3	15	44
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2ccc(NC(C)=O)cc2)c1	ZINC000872137861	FG	On-Demand	Anodyne	MTNR1A	31	44
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2ccc(NC(C)=O)cc2)c1	ZINC000872137861	FG	On-Demand	Anodyne	MTNR1B	38	44
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2ccc(NC(C)=O)cc2)c1	ZINC000872137862	FG	On-Demand	Anodyne	MTNR1A	31	44
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2ccc(NC(C)=O)cc2)c1	ZINC000872137862	FG	On-Demand	Anodyne	MTNR1B	38	44
CC[C@H](N[C@@H](C)C(C)C)[C@H](O)c1ccccc1	ZINC000872137917	BG	On-Demand	Anodyne	AOC3	17	44
CC[C@H](N[C@@H](C)C(C)C)[C@@H](O)c1ccccc1	ZINC000872137918	BG	On-Demand	Anodyne	AOC3	17	44
CC[C@H](N[C@H](C)C(C)C)[C@@H](O)c1ccccc1	ZINC000872137919	BG	On-Demand	Anodyne	AOC3	17	44
CC[C@H](N[C@H](C)C(C)C)[C@H](O)c1ccccc1	ZINC000872137920	BG	On-Demand	Anodyne	AOC3	17	44
Cc1nonc1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872137952	CE	On-Demand	Bother	GSTM2	40	31
Cc1nonc1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872137954	CE	On-Demand	Bother	GSTM2	40	31
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)c1	ZINC000872137957	GG	On-Demand	Anodyne	GRIN2B	18	51
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1	ZINC000872137962	GG	On-Demand	Anodyne	GRIN2B	18	51
CCCOc1ccc([C@@H](C)NCc2nonc2C)cc1	ZINC000872137981	CG	On-Demand	Anodyne	ACACA	15	43
CCCOc1ccc([C@@H](C)NCc2nonc2C)cc1	ZINC000872137981	CG	On-Demand	Anodyne	ACACB	18	43
CCCOc1ccc([C@H](C)NCc2nonc2C)cc1	ZINC000872137984	CG	On-Demand	Anodyne	ACACA	15	43
CCCOc1ccc([C@H](C)NCc2nonc2C)cc1	ZINC000872137984	CG	On-Demand	Anodyne	ACACB	18	43
CC[C@H](NCc1nonc1C)c1cnn(C)c1	ZINC000872138001	BD	On-Demand	Anodyne	CASP7	42	34
CC[C@@H](NCc1nonc1C)c1cnn(C)c1	ZINC000872138003	BD	On-Demand	Anodyne	CASP7	42	34
Cc1nonc1CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138058	DE	On-Demand	Bother	GSTM2	71	36
Cc1nonc1CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138058	DE	On-Demand	Bother	COLA	74	33
Cc1nonc1CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138058	DE	On-Demand	Bother	GSTP1	50	36
Cc1nonc1CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138059	DE	On-Demand	Bother	GSTM2	71	36
Cc1nonc1CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138059	DE	On-Demand	Bother	COLA	74	33
Cc1nonc1CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000872138059	DE	On-Demand	Bother	GSTP1	50	36
CCOC(=O)C1CCN(C(=O)C[C@@H](C)Nc2cnn(CC)c2C)CC1	ZINC000872138226	FE	On-Demand	Anodyne	PTR1	45	34
CCOC(=O)C1CCN(C(=O)C[C@H](C)Nc2cnn(CC)c2C)CC1	ZINC000872138228	FE	On-Demand	Anodyne	PTR1	45	34
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(CC(F)(F)F)CC2)c1	ZINC000872138260	GF	On-Demand	Anodyne	HPGDS	33	44
CC[C@H](N[C@@H](C)CC(N)=O)[C@@H](O)c1ccccc1	ZINC000872138280	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@H](C)CC(N)=O)[C@@H](O)c1ccccc1	ZINC000872138281	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@H](C)CC(N)=O)[C@H](O)c1ccccc1	ZINC000872138282	CD	On-Demand	Anodyne	AOC3	15	41
CC[C@H](N[C@@H](C)CC(N)=O)[C@H](O)c1ccccc1	ZINC000872138283	CD	On-Demand	Anodyne	AOC3	15	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)CCCc2cccnc2)c1	ZINC000872138327	FH	On-Demand	Anodyne	TBXAS1	18	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)CCCc2cccnc2)c1	ZINC000872138327	FH	On-Demand	Anodyne	PTAFR	37	52
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)CCCc2cccnc2)c1	ZINC000872138329	FH	On-Demand	Anodyne	TBXAS1	18	41
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)CCCc2cccnc2)c1	ZINC000872138329	FH	On-Demand	Anodyne	PTAFR	37	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C(C)=O)CC2)c1	ZINC000872138339	ED	On-Demand	Anodyne	MTNR1A	32	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C(C)=O)CC2)c1	ZINC000872138339	ED	On-Demand	Anodyne	MTNR1B	38	41
Cc1nonc1CN[C@H](C)Cn1cncn1	ZINC000872138365	BC	On-Demand	Anodyne	HIS3	70	35
Cc1nonc1CN[C@@H](C)Cn1cncn1	ZINC000872138379	BC	On-Demand	Anodyne	HIS3	70	35
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C3CC3)CC2)c1	ZINC000872138422	EE	On-Demand	Anodyne	ADRA1D	27	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C3CC3)CC2)c1	ZINC000872138422	EE	On-Demand	Anodyne	ADRA1A	19	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C3CC3)CC2)c1	ZINC000872138422	EE	On-Demand	Anodyne	ADRA1B	22	44
Cc1nonc1CN[C@H](C)Cc1ccc(F)cc1Cl	ZINC000872138507	CF	On-Demand	Anodyne	P2RX7	38	40
Cc1nonc1CN[C@@H](C)Cc1ccc(F)cc1Cl	ZINC000872138508	CF	On-Demand	Anodyne	P2RX7	38	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccn3)CC2)c1	ZINC000872138520	GF	On-Demand	Anodyne	DRD4	16	46
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccn3)CC2)c1	ZINC000872138520	GF	On-Demand	Anodyne	SSTR5	57	38
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(Cc3ccccn3)CC2)c1	ZINC000872138520	GF	On-Demand	Anodyne	MCHR1	15	42
COc1cccc([C@H](C)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138549	EG	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138549	EG	On-Demand	Anodyne	MTNR1B	22	41
COc1cccc([C@H](C)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138551	EG	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138551	EG	On-Demand	Anodyne	MTNR1B	22	41
COc1cccc([C@H](C)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138553	EG	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138553	EG	On-Demand	Anodyne	MTNR1B	22	41
COc1cccc([C@H](C)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138555	EG	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000872138555	EG	On-Demand	Anodyne	MTNR1B	22	41
CCOC(=O)C1CCC(Nc2cnn(CC)c2C)CC1	ZINC000872138633	CF	On-Demand	Anodyne	CD38	58	35
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000872138659	GG	On-Demand	Anodyne	GPR119	39	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)c2cn(C)nc2C)c1	ZINC000872138730	EF	On-Demand	Anodyne	LRRK2	15	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)c2cn(C)nc2C)c1	ZINC000872138731	EF	On-Demand	Anodyne	LRRK2	15	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@@H](C)CS(=O)(=O)c2ccccc2)c1	ZINC000872138759	GF	On-Demand	Anodyne	MMP13	17	40
COc1ccc(OC)c([C@H](O)[C@H](C)N[C@H](C)CS(=O)(=O)c2ccccc2)c1	ZINC000872138761	GF	On-Demand	Anodyne	MMP13	17	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCC(NC(C)=O)CC2)c1	ZINC000872138794	FE	On-Demand	Anodyne	MTNR1A	37	48
COc1ccc(OC)c([C@H](O)[C@H](C)NC2CCC(NC(C)=O)CC2)c1	ZINC000872138794	FE	On-Demand	Anodyne	MTNR1B	38	48
CC[C@@H](NC1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000872138861	CE	On-Demand	Anodyne	SLC6A3	16	42
CC[C@@H](NC1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000872138863	CE	On-Demand	Anodyne	SLC6A3	16	42
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCc3ccc(S(N)(=O)=O)cc32)CC1	ZINC000872138961	EE	On-Demand	Mild	CA7	25	42
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCc3ccc(S(N)(=O)=O)cc32)CC1	ZINC000872138961	EE	On-Demand	Mild	CA14	17	42
C#C[C@@H]1CC[C@@H](N[C@H]2CCCc3ccc(S(N)(=O)=O)cc32)CC1	ZINC000872138962	EE	On-Demand	Mild	CA7	25	42
C#C[C@@H]1CC[C@@H](N[C@H]2CCCc3ccc(S(N)(=O)=O)cc32)CC1	ZINC000872138962	EE	On-Demand	Mild	CA14	17	42
C#C[C@@H]1CC[C@@H](N[C@@H]2CCN(C(=O)C(F)(F)F)Cc3ccccc32)CC1	ZINC000872139162	FH	On-Demand	Mild	RBP4	73	40
C#C[C@@H]1CC[C@@H](N[C@H]2CCN(C(=O)C(F)(F)F)Cc3ccccc32)CC1	ZINC000872139163	FH	On-Demand	Mild	RBP4	73	40
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	CHRM2	29	44
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP13	46	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP2	24	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP3	47	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP8	25	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP9	33	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	TGM2	37	43
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP7	41	49
C#C[C@@H]1CC[C@@H](NC2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000872139205	GF	On-Demand	Mild	MMP1	45	49
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000872139208	DG	On-Demand	Mild	HRH3	16	43
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000872139208	DG	On-Demand	Mild	SIGMAR1	27	47
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	GRIN2B	24	45
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	PREP	24	41
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	TGM2	32	48
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	KLK5	40	39
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	F13A1	32	48
O=C(OCc1ccccc1)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872139232	DD	On-Demand	Anodyne	CCR8	22	40
C#C[C@@H]1CC[C@@H](N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1	ZINC000872139255	EI	On-Demand	Mild	EPHX2	15	44
C#C[C@@H]1CC[C@@H](N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1	ZINC000872139256	EI	On-Demand	Mild	EPHX2	15	44
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2ccc(OC)cc2)CC1	ZINC000872139258	DG	On-Demand	Mild	MTNR1B	16	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2ccc(OC)cc2)CC1	ZINC000872139259	DG	On-Demand	Mild	MTNR1B	16	43
C#C[C@@H]1CC[C@@H](NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000872139287	DG	On-Demand	Mild	DRD2	17	44
C#C[C@@H]1CC[C@@H](NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000872139287	DG	On-Demand	Mild	DRD4	22	47
C#C[C@@H]1CC[C@@H](NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000872139287	DG	On-Demand	Mild	HTR2A	15	54
C#C[C@@H]1CC[C@@H](NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000872139287	DG	On-Demand	Mild	SIGMAR1	62	56
C#C[C@@H]1CC[C@@H](N[C@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872139347	EH	On-Demand	Mild	SFRP1	42	33
C#C[C@@H]1CC[C@@H](N[C@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872139347	EH	On-Demand	Mild	WNT3	47	32
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872139349	EH	On-Demand	Mild	SFRP1	42	33
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)CC1	ZINC000872139349	EH	On-Demand	Mild	WNT3	47	32
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2cccnc2Cl)CC1	ZINC000872139445	DG	On-Demand	Mild	G2YM83_BOTF4	67	35
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2cccnc2Cl)CC1	ZINC000872139446	DG	On-Demand	Mild	G2YM83_BOTF4	67	35
C#C[C@@H]1CC[C@@H](NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000872139450	DG	On-Demand	Mild	GPR119	33	41
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2cccc(C)c2)CC1	ZINC000872139452	CG	On-Demand	Mild	KCNK3	48	35
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2cccc(C)c2)CC1	ZINC000872139453	CG	On-Demand	Mild	KCNK3	48	35
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000872139503	CF	On-Demand	Mild	SIGMAR1	23	43
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000872139505	DH	On-Demand	Mild	GPR119	31	41
C#C[C@@H]1CC[C@@H](N[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000872139507	DH	On-Demand	Mild	GPR119	31	41
C#C[C@@H]1CC[C@@H](N[C@@H](C)CCCc2cccnc2)CC1	ZINC000872139544	CH	On-Demand	Mild	PTAFR	28	42
C#C[C@@H]1CC[C@@H](N[C@H](C)CCCc2cccnc2)CC1	ZINC000872139545	CH	On-Demand	Mild	PTAFR	28	42
C#C[C@@H]1CC[C@@H](N[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872139707	DH	On-Demand	Mild	LTA4H	16	47
C#C[C@@H]1CC[C@@H](N[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872139707	DH	On-Demand	Mild	ACHP_LYMST	15	43
C#C[C@@H]1CC[C@@H](N[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872139708	DH	On-Demand	Mild	LTA4H	16	47
C#C[C@@H]1CC[C@@H](N[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872139708	DH	On-Demand	Mild	ACHP_LYMST	15	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)Cn2cncn2)CC1	ZINC000872139821	BD	On-Demand	Mild	HIS3	44	33
C#C[C@@H]1CC[C@@H](N[C@H](C)Cn2cncn2)CC1	ZINC000872139822	BD	On-Demand	Mild	HIS3	44	33
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139996	DH	On-Demand	Mild	ACHE	21	41
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139996	DH	On-Demand	Mild	SIGMAR1	40	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139996	DH	On-Demand	Mild	BIRC2	17	40
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139997	DH	On-Demand	Mild	ACHE	21	41
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139997	DH	On-Demand	Mild	SIGMAR1	40	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139997	DH	On-Demand	Mild	BIRC2	17	40
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139998	DH	On-Demand	Mild	ACHE	21	41
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139998	DH	On-Demand	Mild	SIGMAR1	40	43
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139998	DH	On-Demand	Mild	BIRC2	17	40
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139999	DH	On-Demand	Mild	ACHE	21	41
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139999	DH	On-Demand	Mild	SIGMAR1	40	43
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000872139999	DH	On-Demand	Mild	BIRC2	17	40
C#C[C@@H]1CC[C@@H](N[C@H]2CCCc3cccnc32)CC1	ZINC000872140002	CG	On-Demand	Mild	CXCR4	62	37
C#C[C@@H]1CC[C@@H](N[C@@H]2CCCc3cccnc32)CC1	ZINC000872140003	CG	On-Demand	Mild	CXCR4	62	37
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000872140018	DG	On-Demand	Mild	GPR119	17	40
C#C[C@@H]1CC[C@@H](N[C@@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000872140019	DG	On-Demand	Mild	GPR119	17	40
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000872140020	DG	On-Demand	Mild	GPR119	17	40
C#C[C@@H]1CC[C@@H](N[C@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000872140021	DG	On-Demand	Mild	GPR119	17	40
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	HTR1A	80	48
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	DRD2	65	56
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	DRD1	15	40
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	DRD4	32	42
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	ADRA1D	80	43
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	HTR2A	17	41
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	ADRA1A	68	43
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	ADRA1B	64	43
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	DRD3	61	56
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccc3OC)CC2)CC1	ZINC000872140042	DG	On-Demand	Mild	HTR7	48	48
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2cccc(OC)c2)CC1	ZINC000872140242	DG	On-Demand	Mild	MTNR1A	22	43
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2cccc(OC)c2)CC1	ZINC000872140242	DG	On-Demand	Mild	MTNR1B	29	45
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2cccc(OC)c2)CC1	ZINC000872140243	DG	On-Demand	Mild	MTNR1A	22	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2cccc(OC)c2)CC1	ZINC000872140243	DG	On-Demand	Mild	MTNR1B	29	45
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C[C@H]1c1ccccc1	ZINC000872140261	GF	On-Demand	Anodyne	CCR2	21	41
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C[C@@H]1c1ccccc1	ZINC000872140262	GF	On-Demand	Anodyne	CCR2	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](N[C@@H]3CCOC[C@H]3O)C[C@H]2C1	ZINC000872140267	ED	On-Demand	Anodyne	CCR2	27	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](N[C@@H]3CCOC[C@H]3O)CC[C@H]2C1	ZINC000872140268	ED	On-Demand	Anodyne	CCR2	27	41
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)N(C)c2ccccc2)CC1	ZINC000872140321	CG	On-Demand	Mild	FASN	29	40
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)N(C)c2ccccc2)CC1	ZINC000872140322	CG	On-Demand	Mild	FASN	29	40
C[C@@H](CCc1ccc(C(F)(F)F)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000872140329	DF	On-Demand	Anodyne	CCR2	23	43
C#C[C@@H]1CC[C@@H](NC2CCN(C(=O)CC)CC2)CC1	ZINC000872140453	CE	On-Demand	Mild	EPHX2	17	50
C#C[C@@H]1CC[C@@H](NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872140467	DH	On-Demand	Mild	LTA4H	16	47
C#C[C@@H]1CC[C@@H](NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000872140467	DH	On-Demand	Mild	ACHP_LYMST	15	43
C[C@@H](CCCc1cccnc1)N[C@@H]1CCOC[C@H]1O	ZINC000872140552	CD	On-Demand	Anodyne	PTAFR	31	43
C#C[C@@H]1CC[C@@H](NC2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872140612	EH	On-Demand	Mild	SFRP1	15	44
C#C[C@@H]1CC[C@@H](NC2CCN(C(=O)c3ccccc3Cl)CC2)CC1	ZINC000872140612	EH	On-Demand	Mild	L3MBTL3	60	45
C#C[C@@H]1CC[C@@H](NC2CCN(c3ccccn3)CC2)CC1	ZINC000872140655	CF	On-Demand	Mild	EBP	29	46
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	CHRM2	15	42
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	DRD2	20	48
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	DRD4	51	50
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	ACHE	47	50
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	DRD3	17	48
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	CHRM3	16	42
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	LTA4H	16	42
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	SIGMAR1	81	52
C#C[C@@H]1CC[C@@H](NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872140699	CG	On-Demand	Mild	MCHR1	17	44
C#C[C@@H]1CC[C@@H](N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872140700	EH	On-Demand	Mild	EPHX2	48	44
C#C[C@@H]1CC[C@@H](N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872140701	EH	On-Demand	Mild	EPHX2	48	44
C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CCOC[C@H]1O	ZINC000872140730	EE	On-Demand	Anodyne	CCR2	33	41
C#C[C@@H]1CC[C@@H](NC2CCN(C(=O)c3ccoc3)CC2)CC1	ZINC000872140760	DF	On-Demand	Mild	L3MBTL3	75	38
C[C@@H](CCc1c[nH]c2ccccc12)N[C@@H]1CCOC[C@H]1O	ZINC000872140782	CE	On-Demand	Anodyne	HTR1B	24	40
C[C@@H](CCc1c[nH]c2ccccc12)N[C@@H]1CCOC[C@H]1O	ZINC000872140782	CE	On-Demand	Anodyne	GHSR	44	38
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000872140790	EH	On-Demand	Mild	RBP4	18	43
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000872140791	EH	On-Demand	Mild	RBP4	18	43
C#C[C@@H]1CC[C@@H](N[C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000872140824	FI	On-Demand	Mild	RBP4	82	36
C#C[C@@H]1CC[C@@H](N[C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000872140825	FI	On-Demand	Mild	RBP4	82	36
C[C@@H](Cc1ccccc1C(F)(F)F)N[C@@H]1CCOC[C@H]1O	ZINC000872140928	DE	On-Demand	Anodyne	SLC16A1	43	33
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N[C@@H]1CCOC[C@H]1O	ZINC000872140935	CD	On-Demand	Anodyne	DRD4	19	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1N[C@@H]1CCOC[C@H]1O	ZINC000872140936	CD	On-Demand	Anodyne	DRD4	19	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1N[C@@H]1CCOC[C@H]1O	ZINC000872140937	CD	On-Demand	Anodyne	DRD4	19	42
O[C@@H]1COCC[C@H]1N[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872140946	EG	On-Demand	Anodyne	CCR2	31	45
O[C@@H]1COCC[C@H]1N[C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872140947	EG	On-Demand	Anodyne	CCR2	31	45
O[C@@H]1COCC[C@H]1N[C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872140948	EG	On-Demand	Anodyne	CCR2	31	45
O[C@@H]1COCC[C@H]1N[C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000872140949	EG	On-Demand	Anodyne	CCR2	31	45
CC(C)(C)OC(=O)N1CCC[C@@H](N[C@@H]2CCOC[C@H]2O)CC1	ZINC000872140993	DD	On-Demand	Anodyne	CCR2	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](N[C@@H]2CCOC[C@H]2O)CC1	ZINC000872140993	DD	On-Demand	Anodyne	GPR119	34	40
C[C@@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000872141047	DE	On-Demand	Anodyne	CCR2	26	45
C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1CCOC[C@H]1O	ZINC000872141081	CD	On-Demand	Bother	COLA	113	37
C[C@@H](Cc1cccc(C(F)(F)F)c1)N[C@@H]1CCOC[C@H]1O	ZINC000872141102	DE	On-Demand	Anodyne	CCR2	40	46
C[C@H]1CN(Cc2nc3c(o2)CCCC3)CCN1	ZINC000872141267	BD	On-Demand	Anodyne	MLNR	42	36
C[C@@H]1CN(Cc2nc3c(o2)CCCC3)CCN1	ZINC000872141268	BD	On-Demand	Anodyne	MLNR	42	36
CCCN(Cc1ccc(C)c(C(=O)OC)c1)C1CCNCC1	ZINC000872141271	DF	On-Demand	Anodyne	SLC6A2	23	45
CCCN(Cc1ccc(C)c(C(=O)OC)c1)C1CCNCC1	ZINC000872141271	DF	On-Demand	Anodyne	SLC6A4	15	45
CCNCC1CCN(Cc2cc(C(F)(F)F)co2)CC1	ZINC000872141295	CG	On-Demand	Anodyne	CACNA1I	49	39
CC(C)(C)OC(=O)N1CCC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872141356	DD	On-Demand	Anodyne	CCR2	32	42
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCOC[C@H]2O)C1	ZINC000872141418	CC	On-Demand	Anodyne	CCR2	25	41
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	DRD2	15	46
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	DRD4	39	44
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	ACHE	44	47
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	HTR4	49	39
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	SIGMAR1	36	46
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	SSTR5	74	40
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	CCR3	53	42
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	MCHR1	45	42
CNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141445	CE	On-Demand	Anodyne	CACNA1I	61	47
Cc1conc1CN(C1CC1)[C@@H]1CCNC1	ZINC000872141478	BD	On-Demand	Anodyne	SLC6A2	17	49
Cc1conc1CN(C1CC1)[C@H]1CCNC1	ZINC000872141479	BD	On-Demand	Anodyne	SLC6A2	17	49
CCCN(Cc1cc(C(F)(F)F)co1)[C@@H]1CCNC1	ZINC000872141524	CF	On-Demand	Anodyne	SLC6A2	21	46
CCCN(Cc1cc(C(F)(F)F)co1)[C@H]1CCNC1	ZINC000872141525	CF	On-Demand	Anodyne	SLC6A2	21	46
CCCN(Cc1cc(C(F)(F)F)co1)C1CCNCC1	ZINC000872141530	CG	On-Demand	Anodyne	SLC6A2	19	53
NC[C@H]1CCCN(Cc2cccc3ncccc23)C1	ZINC000872141535	CE	On-Demand	Anodyne	HNMT	41	34
COC[C@@H](N[C@@H]1CCOC[C@H]1O)c1cccc(C(F)(F)F)c1	ZINC000872141566	DE	On-Demand	Anodyne	CCR2	28	40
NC[C@@H]1CCCN(Cc2cccc3ncccc23)C1	ZINC000872141596	CE	On-Demand	Anodyne	HNMT	41	34
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	DRD2	16	45
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	DRD4	34	43
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	ACHE	43	46
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	HTR4	52	38
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	SIGMAR1	36	45
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	SSTR5	78	42
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	CCR3	49	41
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	MCHR1	46	43
CCNCC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141626	DF	On-Demand	Anodyne	CACNA1I	60	46
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@H]1CCNC1	ZINC000872141769	CE	On-Demand	Anodyne	SLC6A2	36	52
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@H]1CCNC1	ZINC000872141769	CE	On-Demand	Anodyne	SLC6A4	19	52
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@H]1CCNC1	ZINC000872141769	CE	On-Demand	Anodyne	MBTPS1	80	38
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@@H]1CCNC1	ZINC000872141770	CE	On-Demand	Anodyne	SLC6A2	36	52
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@@H]1CCNC1	ZINC000872141770	CE	On-Demand	Anodyne	SLC6A4	19	52
CCCN(Cc1ccc(C)c(C(=O)OC)c1)[C@@H]1CCNC1	ZINC000872141770	CE	On-Demand	Anodyne	MBTPS1	80	38
C[C@@H]1CN(Cc2cc(C(F)(F)F)co2)CCN1	ZINC000872141818	BE	On-Demand	Anodyne	MLNR	60	43
C[C@H]1CN(Cc2cc(C(F)(F)F)co2)CCN1	ZINC000872141819	BE	On-Demand	Anodyne	MLNR	60	43
FC(F)(F)c1coc(CN(C2CC2)[C@@H]2CCNC2)c1	ZINC000872141851	CF	On-Demand	Anodyne	SLC6A2	18	46
FC(F)(F)c1coc(CN(C2CC2)[C@H]2CCNC2)c1	ZINC000872141852	CF	On-Demand	Anodyne	SLC6A2	18	46
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	DRD2	20	44
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	DRD4	50	47
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	ACHE	31	43
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	DRD3	15	44
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	KCNH2	17	42
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	SIGMAR1	34	45
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	SSTR5	86	46
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	CCR3	45	48
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	UTS2R	20	40
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	MCHR1	59	48
CNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872141864	CD	On-Demand	Anodyne	CACNA1I	15	41
CC[C@@H](N[C@@H]1CCOC[C@H]1O)c1cccc([N+](=O)[O-])c1	ZINC000872141946	CD	On-Demand	Bother	CACNA1D	42	32
C[C@@H](CCc1ccc2c(c1)OCO2)N[C@@H]1CCOC[C@H]1O	ZINC000872142007	CD	On-Demand	Anodyne	NOS2	54	33
C1CCc2oc(CN3CCCNCC3)nc2C1	ZINC000872142219	BD	On-Demand	Anodyne	CXCR4	22	45
C[C@@H](CCc1cccc(C(F)(F)F)c1)N[C@@H]1CCOC[C@H]1O	ZINC000872142266	DF	On-Demand	Anodyne	CCR2	43	45
C1CCc2oc(CN3CCNCC3)nc2C1	ZINC000872142283	BC	On-Demand	Anodyne	CXCR4	21	41
CCCCCOc1ccc([C@@H](C)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000872142432	DG	On-Demand	Anodyne	PLA2G4B	65	33
Cc1conc1CN1CCC[C@@H](C(=O)N2CCNCC2)C1	ZINC000872142446	CC	On-Demand	Anodyne	SLC6A1	75	35
Cc1conc1CN1CCC[C@H](C(=O)N2CCNCC2)C1	ZINC000872142447	CC	On-Demand	Anodyne	SLC6A1	75	35
CCCOc1ccc([C@@H](C)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000872142464	CE	On-Demand	Anodyne	ACACA	16	47
CCCOc1ccc([C@@H](C)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000872142464	CE	On-Demand	Anodyne	ACACB	17	47
FC(F)(F)c1coc(CN2CCCNCC2)c1	ZINC000872142502	BE	On-Demand	Anodyne	CXCR4	20	44
FC(F)(F)c1coc(CN(C2CCNCC2)C2CC2)c1	ZINC000872142506	CG	On-Demand	Anodyne	SLC6A2	17	43
CCN(Cc1cc(C(F)(F)F)co1)[C@@H]1CCCNCC1	ZINC000872142881	CG	On-Demand	Anodyne	SLC6A2	18	40
CCN(Cc1cc(C(F)(F)F)co1)[C@H]1CCCNCC1	ZINC000872142882	CG	On-Demand	Anodyne	SLC6A2	18	40
COc1ccccc1[C@@H]1CNCCN1CCCS(=O)(=O)C(C)(C)C	ZINC000872142943	FE	On-Demand	Anodyne	MBTPS1	44	33
COc1ccccc1[C@@H]1CNCCN1C[C@@H]1C[C@H](OC)C1	ZINC000872143319	CE	On-Demand	Anodyne	MBTPS1	51	34
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)OC)c2)CC[C@H]1N	ZINC000872143443	CE	On-Demand	Anodyne	SSTR5	47	40
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)OC)c2)CC[C@H]1N	ZINC000872143443	CE	On-Demand	Anodyne	MCHR1	28	40
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)OC)c2)CC[C@@H]1N	ZINC000872143446	CE	On-Demand	Anodyne	SSTR5	47	40
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)OC)c2)CC[C@@H]1N	ZINC000872143446	CE	On-Demand	Anodyne	MCHR1	28	40
COc1ccccc1[C@@H]1CNCCN1Cc1nc2c(o1)CCCC2	ZINC000872143457	EF	On-Demand	Anodyne	MBTPS1	46	35
FC(F)(F)c1coc(CN(Cc2ccccn2)[C@H]2CCCNCC2)c1	ZINC000872143459	FH	On-Demand	Anodyne	SLC6A2	17	44
FC(F)(F)c1coc(CN(Cc2ccccn2)[C@@H]2CCCNCC2)c1	ZINC000872143460	FH	On-Demand	Anodyne	SLC6A2	17	44
Cc1conc1CN1CCC[C@@H](CNC(=O)[C@@H]2CCCN2)C1	ZINC000872143946	DD	On-Demand	Anodyne	PDE8B	28	40
Cc1conc1CN1CCC[C@H](CNC(=O)[C@@H]2CCCN2)C1	ZINC000872143947	DD	On-Demand	Anodyne	PDE8B	28	40
Cc1conc1CN1CCC[C@@H](CNC(=O)[C@H]2CCCN2)C1	ZINC000872143948	DD	On-Demand	Anodyne	PDE8B	28	40
Cc1conc1CN1CCC[C@H](CNC(=O)[C@H]2CCCN2)C1	ZINC000872143949	DD	On-Demand	Anodyne	PDE8B	28	40
CCN(Cc1ccc(C)c(C(=O)OC)c1)[C@H]1CCCNCC1	ZINC000872143993	DF	On-Demand	Anodyne	MBTPS1	40	34
CCN(Cc1ccc(C)c(C(=O)OC)c1)[C@@H]1CCCNCC1	ZINC000872143994	DF	On-Demand	Anodyne	MBTPS1	40	34
c1cncc([C@@H]2CNCCN2C[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872144433	CD	On-Demand	Anodyne	CHRNA7	15	41
c1cncc([C@@H]2CNCCN2C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872144434	CD	On-Demand	Anodyne	CHRNA7	15	41
c1cncc([C@@H]2CNCCN2C[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872144435	CD	On-Demand	Anodyne	CHRNA7	15	41
c1cncc([C@@H]2CNCCN2C[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872144436	CD	On-Demand	Anodyne	CHRNA7	15	41
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	DRD2	15	43
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	DRD4	33	45
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	ACHE	19	42
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	SIGMAR1	24	42
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	SSTR5	82	47
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	CCR3	37	46
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	UTS2R	18	41
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	MCHR1	52	47
COCCNC1CCN(Cc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000872144496	DD	On-Demand	Anodyne	CACNA1I	15	40
Cc1conc1CN1C[C@@H](N)[C@H](c2cccc(F)c2)C1	ZINC000872145331	CE	On-Demand	Anodyne	CCR5	40	31
COC(=O)c1cc(NC(=O)CNC(N)=O)ccc1F	ZINC000872145588	CC	On-Demand	Anodyne	SLC1A3	46	34
COC(=O)c1cc(NC(=O)CNC(N)=O)ccc1F	ZINC000872145588	CC	On-Demand	Anodyne	SLC1A2	60	37
COC(=O)c1cc(NC(=O)CNC(N)=O)ccc1F	ZINC000872145588	CC	On-Demand	Anodyne	ENPP1	50	31
N[C@@H]1CN(C[C@@H]2C[C@@H]3CCC[C@@H]3O2)C[C@H]1c1cccc(F)c1	ZINC000872145894	DF	On-Demand	Anodyne	CCR5	47	37
N[C@@H]1CN(C[C@@H]2C[C@@H]3CCC[C@H]3O2)C[C@H]1c1cccc(F)c1	ZINC000872145895	DF	On-Demand	Anodyne	CCR5	47	37
N[C@@H]1CN(C[C@@H]2C[C@H]3CCC[C@H]3O2)C[C@H]1c1cccc(F)c1	ZINC000872145896	DF	On-Demand	Anodyne	CCR5	47	37
N[C@@H]1CN(C[C@@H]2C[C@H]3CCC[C@@H]3O2)C[C@H]1c1cccc(F)c1	ZINC000872145897	DF	On-Demand	Anodyne	CCR5	47	37
N#Cc1ccc(N2CCN(CCN3CCNCC3)CC2)cn1	ZINC000872145957	DB	On-Demand	Mild	CHRNA4	26	42
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	DRD4	21	46
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	HRH2	24	41
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	SLC6A1	55	33
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	SIGMAR1	16	44
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	MCHR1	15	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145962	ED	On-Demand	Anodyne	BIRC2	27	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	DRD4	21	46
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	HRH2	24	41
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	SLC6A1	55	33
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	SIGMAR1	16	44
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	MCHR1	15	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000872145963	ED	On-Demand	Anodyne	BIRC2	27	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	DRD4	21	46
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	HRH2	24	41
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	SLC6A1	55	33
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	SIGMAR1	16	44
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	MCHR1	15	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145964	ED	On-Demand	Anodyne	BIRC2	27	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	DRD4	21	46
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	HRH2	24	41
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	SLC6A1	55	33
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	SIGMAR1	16	44
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	MCHR1	15	40
Nc1cccc(CN2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000872145965	ED	On-Demand	Anodyne	BIRC2	27	40
O=C(CCN1CCC(Oc2ccc(Cl)cn2)CC1)N1CCNCC1	ZINC000872146000	FD	On-Demand	Anodyne	PRCP	40	36
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000872146005	GD	On-Demand	Anodyne	SLC6A1	77	35
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000872146005	GD	On-Demand	Anodyne	MME	22	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000872146005	GD	On-Demand	Anodyne	LAP3	18	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000872146006	GD	On-Demand	Anodyne	SLC6A1	77	35
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000872146006	GD	On-Demand	Anodyne	MME	22	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000872146006	GD	On-Demand	Anodyne	LAP3	18	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000872146007	GD	On-Demand	Anodyne	SLC6A1	77	35
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000872146007	GD	On-Demand	Anodyne	MME	22	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000872146007	GD	On-Demand	Anodyne	LAP3	18	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000872146008	GD	On-Demand	Anodyne	SLC6A1	77	35
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000872146008	GD	On-Demand	Anodyne	MME	22	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000872146008	GD	On-Demand	Anodyne	LAP3	18	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146014	EE	On-Demand	Anodyne	HRH1	23	41
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146014	EE	On-Demand	Anodyne	SLC6A3	26	46
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146014	EE	On-Demand	Anodyne	SIGMAR1	19	46
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146014	EE	On-Demand	Anodyne	CCR3	34	43
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872146029	EC	On-Demand	Anodyne	SIGMAR1	25	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872146029	EC	On-Demand	Anodyne	LAP3	44	34
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872146030	EC	On-Demand	Anodyne	SIGMAR1	25	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872146030	EC	On-Demand	Anodyne	LAP3	44	34
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872146031	EC	On-Demand	Anodyne	SIGMAR1	25	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872146031	EC	On-Demand	Anodyne	LAP3	44	34
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872146032	EC	On-Demand	Anodyne	SIGMAR1	25	42
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872146032	EC	On-Demand	Anodyne	LAP3	44	34
COC(=O)c1cc(NC(=O)c2cc(C)n(CC(F)(F)F)c2C)ccc1F	ZINC000872146076	FH	On-Demand	Anodyne	KCNK3	45	33
O=C(CCN1CC[C@@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872146079	DD	On-Demand	Anodyne	SIGMAR1	18	50
O=C(CCN1CC[C@@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872146079	DD	On-Demand	Anodyne	EBP	17	41
O=C(CCN1CC[C@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872146080	DD	On-Demand	Anodyne	SIGMAR1	18	50
O=C(CCN1CC[C@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872146080	DD	On-Demand	Anodyne	EBP	17	41
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CNCCO2)C1	ZINC000872146084	CD	On-Demand	Anodyne	SIGMAR1	17	60
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CNCCO2)C1	ZINC000872146085	CD	On-Demand	Anodyne	SIGMAR1	17	60
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CNCCO2)C1	ZINC000872146086	CD	On-Demand	Anodyne	SIGMAR1	17	60
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CNCCO2)C1	ZINC000872146087	CD	On-Demand	Anodyne	SIGMAR1	17	60
COC(=O)c1cc(NC(=O)CCCOc2ccccc2C)ccc1F	ZINC000872146094	EH	On-Demand	Anodyne	HDAC3	17	40
COC(=O)c1cc(NC(=O)CCCOc2ccccc2C)ccc1F	ZINC000872146094	EH	On-Demand	Anodyne	KCNK3	47	34
COC(=O)c1cc(NC(=O)CCCOc2ccccc2C)ccc1F	ZINC000872146094	EH	On-Demand	Anodyne	KCNK9	48	34
Nc1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872146095	CG	On-Demand	Anodyne	SIGMAR1	31	45
Nc1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872146095	CG	On-Demand	Anodyne	CCR3	44	43
Nc1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872146095	CG	On-Demand	Anodyne	MLNR	32	44
COC(=O)c1cc(NC(=O)CCCOc2ccc(F)cc2)ccc1F	ZINC000872146110	EH	On-Demand	Anodyne	LTA4H	24	41
COC(=O)c1cc(NC(=O)CCCOc2ccc(F)cc2)ccc1F	ZINC000872146110	EH	On-Demand	Anodyne	HDAC3	19	44
COC(=O)c1cc(NC(=O)CCCOc2ccc(F)cc2)ccc1F	ZINC000872146110	EH	On-Demand	Anodyne	FAAH	21	43
COC(=O)c1cc(NC(=O)c2ccc(-n3cccn3)nc2)ccc1F	ZINC000872146118	EE	On-Demand	Anodyne	GRM4	24	40
COC(=O)c1cc(NC(=O)c2ccc(-n3cccn3)nc2)ccc1F	ZINC000872146118	EE	On-Demand	Anodyne	TAAR1	17	41
C[S@](=N)(=O)N1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146120	DD	On-Demand	Anodyne	PNMT	19	47
CC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146124	CE	On-Demand	Anodyne	ACHE	16	50
CC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146124	CE	On-Demand	Anodyne	SIGMAR1	27	43
CC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146124	CE	On-Demand	Anodyne	MCHR2	49	35
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000872146135	GF	On-Demand	Anodyne	HRH1	23	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000872146135	GF	On-Demand	Anodyne	CCR3	25	40
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000872146135	GF	On-Demand	Anodyne	SCN5A	44	38
CONC(=O)C1CCN(C[C@H](CN)c2ccc(OC)cc2)CC1	ZINC000872146139	DD	On-Demand	Anodyne	MTNR1A	18	41
CONC(=O)C1CCN(C[C@H](CN)c2ccc(OC)cc2)CC1	ZINC000872146139	DD	On-Demand	Anodyne	MTNR1B	16	41
CONC(=O)C1CCN(C[C@@H](CN)c2ccc(OC)cc2)CC1	ZINC000872146140	DD	On-Demand	Anodyne	MTNR1A	18	41
CONC(=O)C1CCN(C[C@@H](CN)c2ccc(OC)cc2)CC1	ZINC000872146140	DD	On-Demand	Anodyne	MTNR1B	16	41
NCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146142	BD	On-Demand	Anodyne	HRH3	18	40
NCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146142	BD	On-Demand	Anodyne	SIGMAR1	15	40
NCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146142	BD	On-Demand	Anodyne	CCR3	17	56
CC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146161	CD	On-Demand	Anodyne	SIGMAR1	31	42
CC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146161	CD	On-Demand	Anodyne	ABCB1	23	40
CC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146161	CD	On-Demand	Anodyne	LAP3	52	39
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	DHODH	26	41
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	GRM4	50	46
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	MET	17	45
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	AURKA	19	42
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	DGAT1	15	40
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	KCNK3	58	37
COC(=O)c1cc(NC(=O)c2cccnc2Nc2ccccc2F)ccc1F	ZINC000872146162	GI	On-Demand	Anodyne	KCNK9	52	37
c1ccc2c(c1)CC[C@]21CCN(CCN2CCNCC2)C1	ZINC000872146170	CD	On-Demand	Anodyne	SIGMAR1	27	57
c1ccc2c(c1)CC[C@]21CCN(CCN2CCNCC2)C1	ZINC000872146170	CD	On-Demand	Anodyne	SLC18A3	16	41
c1ccc2c(c1)CC[C@]21CCN(CCN2CCNCC2)C1	ZINC000872146170	CD	On-Demand	Anodyne	EBP	19	50
c1ccc2c(c1)CC[C@@]21CCN(CCN2CCNCC2)C1	ZINC000872146171	CD	On-Demand	Anodyne	SIGMAR1	27	57
c1ccc2c(c1)CC[C@@]21CCN(CCN2CCNCC2)C1	ZINC000872146171	CD	On-Demand	Anodyne	SLC18A3	16	41
c1ccc2c(c1)CC[C@@]21CCN(CCN2CCNCC2)C1	ZINC000872146171	CD	On-Demand	Anodyne	EBP	19	50
NCCN1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000872146178	CC	On-Demand	Anodyne	SLC6A1	47	32
NCCN1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000872146179	CC	On-Demand	Anodyne	SLC6A1	47	32
NCCN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000872146180	CC	On-Demand	Anodyne	SLC6A1	47	32
NCCN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000872146181	CC	On-Demand	Anodyne	SLC6A1	47	32
Nc1cccc(CN2CCC3(CCNC3=O)CC2)c1	ZINC000872146184	CD	On-Demand	Anodyne	SIGMAR1	20	40
Nc1cccc(CN2CCC3(CCNC3=O)CC2)c1	ZINC000872146184	CD	On-Demand	Anodyne	MCHR2	44	32
CC(=O)[C@H]1CCCN(CCCN)C1	ZINC000872146198	AC	On-Demand	Anodyne	SLC6A1	147	42
CC(=O)[C@@H]1CCCN(CCCN)C1	ZINC000872146199	AC	On-Demand	Anodyne	SLC6A1	147	42
N#Cc1ccc(N2CCN(Cc3cccc4c3CCNC4)CC2)cn1	ZINC000872146203	ED	On-Demand	Mild	DRD4	19	41
COC(=O)c1cc(NC(=O)[C@H]2CSCN2C(=O)c2ccccc2)ccc1F	ZINC000872146208	GF	On-Demand	Anodyne	CFTR	64	39
NCCOCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146215	CD	On-Demand	Anodyne	SIGMAR1	25	53
NCCOCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146215	CD	On-Demand	Anodyne	EBP	19	47
NCCOCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146216	CD	On-Demand	Anodyne	SIGMAR1	25	53
NCCOCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146216	CD	On-Demand	Anodyne	EBP	19	47
CC(=O)[C@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146221	CE	On-Demand	Anodyne	SLC6A1	152	41
CC(=O)[C@@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146222	CE	On-Demand	Anodyne	SLC6A1	152	41
Nc1cccc(CN2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000872146240	CD	On-Demand	Anodyne	DRD4	22	43
Nc1cccc(CN2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000872146240	CD	On-Demand	Anodyne	ACHE	23	41
Nc1cccc(CN2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000872146241	CD	On-Demand	Anodyne	DRD4	22	43
Nc1cccc(CN2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000872146241	CD	On-Demand	Anodyne	ACHE	23	41
Nc1cccc(CN2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000872146242	CD	On-Demand	Anodyne	DRD4	22	43
Nc1cccc(CN2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000872146242	CD	On-Demand	Anodyne	ACHE	23	41
Nc1cccc(CN2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000872146243	CD	On-Demand	Anodyne	DRD4	22	43
Nc1cccc(CN2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000872146243	CD	On-Demand	Anodyne	ACHE	23	41
NCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146246	BD	On-Demand	Anodyne	SIGMAR1	33	62
NCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146246	BD	On-Demand	Anodyne	SLC18A3	17	49
NCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146246	BD	On-Demand	Anodyne	EBP	22	54
NCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146247	BD	On-Demand	Anodyne	SIGMAR1	33	62
NCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146247	BD	On-Demand	Anodyne	SLC18A3	17	49
NCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146247	BD	On-Demand	Anodyne	EBP	22	54
CC(=O)[C@H]1CCCN(CCCC2CCNCC2)C1	ZINC000872146250	CE	On-Demand	Anodyne	SLC6A1	100	38
CC(=O)[C@@H]1CCCN(CCCC2CCNCC2)C1	ZINC000872146251	CE	On-Demand	Anodyne	SLC6A1	100	38
CONC(=O)C1CCN(Cc2cccc3c2CCNC3)CC1	ZINC000872146266	DD	On-Demand	Anodyne	CACNA1G	36	40
Fc1ccc(O[C@H]2CCN(CC3CCNCC3)C2)cc1	ZINC000872146271	CE	On-Demand	Anodyne	HRH1	17	42
Fc1ccc(O[C@H]2CCN(CC3CCNCC3)C2)cc1	ZINC000872146271	CE	On-Demand	Anodyne	SIGMAR1	15	50
Fc1ccc(O[C@H]2CCN(CC3CCNCC3)C2)cc1	ZINC000872146271	CE	On-Demand	Anodyne	CCR3	22	45
N#Cc1ccc(N2CCN(CCCN)CC2)cn1	ZINC000872146272	BC	On-Demand	Mild	HTR1A	25	40
N#Cc1ccc(N2CCN(CCCN)CC2)cn1	ZINC000872146272	BC	On-Demand	Mild	DRD4	23	40
N#Cc1ccc(N2CCN(CCCN)CC2)cn1	ZINC000872146272	BC	On-Demand	Mild	HTR2A	15	40
N#Cc1ccc(N2CCN(CCCN)CC2)cn1	ZINC000872146272	BC	On-Demand	Mild	DRD3	15	40
N#Cc1ccc(N2CCN(CCCCCCCN)CC2)cn1	ZINC000872146283	DD	On-Demand	Mild	HTR1A	31	43
N#Cc1ccc(N2CCN(CCCCCCCN)CC2)cn1	ZINC000872146283	DD	On-Demand	Mild	DRD2	17	43
N#Cc1ccc(N2CCN(CCCCCCCN)CC2)cn1	ZINC000872146283	DD	On-Demand	Mild	HTR2A	16	43
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146289	CF	On-Demand	Anodyne	OXTR	18	44
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146289	CF	On-Demand	Anodyne	SIGMAR1	21	63
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146289	CF	On-Demand	Anodyne	EBP	17	41
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146290	CF	On-Demand	Anodyne	OXTR	18	44
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146290	CF	On-Demand	Anodyne	SIGMAR1	21	63
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146290	CF	On-Demand	Anodyne	EBP	17	41
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146291	CF	On-Demand	Anodyne	OXTR	18	44
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146291	CF	On-Demand	Anodyne	SIGMAR1	21	63
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCCNC2)C1	ZINC000872146291	CF	On-Demand	Anodyne	EBP	17	41
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146292	CF	On-Demand	Anodyne	OXTR	18	44
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146292	CF	On-Demand	Anodyne	SIGMAR1	21	63
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCCNC2)C1	ZINC000872146292	CF	On-Demand	Anodyne	EBP	17	41
NCc1nc(CN2CC[C@@]3(CCc4ccccc43)C2)no1	ZINC000872146293	CD	On-Demand	Anodyne	SIGMAR1	15	47
NCc1nc(CN2CC[C@]3(CCc4ccccc43)C2)no1	ZINC000872146294	CD	On-Demand	Anodyne	SIGMAR1	15	47
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCC3(CNC3)O2)C1	ZINC000872146333	CE	On-Demand	Anodyne	SIGMAR1	19	53
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCC3(CNC3)O2)C1	ZINC000872146334	CE	On-Demand	Anodyne	SIGMAR1	19	53
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCC3(CNC3)O2)C1	ZINC000872146335	CE	On-Demand	Anodyne	SIGMAR1	19	53
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCC3(CNC3)O2)C1	ZINC000872146336	CE	On-Demand	Anodyne	SIGMAR1	19	53
CC(=O)[C@@H]1CCCN(CC[C@H]2CCNC2)C1	ZINC000872146344	BD	On-Demand	Anodyne	SLC6A1	90	34
CC(=O)[C@H]1CCCN(CC[C@H]2CCNC2)C1	ZINC000872146345	BD	On-Demand	Anodyne	SLC6A1	90	34
CC(=O)[C@@H]1CCCN(CC[C@@H]2CCNC2)C1	ZINC000872146346	BD	On-Demand	Anodyne	SLC6A1	90	34
CC(=O)[C@H]1CCCN(CC[C@@H]2CCNC2)C1	ZINC000872146347	BD	On-Demand	Anodyne	SLC6A1	90	34
NCCOCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146348	CD	On-Demand	Anodyne	SLC6A3	19	42
Fc1ccc(O[C@H]2CCN(C[C@H]3CCCNC3)C2)cc1	ZINC000872146349	CE	On-Demand	Anodyne	CCR3	19	40
Fc1ccc(O[C@H]2CCN(C[C@@H]3CCCNC3)C2)cc1	ZINC000872146350	CE	On-Demand	Anodyne	CCR3	19	40
c1ccc2c(c1)CC[C@]21CCN(CC[C@H]2CCNC2)C1	ZINC000872146352	CF	On-Demand	Anodyne	SIGMAR1	20	50
c1ccc2c(c1)CC[C@]21CCN(CC[C@H]2CCNC2)C1	ZINC000872146352	CF	On-Demand	Anodyne	EBP	18	41
c1ccc2c(c1)CC[C@]21CCN(CC[C@@H]2CCNC2)C1	ZINC000872146353	CF	On-Demand	Anodyne	SIGMAR1	20	50
c1ccc2c(c1)CC[C@]21CCN(CC[C@@H]2CCNC2)C1	ZINC000872146353	CF	On-Demand	Anodyne	EBP	18	41
c1ccc2c(c1)CC[C@@]21CCN(CC[C@H]2CCNC2)C1	ZINC000872146354	CF	On-Demand	Anodyne	SIGMAR1	20	50
c1ccc2c(c1)CC[C@@]21CCN(CC[C@H]2CCNC2)C1	ZINC000872146354	CF	On-Demand	Anodyne	EBP	18	41
c1ccc2c(c1)CC[C@@]21CCN(CC[C@@H]2CCNC2)C1	ZINC000872146355	CF	On-Demand	Anodyne	SIGMAR1	20	50
c1ccc2c(c1)CC[C@@]21CCN(CC[C@@H]2CCNC2)C1	ZINC000872146355	CF	On-Demand	Anodyne	EBP	18	41
N#Cc1ccc(N2CCN(CCCCCCN)CC2)cn1	ZINC000872146380	CD	On-Demand	Mild	HTR1A	31	43
N#Cc1ccc(N2CCN(CCCCCCN)CC2)cn1	ZINC000872146380	CD	On-Demand	Mild	DRD2	17	43
N#Cc1ccc(N2CCN(CCCCCCN)CC2)cn1	ZINC000872146380	CD	On-Demand	Mild	HTR2A	16	43
C[S@](=N)(=O)N1CCN(Cc2cccc(N)c2)CC1	ZINC000872146383	CC	On-Demand	Anodyne	SIGMAR1	20	47
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146409	EF	On-Demand	Anodyne	SIGMAR1	21	54
N[C@@H](Cc1ccccc1)[C@@H](O)CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146410	EF	On-Demand	Anodyne	SIGMAR1	21	54
Fc1ccc(O[C@H]2CCN(C[C@@H]3CCNC3)C2)cc1	ZINC000872146437	CD	On-Demand	Anodyne	CCR3	19	42
Fc1ccc(O[C@H]2CCN(C[C@H]3CCNC3)C2)cc1	ZINC000872146438	CD	On-Demand	Anodyne	CCR3	19	42
CONC(=O)C1CCN(CC2CCNCC2)CC1	ZINC000872146452	CC	On-Demand	Anodyne	HTR4	15	43
O=C(CCN1CC[C@H](Oc2ccc(F)cc2)C1)N1CCNCC1	ZINC000872146453	DD	On-Demand	Anodyne	CCR3	36	50
O=C(CCN1CC[C@H](Oc2ccc(F)cc2)C1)N1CCNCC1	ZINC000872146453	DD	On-Demand	Anodyne	MLNR	27	52
O=C(CCN1CC[C@H](Oc2ccc(F)cc2)C1)N1CCNCC1	ZINC000872146453	DD	On-Demand	Anodyne	LIPG	22	44
CC(=O)C1CCN(CCCCCCCN)CC1	ZINC000872146506	BE	On-Demand	Anodyne	PAOX	25	41
CC(=O)[C@H]1CCCN(CC[C@@H]2CCCNC2)C1	ZINC000872146528	BD	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@H]1CCCN(CC[C@H]2CCCNC2)C1	ZINC000872146529	BD	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@@H]1CCCN(CC[C@@H]2CCCNC2)C1	ZINC000872146530	BD	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@@H]1CCCN(CC[C@H]2CCCNC2)C1	ZINC000872146531	BD	On-Demand	Anodyne	SLC6A1	79	34
NCCCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146533	CF	On-Demand	Anodyne	DRD2	16	43
NCCCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146533	CF	On-Demand	Anodyne	HTR2A	20	43
NCCCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146533	CF	On-Demand	Anodyne	HRH3	20	42
NCCCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872146533	CF	On-Demand	Anodyne	CCR3	25	58
c1ccc2c(c1)CC[C@]21CCN(CC2CCNCC2)C1	ZINC000872146539	CF	On-Demand	Anodyne	SIGMAR1	25	64
c1ccc2c(c1)CC[C@]21CCN(CC2CCNCC2)C1	ZINC000872146539	CF	On-Demand	Anodyne	SLC18A3	17	41
c1ccc2c(c1)CC[C@]21CCN(CC2CCNCC2)C1	ZINC000872146539	CF	On-Demand	Anodyne	EBP	17	42
c1ccc2c(c1)CC[C@@]21CCN(CC2CCNCC2)C1	ZINC000872146540	CF	On-Demand	Anodyne	SIGMAR1	25	64
c1ccc2c(c1)CC[C@@]21CCN(CC2CCNCC2)C1	ZINC000872146540	CF	On-Demand	Anodyne	SLC18A3	17	41
c1ccc2c(c1)CC[C@@]21CCN(CC2CCNCC2)C1	ZINC000872146540	CF	On-Demand	Anodyne	EBP	17	42
Nc1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872146546	CG	On-Demand	Anodyne	SIGMAR1	38	61
Nc1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872146546	CG	On-Demand	Anodyne	SLC18A3	18	47
Nc1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872146546	CG	On-Demand	Anodyne	MCHR2	60	38
Nc1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872146547	CG	On-Demand	Anodyne	SIGMAR1	38	61
Nc1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872146547	CG	On-Demand	Anodyne	SLC18A3	18	47
Nc1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872146547	CG	On-Demand	Anodyne	MCHR2	60	38
NCCCCCCN1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000872146548	DG	On-Demand	Anodyne	HRH3	17	43
CC(=O)[C@@H]1CCCN(CCN2CCNCC2)C1	ZINC000872146549	BC	On-Demand	Anodyne	SLC6A1	125	40
CC(=O)[C@H]1CCCN(CCN2CCNCC2)C1	ZINC000872146550	BC	On-Demand	Anodyne	SLC6A1	125	40
CONC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146551	DC	On-Demand	Anodyne	LTA4H	16	44
CONC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146551	DC	On-Demand	Anodyne	SIGMAR1	26	44
CONC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146551	DC	On-Demand	Anodyne	F11	44	37
CONC(=O)C1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146551	DC	On-Demand	Anodyne	CAPN1	25	41
CC(=O)[C@H]1CCCN(CCC2CCNCC2)C1	ZINC000872146556	BD	On-Demand	Anodyne	SLC6A1	108	36
CC(=O)[C@@H]1CCCN(CCC2CCNCC2)C1	ZINC000872146557	BD	On-Demand	Anodyne	SLC6A1	108	36
C[S@](=N)(=O)N1CCN(C[C@H](O)[C@@H](N)Cc2ccccc2)CC1	ZINC000872146569	EC	On-Demand	Anodyne	LAP3	44	36
COC(=O)c1cc(NC(=O)c2sc3cccc(C)c3c2Cl)ccc1F	ZINC000872146576	GK	On-Demand	Anodyne	KCNK3	44	35
CC(=O)[C@@H]1CCCN(CCCCCCN)C1	ZINC000872146578	BD	On-Demand	Anodyne	SLC6A1	145	44
CC(=O)[C@H]1CCCN(CCCCCCN)C1	ZINC000872146579	BD	On-Demand	Anodyne	SLC6A1	145	44
NCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146586	BD	On-Demand	Anodyne	OXTR	42	37
NCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146586	BD	On-Demand	Anodyne	SIGMAR1	28	57
NCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146586	BD	On-Demand	Anodyne	SLC18A3	18	45
NCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872146586	BD	On-Demand	Anodyne	EBP	20	50
NCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146587	BD	On-Demand	Anodyne	OXTR	42	37
NCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146587	BD	On-Demand	Anodyne	SIGMAR1	28	57
NCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146587	BD	On-Demand	Anodyne	SLC18A3	18	45
NCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872146587	BD	On-Demand	Anodyne	EBP	20	50
CC(=O)[C@H]1CCCN(Cc2ccc3c(c2)CNCC3)C1	ZINC000872146620	CE	On-Demand	Anodyne	SLC6A1	113	34
CC(=O)[C@@H]1CCCN(Cc2ccc3c(c2)CNCC3)C1	ZINC000872146621	CE	On-Demand	Anodyne	SLC6A1	113	34
CC(=O)[C@@H]1CCCN(CCOCCN)C1	ZINC000872146630	BC	On-Demand	Anodyne	SLC6A1	150	49
CC(=O)[C@H]1CCCN(CCOCCN)C1	ZINC000872146631	BC	On-Demand	Anodyne	SLC6A1	150	49
COC(=O)c1cc(NC(=O)c2ccccc2C(=O)c2cccs2)ccc1F	ZINC000872146632	GI	On-Demand	Anodyne	GRM4	21	49
COC(=O)c1cc(NC(=O)c2ccccc2C(=O)c2cccs2)ccc1F	ZINC000872146632	GI	On-Demand	Anodyne	KCNK3	66	42
COC(=O)c1cc(NC(=O)c2ccccc2C(=O)c2cccs2)ccc1F	ZINC000872146632	GI	On-Demand	Anodyne	KCNK9	65	42
O=C(CCN1CCO[C@@H](c2noc(C3CC3)n2)C1)N1CCNCC1	ZINC000872146643	EC	On-Demand	Anodyne	ETHR	75	48
O=C(CCN1CCO[C@H](c2noc(C3CC3)n2)C1)N1CCNCC1	ZINC000872146644	EC	On-Demand	Anodyne	ETHR	75	48
NCCOCCN1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000872146661	DC	On-Demand	Anodyne	SLC6A1	61	40
NCCOCCN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000872146662	DC	On-Demand	Anodyne	SLC6A1	61	40
NCCOCCN1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000872146663	DC	On-Demand	Anodyne	SLC6A1	61	40
NCCOCCN1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000872146664	DC	On-Demand	Anodyne	SLC6A1	61	40
CC(=O)C1CCN(CCCCCCN)CC1	ZINC000872146709	BD	On-Demand	Anodyne	PAOX	25	41
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146722	FD	On-Demand	Anodyne	SLC6A1	76	33
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146723	FD	On-Demand	Anodyne	SLC6A1	76	33
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146724	FD	On-Demand	Anodyne	SLC6A1	76	33
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(Cc2cccc3c2CCNC3)C1	ZINC000872146725	FD	On-Demand	Anodyne	SLC6A1	76	33
CC(=O)[C@@H]1CCCN(CCC(=O)N2CCNCC2)C1	ZINC000872146736	CC	On-Demand	Anodyne	SLC6A1	103	35
CC(=O)[C@H]1CCCN(CCC(=O)N2CCNCC2)C1	ZINC000872146737	CC	On-Demand	Anodyne	SLC6A1	103	35
CC(=O)[C@H]1CCCN(CCCCCCCN)C1	ZINC000872146754	BE	On-Demand	Anodyne	SLC6A1	145	44
CC(=O)[C@@H]1CCCN(CCCCCCCN)C1	ZINC000872146755	BE	On-Demand	Anodyne	SLC6A1	145	44
CONC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146756	DD	On-Demand	Anodyne	ACHE	16	46
CONC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146756	DD	On-Demand	Anodyne	SIGMAR1	22	43
CONC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146756	DD	On-Demand	Anodyne	SSTR5	43	34
CONC(=O)C1CCN(Cc2ccc3c(c2)CNCC3)CC1	ZINC000872146756	DD	On-Demand	Anodyne	CACNA1G	49	44
Nc1cccc(CN2CCC(CO)(CO)CC2)c1	ZINC000872146761	CC	On-Demand	Anodyne	SIGMAR1	55	44
Nc1cccc(CN2CCC(CO)(CO)CC2)c1	ZINC000872146761	CC	On-Demand	Anodyne	NPFFR2	30	40
Nc1cccc(CN2CCC(CO)(CO)CC2)c1	ZINC000872146761	CC	On-Demand	Anodyne	MCHR2	53	33
Nc1cccc(CN2CCC(CO)(CO)CC2)c1	ZINC000872146761	CC	On-Demand	Anodyne	NPFFR1	44	40
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	ACE	43	36
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	SLC6A1	151	42
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	OPRM1	42	39
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	DPP4	18	46
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	LAP3	50	42
CC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146773	CD	On-Demand	Anodyne	DPP8	20	45
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	ACE	43	36
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	SLC6A1	151	42
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	OPRM1	42	39
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	DPP4	18	46
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	LAP3	50	42
CC(=O)[C@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872146774	CD	On-Demand	Anodyne	DPP8	20	45
CC(=O)[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146777	BE	On-Demand	Anodyne	DRD2	18	42
CC(=O)[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146777	BE	On-Demand	Anodyne	DRD4	26	44
CC(=O)[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146777	BE	On-Demand	Anodyne	HRH2	28	44
CC(=O)[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146777	BE	On-Demand	Anodyne	SLC6A1	152	39
CC(=O)[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146777	BE	On-Demand	Anodyne	HRH3	17	40
CC(=O)[C@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146778	BE	On-Demand	Anodyne	DRD2	18	42
CC(=O)[C@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146778	BE	On-Demand	Anodyne	DRD4	26	44
CC(=O)[C@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146778	BE	On-Demand	Anodyne	HRH2	28	44
CC(=O)[C@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146778	BE	On-Demand	Anodyne	SLC6A1	152	39
CC(=O)[C@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872146778	BE	On-Demand	Anodyne	HRH3	17	40
O=C1NCCC12CCN(Cc1ccc3c(c1)CNCC3)CC2	ZINC000872146796	CD	On-Demand	Anodyne	MCHR2	58	36
COc1ccc([C@@H](CN)CN2CCC[C@@H](C(C)=O)C2)cc1	ZINC000872146801	CE	On-Demand	Anodyne	SLC6A1	85	39
COc1ccc([C@@H](CN)CN2CCC[C@H](C(C)=O)C2)cc1	ZINC000872146802	CE	On-Demand	Anodyne	SLC6A1	85	39
COc1ccc([C@H](CN)CN2CCC[C@@H](C(C)=O)C2)cc1	ZINC000872146803	CE	On-Demand	Anodyne	SLC6A1	85	39
COc1ccc([C@H](CN)CN2CCC[C@H](C(C)=O)C2)cc1	ZINC000872146804	CE	On-Demand	Anodyne	SLC6A1	85	39
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	CHRM2	16	46
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	DRD2	26	42
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	DRD4	50	44
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	ACHE	47	42
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	HRH2	32	45
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	DRD3	19	42
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	HTR4	28	41
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	CHRM3	28	46
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	HRH3	17	42
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	SIGMAR1	48	50
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	SSTR5	62	37
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	CCR3	43	38
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	MCHR1	42	42
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	CACNA1G	50	47
CONC(=O)C1CCN(Cc2cccc(N)c2)CC1	ZINC000872146818	CD	On-Demand	Anodyne	CCR8	23	43
C[C@]1(C(F)(F)F)CCN(Cc2ccc3c(c2)CNCC3)C1	ZINC000872146839	CG	On-Demand	Anodyne	PNMT	15	42
C[C@]1(C(F)(F)F)CCN(Cc2ccc3c(c2)CNCC3)C1	ZINC000872146839	CG	On-Demand	Anodyne	MCHR2	46	36
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCNC2)C1	ZINC000872146858	CE	On-Demand	Anodyne	SIGMAR1	20	58
c1ccc2c(c1)CC[C@@]21CCN(C[C@@H]2CCNC2)C1	ZINC000872146858	CE	On-Demand	Anodyne	SLC18A3	17	40
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCNC2)C1	ZINC000872146859	CE	On-Demand	Anodyne	SIGMAR1	20	58
c1ccc2c(c1)CC[C@]21CCN(C[C@@H]2CCNC2)C1	ZINC000872146859	CE	On-Demand	Anodyne	SLC18A3	17	40
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCNC2)C1	ZINC000872146860	CE	On-Demand	Anodyne	SIGMAR1	20	58
c1ccc2c(c1)CC[C@]21CCN(C[C@H]2CCNC2)C1	ZINC000872146860	CE	On-Demand	Anodyne	SLC18A3	17	40
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCNC2)C1	ZINC000872146861	CE	On-Demand	Anodyne	SIGMAR1	20	58
c1ccc2c(c1)CC[C@@]21CCN(C[C@H]2CCNC2)C1	ZINC000872146861	CE	On-Demand	Anodyne	SLC18A3	17	40
COc1ccc(OCCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872146928	EF	On-Demand	Anodyne	HRH3	65	43
COc1ccc(OCCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872146929	EF	On-Demand	Anodyne	HRH3	65	43
COc1ccc(OCCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872146930	EF	On-Demand	Anodyne	HRH3	65	43
COc1ccc(OCCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872146931	EF	On-Demand	Anodyne	HRH3	65	43
C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872146936	FE	On-Demand	Anodyne	CCR5	49	34
C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872146937	FE	On-Demand	Anodyne	CCR5	49	34
C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872146938	FE	On-Demand	Anodyne	CCR5	49	34
C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872146939	FE	On-Demand	Anodyne	CCR5	49	34
NC[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872146962	DF	On-Demand	Anodyne	LTA4H	37	47
NC[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872146962	DF	On-Demand	Anodyne	EBP	17	48
NC[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872146963	DF	On-Demand	Anodyne	LTA4H	37	47
NC[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872146963	DF	On-Demand	Anodyne	EBP	17	48
NC[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872146964	DF	On-Demand	Anodyne	LTA4H	37	47
NC[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872146964	DF	On-Demand	Anodyne	EBP	17	48
NC[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872146965	DF	On-Demand	Anodyne	LTA4H	37	47
NC[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872146965	DF	On-Demand	Anodyne	EBP	17	48
NC[C@@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872146998	GF	On-Demand	Anodyne	P2RY1	57	38
NC[C@@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872146998	GF	On-Demand	Anodyne	EPHX2	56	42
NC[C@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872146999	GF	On-Demand	Anodyne	P2RY1	57	38
NC[C@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872146999	GF	On-Demand	Anodyne	EPHX2	56	42
NC[C@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147000	GF	On-Demand	Anodyne	P2RY1	57	38
NC[C@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147000	GF	On-Demand	Anodyne	EPHX2	56	42
NC[C@@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147001	GF	On-Demand	Anodyne	P2RY1	57	38
NC[C@@H]1CN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147001	GF	On-Demand	Anodyne	EPHX2	56	42
NC[C@@H]1CN(Cc2nc(-c3ccccc3)no2)C[C@@H]1C(F)(F)F	ZINC000872147052	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@H]1CN(Cc2nc(-c3ccccc3)no2)C[C@H]1C(F)(F)F	ZINC000872147053	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@H]1CN(Cc2nc(-c3ccccc3)no2)C[C@@H]1C(F)(F)F	ZINC000872147054	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@@H]1CN(Cc2nc(-c3ccccc3)no2)C[C@H]1C(F)(F)F	ZINC000872147055	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147062	FF	On-Demand	Anodyne	SLC1A1	23	40
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147062	FF	On-Demand	Anodyne	SLC1A3	22	40
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147062	FF	On-Demand	Anodyne	CCR2	36	41
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147062	FF	On-Demand	Anodyne	SLC1A2	33	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147063	FF	On-Demand	Anodyne	SLC1A1	23	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147063	FF	On-Demand	Anodyne	SLC1A3	22	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147063	FF	On-Demand	Anodyne	CCR2	36	41
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147063	FF	On-Demand	Anodyne	SLC1A2	33	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147064	FF	On-Demand	Anodyne	SLC1A1	23	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147064	FF	On-Demand	Anodyne	SLC1A3	22	40
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147064	FF	On-Demand	Anodyne	CCR2	36	41
NC[C@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872147064	FF	On-Demand	Anodyne	SLC1A2	33	40
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147065	FF	On-Demand	Anodyne	SLC1A1	23	40
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147065	FF	On-Demand	Anodyne	SLC1A3	22	40
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147065	FF	On-Demand	Anodyne	CCR2	36	41
NC[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872147065	FF	On-Demand	Anodyne	SLC1A2	33	40
NC[C@@H]1CN(CCCOc2ccc(F)cc2)C[C@H]1C(F)(F)F	ZINC000872147066	DF	On-Demand	Anodyne	HRH3	53	39
NC[C@H]1CN(CCCOc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147067	DF	On-Demand	Anodyne	HRH3	53	39
NC[C@@H]1CN(CCCOc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147068	DF	On-Demand	Anodyne	HRH3	53	39
NC[C@H]1CN(CCCOc2ccc(F)cc2)C[C@H]1C(F)(F)F	ZINC000872147069	DF	On-Demand	Anodyne	HRH3	53	39
COc1ccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872147191	DE	On-Demand	Anodyne	LTA4H	42	45
COc1ccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872147191	DE	On-Demand	Anodyne	HRH3	18	41
COc1ccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872147191	DE	On-Demand	Anodyne	PSMB1	39	40
COc1ccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147192	DE	On-Demand	Anodyne	LTA4H	42	45
COc1ccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147192	DE	On-Demand	Anodyne	HRH3	18	41
COc1ccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147192	DE	On-Demand	Anodyne	PSMB1	39	40
COc1ccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147193	DE	On-Demand	Anodyne	LTA4H	42	45
COc1ccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147193	DE	On-Demand	Anodyne	HRH3	18	41
COc1ccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872147193	DE	On-Demand	Anodyne	PSMB1	39	40
COc1ccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872147194	DE	On-Demand	Anodyne	LTA4H	42	45
COc1ccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872147194	DE	On-Demand	Anodyne	HRH3	18	41
COc1ccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872147194	DE	On-Demand	Anodyne	PSMB1	39	40
C[C@H](NC(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1	ZINC000872147195	FF	On-Demand	Anodyne	PRCP	24	45
C[C@H](NC(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1	ZINC000872147196	FF	On-Demand	Anodyne	PRCP	24	45
C[C@H](NC(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1)c1ccc(Cl)cc1	ZINC000872147197	FF	On-Demand	Anodyne	PRCP	24	45
C[C@H](NC(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1)c1ccc(Cl)cc1	ZINC000872147198	FF	On-Demand	Anodyne	PRCP	24	45
NC[C@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147215	EE	On-Demand	Anodyne	DRD4	15	52
NC[C@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147215	EE	On-Demand	Anodyne	AVPR2	31	40
NC[C@@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147216	EE	On-Demand	Anodyne	DRD4	15	52
NC[C@@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147216	EE	On-Demand	Anodyne	AVPR2	31	40
NC[C@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147217	EE	On-Demand	Anodyne	DRD4	15	52
NC[C@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147217	EE	On-Demand	Anodyne	AVPR2	31	40
NC[C@@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147218	EE	On-Demand	Anodyne	DRD4	15	52
NC[C@@H]1CN(CC(=O)N2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147218	EE	On-Demand	Anodyne	AVPR2	31	40
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147267	GG	On-Demand	Anodyne	RBP4	79	36
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147268	GG	On-Demand	Anodyne	RBP4	79	36
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147269	GG	On-Demand	Anodyne	RBP4	79	36
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147270	GG	On-Demand	Anodyne	RBP4	79	36
NC[C@@H]1CN(CC(=O)N2CCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147289	ED	On-Demand	Anodyne	DRD4	15	49
NC[C@@H]1CN(CC(=O)N2CCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147290	ED	On-Demand	Anodyne	DRD4	15	49
NC[C@H]1CN(CC(=O)N2CCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872147291	ED	On-Demand	Anodyne	DRD4	15	49
NC[C@H]1CN(CC(=O)N2CCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872147292	ED	On-Demand	Anodyne	DRD4	15	49
C[C@H](C(=O)Nc1ccccc1Cl)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147309	EF	On-Demand	Anodyne	KCNQ2	43	34
C[C@H](C(=O)Nc1ccccc1Cl)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147310	EF	On-Demand	Anodyne	KCNQ2	43	34
C[C@H](C(=O)Nc1ccccc1Cl)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147311	EF	On-Demand	Anodyne	KCNQ2	43	34
C[C@H](C(=O)Nc1ccccc1Cl)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147312	EF	On-Demand	Anodyne	KCNQ2	43	34
Cc1cccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147375	EE	On-Demand	Anodyne	KCNK3	56	36
Cc1cccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147375	EE	On-Demand	Anodyne	KCNK9	54	35
Cc1cccc(NC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872147376	EE	On-Demand	Anodyne	KCNK3	56	36
Cc1cccc(NC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872147376	EE	On-Demand	Anodyne	KCNK9	54	35
Cc1cccc(NC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147377	EE	On-Demand	Anodyne	KCNK3	56	36
Cc1cccc(NC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147377	EE	On-Demand	Anodyne	KCNK9	54	35
Cc1cccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872147378	EE	On-Demand	Anodyne	KCNK3	56	36
Cc1cccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872147378	EE	On-Demand	Anodyne	KCNK9	54	35
CN(Cc1ccc(F)cc1)C(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147379	ED	On-Demand	Anodyne	PLA2G7	43	35
CN(Cc1ccc(F)cc1)C(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147380	ED	On-Demand	Anodyne	PLA2G7	43	35
CN(Cc1ccc(F)cc1)C(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147381	ED	On-Demand	Anodyne	PLA2G7	43	35
CN(Cc1ccc(F)cc1)C(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147382	ED	On-Demand	Anodyne	PLA2G7	43	35
NC[C@@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872147395	GG	On-Demand	Anodyne	SLC1A1	23	42
NC[C@@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872147395	GG	On-Demand	Anodyne	SLC1A2	36	42
CS(=O)(=O)c1cccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872147400	FD	On-Demand	Anodyne	NR1H3	46	36
CS(=O)(=O)c1cccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147401	FD	On-Demand	Anodyne	NR1H3	46	36
CS(=O)(=O)c1cccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872147402	FD	On-Demand	Anodyne	NR1H3	46	36
CS(=O)(=O)c1cccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872147403	FD	On-Demand	Anodyne	NR1H3	46	36
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147408	EG	On-Demand	Anodyne	PPARG	55	40
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147408	EG	On-Demand	Anodyne	PPARA	59	39
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147408	EG	On-Demand	Anodyne	PDE8B	77	45
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147409	EG	On-Demand	Anodyne	PPARG	55	40
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147409	EG	On-Demand	Anodyne	PPARA	59	39
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147409	EG	On-Demand	Anodyne	PDE8B	77	45
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147410	EG	On-Demand	Anodyne	PPARG	55	40
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147410	EG	On-Demand	Anodyne	PPARA	59	39
Cc1oc(-c2ccccc2)nc1CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147410	EG	On-Demand	Anodyne	PDE8B	77	45
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147411	EG	On-Demand	Anodyne	PPARG	55	40
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147411	EG	On-Demand	Anodyne	PPARA	59	39
Cc1oc(-c2ccccc2)nc1CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147411	EG	On-Demand	Anodyne	PDE8B	77	45
NC[C@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872147456	GG	On-Demand	Anodyne	SLC1A1	23	42
NC[C@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872147456	GG	On-Demand	Anodyne	SLC1A2	36	42
NC[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872147457	EE	On-Demand	Bother	LTA4H	23	52
NC[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872147458	EE	On-Demand	Bother	LTA4H	23	52
NC[C@@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872147459	GG	On-Demand	Anodyne	SLC1A1	23	42
NC[C@@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872147459	GG	On-Demand	Anodyne	SLC1A2	36	42
NC[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872147460	EE	On-Demand	Bother	LTA4H	23	52
NC[C@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872147461	GG	On-Demand	Anodyne	SLC1A1	23	42
NC[C@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872147461	GG	On-Demand	Anodyne	SLC1A2	36	42
NC[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872147462	EE	On-Demand	Bother	LTA4H	23	52
NC[C@H]1CN(CC(=O)NCCOc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872147529	GC	On-Demand	Anodyne	EDNRA	27	41
NC[C@@H]1CN(CC(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872147531	GC	On-Demand	Anodyne	EDNRA	27	41
NC[C@H]1CN(CC(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872147534	GC	On-Demand	Anodyne	EDNRA	27	41
NC[C@@H]1CN(CC(=O)NCCOc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872147536	GC	On-Demand	Anodyne	EDNRA	27	41
COc1ccc(NC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872147579	GE	On-Demand	Anodyne	ENPP1	72	33
COc1ccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872147580	GE	On-Demand	Anodyne	ENPP1	72	33
COc1ccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872147581	GE	On-Demand	Anodyne	ENPP1	72	33
COc1ccc(NC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872147582	GE	On-Demand	Anodyne	ENPP1	72	33
COc1ccccc1CNC(=O)[C@H](C)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147608	FD	On-Demand	Anodyne	CARM1	42	43
COc1ccccc1CNC(=O)[C@H](C)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147609	FD	On-Demand	Anodyne	CARM1	42	43
COc1ccccc1CNC(=O)[C@H](C)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147610	FD	On-Demand	Anodyne	CARM1	42	43
COc1ccccc1CNC(=O)[C@H](C)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147611	FD	On-Demand	Anodyne	CARM1	42	43
NC[C@@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872147652	GH	On-Demand	Anodyne	CHRM3	16	44
NC[C@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872147653	GH	On-Demand	Anodyne	CHRM3	16	44
NC[C@@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872147654	GH	On-Demand	Anodyne	CHRM3	16	44
NC[C@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872147655	GH	On-Demand	Anodyne	CHRM3	16	44
NC[C@@H]1CN(CCCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872147660	EG	On-Demand	Anodyne	HRH3	49	46
NC[C@H]1CN(CCCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872147661	EG	On-Demand	Anodyne	HRH3	49	46
NC[C@@H]1CN(CCCOc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872147662	EG	On-Demand	Anodyne	HRH3	49	46
NC[C@H]1CN(CCCOc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC000872147663	EG	On-Demand	Anodyne	HRH3	49	46
NC[C@@H]1CN(CCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872147708	EG	On-Demand	Anodyne	HRH3	28	47
NC[C@@H]1CN(CCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872147708	EG	On-Demand	Anodyne	CHRNA10	19	41
NC[C@H]1CN(CCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872147709	EG	On-Demand	Anodyne	HRH3	28	47
NC[C@H]1CN(CCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872147709	EG	On-Demand	Anodyne	CHRNA10	19	41
NC[C@@H]1CN(CCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872147710	EG	On-Demand	Anodyne	HRH3	28	47
NC[C@@H]1CN(CCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872147710	EG	On-Demand	Anodyne	CHRNA10	19	41
NC[C@H]1CN(CCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872147711	EG	On-Demand	Anodyne	HRH3	28	47
NC[C@H]1CN(CCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872147711	EG	On-Demand	Anodyne	CHRNA10	19	41
C[C@H](C(=O)N1CCCCCC1)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147721	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCCC1)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147723	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCCC1)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147725	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCCC1)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147727	DD	On-Demand	Anodyne	DPP7	54	39
NC[C@H]1CN(CCOc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147744	DE	On-Demand	Anodyne	LTA4H	38	48
NC[C@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C(F)(F)F	ZINC000872147745	DE	On-Demand	Anodyne	LTA4H	38	48
NC[C@@H]1CN(CCOc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147747	DE	On-Demand	Anodyne	LTA4H	38	48
NC[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C(F)(F)F	ZINC000872147748	DE	On-Demand	Anodyne	LTA4H	38	48
Cc1csc([C@@H]2CCN(CCC(=O)N3CCNCC3)C2)n1	ZINC000872147758	DD	On-Demand	Anodyne	ETHR	59	41
Cc1csc([C@H]2CCN(CCC(=O)N3CCNCC3)C2)n1	ZINC000872147760	DD	On-Demand	Anodyne	ETHR	59	41
NC[C@@H]1CN(CC(=O)Nc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147765	FF	On-Demand	Anodyne	EPHX2	24	42
NC[C@H]1CN(CC(=O)Nc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147766	FF	On-Demand	Anodyne	EPHX2	24	42
NC[C@H]1CN(CC(=O)Nc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147767	FF	On-Demand	Anodyne	EPHX2	24	42
NC[C@@H]1CN(CC(=O)Nc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147768	FF	On-Demand	Anodyne	EPHX2	24	42
NC[C@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147796	FG	On-Demand	Anodyne	LTA4H	32	53
NC[C@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147796	FG	On-Demand	Anodyne	PSMB1	35	43
NC[C@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147797	FG	On-Demand	Anodyne	LTA4H	32	53
NC[C@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147797	FG	On-Demand	Anodyne	PSMB1	35	43
NC[C@@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147798	FG	On-Demand	Anodyne	LTA4H	32	53
NC[C@@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@@H]1C(F)(F)F	ZINC000872147798	FG	On-Demand	Anodyne	PSMB1	35	43
NC[C@@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147799	FG	On-Demand	Anodyne	LTA4H	32	53
NC[C@@H]1CN(CCOc2ccc(C(F)(F)F)cc2)C[C@H]1C(F)(F)F	ZINC000872147799	FG	On-Demand	Anodyne	PSMB1	35	43
NC[C@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872147800	FF	On-Demand	Anodyne	PARP1	15	42
NC[C@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872147800	FF	On-Demand	Anodyne	L3MBTL3	42	39
NC[C@@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872147801	FF	On-Demand	Anodyne	PARP1	15	42
NC[C@@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872147801	FF	On-Demand	Anodyne	L3MBTL3	42	39
NC[C@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@@H]1C(F)(F)F	ZINC000872147802	FF	On-Demand	Anodyne	PARP1	15	42
NC[C@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@@H]1C(F)(F)F	ZINC000872147802	FF	On-Demand	Anodyne	L3MBTL3	42	39
NC[C@@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@@H]1C(F)(F)F	ZINC000872147803	FF	On-Demand	Anodyne	PARP1	15	42
NC[C@@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)C[C@@H]1C(F)(F)F	ZINC000872147803	FF	On-Demand	Anodyne	L3MBTL3	42	39
Cc1ccccc1CNC(=O)[C@H](C)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872147884	EE	On-Demand	Anodyne	CARM1	29	40
Cc1ccccc1CNC(=O)[C@H](C)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147885	EE	On-Demand	Anodyne	CARM1	29	40
Cc1ccccc1CNC(=O)[C@H](C)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872147886	EE	On-Demand	Anodyne	CARM1	29	40
Cc1ccccc1CNC(=O)[C@H](C)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872147887	EE	On-Demand	Anodyne	CARM1	29	40
NC[C@@H]1CN(Cc2nc(-c3cccs3)no2)C[C@@H]1C(F)(F)F	ZINC000872147898	EE	On-Demand	Anodyne	ETHR	36	41
NC[C@H]1CN(Cc2nc(-c3cccs3)no2)C[C@H]1C(F)(F)F	ZINC000872147899	EE	On-Demand	Anodyne	ETHR	36	41
NC[C@H]1CN(Cc2nc(-c3cccs3)no2)C[C@@H]1C(F)(F)F	ZINC000872147900	EE	On-Demand	Anodyne	ETHR	36	41
NC[C@@H]1CN(Cc2nc(-c3cccs3)no2)C[C@H]1C(F)(F)F	ZINC000872147901	EE	On-Demand	Anodyne	ETHR	36	41
NC[C@H]1CN(CCOc2cccc(F)c2)C[C@@H]1C(F)(F)F	ZINC000872148032	DE	On-Demand	Anodyne	CHRNA10	43	43
NC[C@H]1CN(CCOc2cccc(F)c2)C[C@H]1C(F)(F)F	ZINC000872148033	DE	On-Demand	Anodyne	CHRNA10	43	43
NC[C@@H]1CN(CCOc2cccc(F)c2)C[C@@H]1C(F)(F)F	ZINC000872148034	DE	On-Demand	Anodyne	CHRNA10	43	43
NC[C@@H]1CN(CCOc2cccc(F)c2)C[C@H]1C(F)(F)F	ZINC000872148035	DE	On-Demand	Anodyne	CHRNA10	43	43
NC[C@H]1CN(CCC(=O)Nc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872148056	DE	On-Demand	Anodyne	LTA4H	19	42
NC[C@@H]1CN(CCC(=O)Nc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872148057	DE	On-Demand	Anodyne	LTA4H	19	42
NC[C@H]1CN(CCC(=O)Nc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872148058	DE	On-Demand	Anodyne	LTA4H	19	42
NC[C@@H]1CN(CCC(=O)Nc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872148059	DE	On-Demand	Anodyne	LTA4H	19	42
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872148072	FD	On-Demand	Anodyne	KCNA3	41	34
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872148073	FD	On-Demand	Anodyne	KCNA3	41	34
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872148074	FD	On-Demand	Anodyne	KCNA3	41	34
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872148075	FD	On-Demand	Anodyne	KCNA3	41	34
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	DRD4	18	42
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	ACHE	17	43
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	LTA4H	17	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	SIGMAR1	15	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	PRNP	43	38
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	HDAC1	25	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	HDAC2	16	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	NOD1	20	47
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	NOD2	53	47
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148179	GH	On-Demand	Anodyne	KCNK3	54	37
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	DRD4	18	42
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	ACHE	17	43
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	LTA4H	17	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	SIGMAR1	15	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	PRNP	43	38
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	HDAC1	25	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	HDAC2	16	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	NOD1	20	47
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	NOD2	53	47
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148181	GH	On-Demand	Anodyne	KCNK3	54	37
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	DRD4	18	42
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	ACHE	17	43
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	LTA4H	17	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	SIGMAR1	15	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	PRNP	43	38
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	HDAC1	25	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	HDAC2	16	41
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	NOD1	20	47
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	NOD2	53	47
NC[C@@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@H]1C(F)(F)F	ZINC000872148182	GH	On-Demand	Anodyne	KCNK3	54	37
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	DRD4	18	42
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	ACHE	17	43
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	LTA4H	17	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	SIGMAR1	15	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	PRNP	43	38
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	HDAC1	25	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	HDAC2	16	41
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	NOD1	20	47
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	NOD2	53	47
NC[C@H]1CN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C[C@@H]1C(F)(F)F	ZINC000872148184	GH	On-Demand	Anodyne	KCNK3	54	37
NC[C@H]1CN(CCOc2ccc(Br)cc2)C[C@@H]1C(F)(F)F	ZINC000872148204	FF	On-Demand	Anodyne	LTA4H	31	47
NC[C@H]1CN(CCOc2ccc(Br)cc2)C[C@H]1C(F)(F)F	ZINC000872148205	FF	On-Demand	Anodyne	LTA4H	31	47
NC[C@@H]1CN(CCOc2ccc(Br)cc2)C[C@@H]1C(F)(F)F	ZINC000872148206	FF	On-Demand	Anodyne	LTA4H	31	47
NC[C@@H]1CN(CCOc2ccc(Br)cc2)C[C@H]1C(F)(F)F	ZINC000872148207	FF	On-Demand	Anodyne	LTA4H	31	47
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@H]1C(F)(F)F	ZINC000872148250	GF	On-Demand	Anodyne	KCNA3	40	35
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@H]1C(F)(F)F	ZINC000872148250	GF	On-Demand	Anodyne	NPFFR1	16	41
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@H]1C(F)(F)F	ZINC000872148252	GF	On-Demand	Anodyne	KCNA3	40	35
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@H]1C(F)(F)F	ZINC000872148252	GF	On-Demand	Anodyne	NPFFR1	16	41
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@@H]1C(F)(F)F	ZINC000872148254	GF	On-Demand	Anodyne	KCNA3	40	35
NC[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@@H]1C(F)(F)F	ZINC000872148254	GF	On-Demand	Anodyne	NPFFR1	16	41
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@@H]1C(F)(F)F	ZINC000872148256	GF	On-Demand	Anodyne	KCNA3	40	35
NC[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)C[C@@H]1C(F)(F)F	ZINC000872148256	GF	On-Demand	Anodyne	NPFFR1	16	41
NC[C@@H]1CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148258	FF	On-Demand	Anodyne	HTR7	15	51
NC[C@@H]1CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148258	FF	On-Demand	Anodyne	BDKRB1	48	39
NC[C@@H]1CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148260	FF	On-Demand	Anodyne	HTR7	15	51
NC[C@@H]1CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148260	FF	On-Demand	Anodyne	BDKRB1	48	39
NC[C@@H]1CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148261	FF	On-Demand	Anodyne	HTR7	15	51
NC[C@@H]1CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148261	FF	On-Demand	Anodyne	BDKRB1	48	39
NC[C@@H]1CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148262	FF	On-Demand	Anodyne	HTR7	15	51
NC[C@@H]1CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148262	FF	On-Demand	Anodyne	BDKRB1	48	39
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)CC1	ZINC000872148359	GC	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)CC1	ZINC000872148360	GC	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)CC1	ZINC000872148361	GC	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)CC1	ZINC000872148362	GC	On-Demand	Anodyne	P2RY12	41	36
NC[C@@H]1CN(CC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148510	FE	On-Demand	Anodyne	BDKRB1	51	40
NC[C@@H]1CN(CC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148510	FE	On-Demand	Anodyne	BIRC2	40	37
NC[C@@H]1CN(CC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148512	FE	On-Demand	Anodyne	BDKRB1	51	40
NC[C@@H]1CN(CC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C(F)(F)F	ZINC000872148512	FE	On-Demand	Anodyne	BIRC2	40	37
NC[C@@H]1CN(CC(=O)N[C@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148513	FE	On-Demand	Anodyne	BDKRB1	51	40
NC[C@@H]1CN(CC(=O)N[C@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148513	FE	On-Demand	Anodyne	BIRC2	40	37
NC[C@@H]1CN(CC(=O)N[C@@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148515	FE	On-Demand	Anodyne	BDKRB1	51	40
NC[C@@H]1CN(CC(=O)N[C@@H]2CCCc3ccccc32)C[C@@H]1C(F)(F)F	ZINC000872148515	FE	On-Demand	Anodyne	BIRC2	40	37
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148532	FC	On-Demand	Anodyne	CA2	15	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148532	FC	On-Demand	Anodyne	CA7	27	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148532	FC	On-Demand	Anodyne	CA12	17	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148532	FC	On-Demand	Anodyne	CA9	16	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148540	FC	On-Demand	Anodyne	CA2	15	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148540	FC	On-Demand	Anodyne	CA7	27	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148540	FC	On-Demand	Anodyne	CA12	17	54
NC[C@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148540	FC	On-Demand	Anodyne	CA9	16	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148542	FC	On-Demand	Anodyne	CA2	15	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148542	FC	On-Demand	Anodyne	CA7	27	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148542	FC	On-Demand	Anodyne	CA12	17	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@@H]1C(F)(F)F	ZINC000872148542	FC	On-Demand	Anodyne	CA9	16	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148544	FC	On-Demand	Anodyne	CA2	15	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148544	FC	On-Demand	Anodyne	CA7	27	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148544	FC	On-Demand	Anodyne	CA12	17	54
NC[C@@H]1CN(CCOc2ccc(S(N)(=O)=O)cc2)C[C@H]1C(F)(F)F	ZINC000872148544	FC	On-Demand	Anodyne	CA9	16	54
CC(=O)c1cccc(NC(=O)CN2C[C@@H]3CNC[C@]3(C)C2)c1	ZINC000872148592	DD	On-Demand	Anodyne	CCR3	19	41
C[C@H](c1nc(-c2cccs2)no1)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872148597	EF	On-Demand	Anodyne	ETHR	47	41
C[C@H](c1nc(-c2cccs2)no1)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872148599	EF	On-Demand	Anodyne	ETHR	47	41
C[C@H](c1nc(-c2cccs2)no1)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872148600	EF	On-Demand	Anodyne	ETHR	47	41
C[C@H](c1nc(-c2cccs2)no1)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872148601	EF	On-Demand	Anodyne	ETHR	47	41
NC[C@@H]1CN(CCC(=O)NCc2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC000872148646	FE	On-Demand	Anodyne	P2RX7	62	41
NC[C@@H]1CN(CCC(=O)NCc2ccccc2Cl)C[C@@H]1C(F)(F)F	ZINC000872148647	FE	On-Demand	Anodyne	P2RX7	62	41
NC[C@H]1CN(CCC(=O)NCc2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC000872148648	FE	On-Demand	Anodyne	P2RX7	62	41
NC[C@H]1CN(CCC(=O)NCc2ccccc2Cl)C[C@@H]1C(F)(F)F	ZINC000872148649	FE	On-Demand	Anodyne	P2RX7	62	41
NC[C@H]1CN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F	ZINC000872148789	FF	On-Demand	Anodyne	GRM5	17	46
NC[C@H]1CN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C(F)(F)F	ZINC000872148790	FF	On-Demand	Anodyne	GRM5	17	46
NC[C@@H]1CN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C(F)(F)F	ZINC000872148791	FF	On-Demand	Anodyne	GRM5	17	46
NC[C@@H]1CN(Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F	ZINC000872148792	FF	On-Demand	Anodyne	GRM5	17	46
NC[C@H]1CN(CCC(=O)Nc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872148929	EF	On-Demand	Anodyne	MCHR1	16	47
NC[C@H]1CN(CCC(=O)Nc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872148931	EF	On-Demand	Anodyne	MCHR1	16	47
NC[C@@H]1CN(CCC(=O)Nc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872148932	EF	On-Demand	Anodyne	MCHR1	16	47
NC[C@@H]1CN(CCC(=O)Nc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872148933	EF	On-Demand	Anodyne	MCHR1	16	47
NC[C@@H]1CN(CC(=O)NCCCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149004	ED	On-Demand	Anodyne	FKBP1A	20	40
NC[C@@H]1CN(CC(=O)NCCCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149004	ED	On-Demand	Anodyne	CRTM	28	40
NC[C@H]1CN(CC(=O)NCCCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149005	ED	On-Demand	Anodyne	FKBP1A	20	40
NC[C@H]1CN(CC(=O)NCCCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149005	ED	On-Demand	Anodyne	CRTM	28	40
NC[C@@H]1CN(CC(=O)NCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149006	ED	On-Demand	Anodyne	FKBP1A	20	40
NC[C@@H]1CN(CC(=O)NCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149006	ED	On-Demand	Anodyne	CRTM	28	40
NC[C@H]1CN(CC(=O)NCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149007	ED	On-Demand	Anodyne	FKBP1A	20	40
NC[C@H]1CN(CC(=O)NCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149007	ED	On-Demand	Anodyne	CRTM	28	40
NC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872149016	DE	On-Demand	Bother	KCNJ1	23	46
NC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872149017	DE	On-Demand	Bother	KCNJ1	23	46
NC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872149018	DE	On-Demand	Bother	KCNJ1	23	46
NC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872149019	DE	On-Demand	Bother	KCNJ1	23	46
CC(C)c1cccc(C(C)C)c1NC(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872149020	GH	On-Demand	Anodyne	SOAT1	55	39
CC(C)c1cccc(C(C)C)c1NC(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872149021	GH	On-Demand	Anodyne	SOAT1	55	39
CC(C)c1cccc(C(C)C)c1NC(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872149022	GH	On-Demand	Anodyne	SOAT1	55	39
CC(C)c1cccc(C(C)C)c1NC(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872149023	GH	On-Demand	Anodyne	SOAT1	55	39
NC[C@H]1CN(CCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149024	DF	On-Demand	Anodyne	CHRNA10	19	42
NC[C@H]1CN(CCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149025	DF	On-Demand	Anodyne	CHRNA10	19	42
NC[C@@H]1CN(CCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149026	DF	On-Demand	Anodyne	CHRNA10	19	42
NC[C@@H]1CN(CCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149027	DF	On-Demand	Anodyne	CHRNA10	19	42
NC[C@@H]1CN([C@@H](C(=O)N2CCCCC2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149076	FF	On-Demand	Anodyne	DPP7	66	45
NC[C@@H]1CN([C@H](C(=O)N2CCCCC2)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149077	FF	On-Demand	Anodyne	DPP7	66	45
NC[C@@H]1CN([C@@H](C(=O)N2CCCCC2)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149078	FF	On-Demand	Anodyne	DPP7	66	45
NC[C@@H]1CN([C@H](C(=O)N2CCCCC2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149079	FF	On-Demand	Anodyne	DPP7	66	45
NC[C@H]1CN(CCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149090	DF	On-Demand	Anodyne	HRH3	50	41
NC[C@H]1CN(CCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149090	DF	On-Demand	Anodyne	MEN1	43	37
NC[C@H]1CN(CCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149091	DF	On-Demand	Anodyne	HRH3	50	41
NC[C@H]1CN(CCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149091	DF	On-Demand	Anodyne	MEN1	43	37
NC[C@@H]1CN(CCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149092	DF	On-Demand	Anodyne	HRH3	50	41
NC[C@@H]1CN(CCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149092	DF	On-Demand	Anodyne	MEN1	43	37
NC[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149093	DF	On-Demand	Anodyne	HRH3	50	41
NC[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149093	DF	On-Demand	Anodyne	MEN1	43	37
NC[C@@H]1CN(Cc2ccc3c(c2)CNCC3)C[C@@H]1C(F)(F)F	ZINC000872149142	DD	On-Demand	Anodyne	PNMT	26	43
NC[C@H]1CN(Cc2ccc3c(c2)CNCC3)C[C@@H]1C(F)(F)F	ZINC000872149143	DD	On-Demand	Anodyne	PNMT	26	43
NC[C@@H]1CN(Cc2ccc3c(c2)CNCC3)C[C@H]1C(F)(F)F	ZINC000872149144	DD	On-Demand	Anodyne	PNMT	26	43
NC[C@H]1CN(Cc2ccc3c(c2)CNCC3)C[C@H]1C(F)(F)F	ZINC000872149145	DD	On-Demand	Anodyne	PNMT	26	43
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149163	DD	On-Demand	Bother	CACNA1C	46	35
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149163	DD	On-Demand	Bother	CACNA1D	73	35
NC[C@H]1CN(CCCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149180	DF	On-Demand	Anodyne	HRH3	29	53
NC[C@@H]1CN(CCCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149181	DF	On-Demand	Anodyne	HRH3	29	53
NC[C@@H]1CN(CCCCOc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149182	DF	On-Demand	Anodyne	HRH3	29	53
NC[C@H]1CN(CCCCOc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149183	DF	On-Demand	Anodyne	HRH3	29	53
NC[C@@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@@H]1C(F)(F)F	ZINC000872149188	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@@H]1C(F)(F)F	ZINC000872149188	EE	On-Demand	Anodyne	S1PR1	16	43
NC[C@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@H]1C(F)(F)F	ZINC000872149191	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@H]1C(F)(F)F	ZINC000872149191	EE	On-Demand	Anodyne	S1PR1	16	43
NC[C@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@@H]1C(F)(F)F	ZINC000872149193	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@@H]1C(F)(F)F	ZINC000872149193	EE	On-Demand	Anodyne	S1PR1	16	43
NC[C@@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@H]1C(F)(F)F	ZINC000872149194	EE	On-Demand	Anodyne	S1PR4	15	43
NC[C@@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@H]1C(F)(F)F	ZINC000872149194	EE	On-Demand	Anodyne	S1PR1	16	43
NC[C@H]1CN(CCCOc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872149220	EE	On-Demand	Anodyne	HRH3	22	47
NC[C@@H]1CN(CCCOc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872149221	EE	On-Demand	Anodyne	HRH3	22	47
NC[C@H]1CN(CCCOc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872149222	EE	On-Demand	Anodyne	HRH3	22	47
NC[C@@H]1CN(CCCOc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872149223	EE	On-Demand	Anodyne	HRH3	22	47
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	DRD4	19	40
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	ACHE	15	43
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	CCR2	17	40
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	NOD2	41	37
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	KCNK3	101	42
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149236	GH	On-Demand	Anodyne	KCNK9	63	37
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	DRD4	19	40
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	ACHE	15	43
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	CCR2	17	40
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	NOD2	41	37
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	KCNK3	101	42
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149237	GH	On-Demand	Anodyne	KCNK9	63	37
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	DRD4	19	40
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	ACHE	15	43
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	CCR2	17	40
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	NOD2	41	37
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	KCNK3	101	42
NC[C@@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H]1C(F)(F)F	ZINC000872149238	GH	On-Demand	Anodyne	KCNK9	63	37
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	DRD4	19	40
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	ACHE	15	43
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	CCR2	17	40
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	NOD2	41	37
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	KCNK3	101	42
NC[C@H]1CN(Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H]1C(F)(F)F	ZINC000872149239	GH	On-Demand	Anodyne	KCNK9	63	37
NC[C@@H]1CN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149260	GD	On-Demand	Anodyne	MAPK13	45	32
NC[C@@H]1CN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149261	GD	On-Demand	Anodyne	MAPK13	45	32
NC[C@H]1CN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149262	GD	On-Demand	Anodyne	MAPK13	45	32
NC[C@H]1CN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149263	GD	On-Demand	Anodyne	MAPK13	45	32
COc1ccc([C@H](NC(=O)CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)C(C)C)cc1	ZINC000872149264	GF	On-Demand	Anodyne	EDNRB	17	41
COc1ccc([C@H](NC(=O)CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)C(C)C)cc1	ZINC000872149265	GF	On-Demand	Anodyne	EDNRB	17	41
COc1ccc([C@H](NC(=O)CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)C(C)C)cc1	ZINC000872149266	GF	On-Demand	Anodyne	EDNRB	17	41
COc1ccc([C@H](NC(=O)CN2C[C@H](CN)[C@H](C(F)(F)F)C2)C(C)C)cc1	ZINC000872149267	GF	On-Demand	Anodyne	EDNRB	17	41
COc1ccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872149326	EE	On-Demand	Anodyne	MMP3	17	40
COc1ccc(NC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872149327	EE	On-Demand	Anodyne	MMP3	17	40
COc1ccc(NC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149328	EE	On-Demand	Anodyne	MMP3	17	40
COc1ccc(NC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149329	EE	On-Demand	Anodyne	MMP3	17	40
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149380	FE	On-Demand	Anodyne	SLC1A1	28	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149380	FE	On-Demand	Anodyne	SLC1A3	26	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149380	FE	On-Demand	Anodyne	SLC1A2	28	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149380	FE	On-Demand	Anodyne	MCHR1	23	40
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149381	FE	On-Demand	Anodyne	SLC1A1	28	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149381	FE	On-Demand	Anodyne	SLC1A3	26	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149381	FE	On-Demand	Anodyne	SLC1A2	28	43
NC[C@@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149381	FE	On-Demand	Anodyne	MCHR1	23	40
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149382	FE	On-Demand	Anodyne	SLC1A1	28	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149382	FE	On-Demand	Anodyne	SLC1A3	26	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149382	FE	On-Demand	Anodyne	SLC1A2	28	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149382	FE	On-Demand	Anodyne	MCHR1	23	40
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149384	FE	On-Demand	Anodyne	SLC1A1	28	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149384	FE	On-Demand	Anodyne	SLC1A3	26	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149384	FE	On-Demand	Anodyne	SLC1A2	28	43
NC[C@H]1CN(CC(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149384	FE	On-Demand	Anodyne	MCHR1	23	40
NC[C@@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872149385	FD	On-Demand	Anodyne	NOS2	97	38
NC[C@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872149386	FD	On-Demand	Anodyne	NOS2	97	38
NC[C@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)C[C@@H]1C(F)(F)F	ZINC000872149387	FD	On-Demand	Anodyne	NOS2	97	38
NC[C@@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)C[C@H]1C(F)(F)F	ZINC000872149389	FD	On-Demand	Anodyne	NOS2	97	38
NC[C@@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872149444	GD	On-Demand	Anodyne	SFRP1	81	35
NC[C@@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872149444	GD	On-Demand	Anodyne	WNT3	41	33
NC[C@@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@H]1C(F)(F)F	ZINC000872149445	GD	On-Demand	Anodyne	SFRP1	81	35
NC[C@@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@H]1C(F)(F)F	ZINC000872149445	GD	On-Demand	Anodyne	WNT3	41	33
NC[C@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@H]1C(F)(F)F	ZINC000872149446	GD	On-Demand	Anodyne	SFRP1	81	35
NC[C@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@H]1C(F)(F)F	ZINC000872149446	GD	On-Demand	Anodyne	WNT3	41	33
NC[C@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872149447	GD	On-Demand	Anodyne	SFRP1	81	35
NC[C@H]1CN(Cc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872149447	GD	On-Demand	Anodyne	WNT3	41	33
NC[C@@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872149524	GE	On-Demand	Anodyne	SSTR4	51	36
NC[C@@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872149524	GE	On-Demand	Anodyne	SSTR5	42	36
NC[C@@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872149525	GE	On-Demand	Anodyne	SSTR4	51	36
NC[C@@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872149525	GE	On-Demand	Anodyne	SSTR5	42	36
NC[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872149526	GE	On-Demand	Anodyne	SSTR4	51	36
NC[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872149526	GE	On-Demand	Anodyne	SSTR5	42	36
NC[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872149527	GE	On-Demand	Anodyne	SSTR4	51	36
NC[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872149527	GE	On-Demand	Anodyne	SSTR5	42	36
NC[C@@H]1CN(CC(=O)Nc2ccccc2N2CCCC2=O)C[C@H]1C(F)(F)F	ZINC000872149572	GD	On-Demand	Anodyne	KCNQ2	42	38
NC[C@@H]1CN(CC(=O)Nc2ccccc2N2CCCC2=O)C[C@@H]1C(F)(F)F	ZINC000872149573	GD	On-Demand	Anodyne	KCNQ2	42	38
NC[C@H]1CN(CC(=O)Nc2ccccc2N2CCCC2=O)C[C@H]1C(F)(F)F	ZINC000872149574	GD	On-Demand	Anodyne	KCNQ2	42	38
NC[C@H]1CN(CC(=O)Nc2ccccc2N2CCCC2=O)C[C@@H]1C(F)(F)F	ZINC000872149575	GD	On-Demand	Anodyne	KCNQ2	42	38
NC[C@@H]1CN(CC(=O)Nc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149600	EE	On-Demand	Anodyne	MCHR1	22	42
NC[C@H]1CN(CC(=O)Nc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149601	EE	On-Demand	Anodyne	MCHR1	22	42
NC[C@H]1CN(CC(=O)Nc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872149602	EE	On-Demand	Anodyne	MCHR1	22	42
NC[C@@H]1CN(CC(=O)Nc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872149603	EE	On-Demand	Anodyne	MCHR1	22	42
COc1ccc(CN(C)C(=O)CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872149609	GD	On-Demand	Anodyne	MT-ND1	18	45
COc1ccc(CN(C)C(=O)CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872149610	GD	On-Demand	Anodyne	MT-ND1	18	45
COc1ccc(CN(C)C(=O)CN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872149611	GD	On-Demand	Anodyne	MT-ND1	18	45
COc1ccc(CN(C)C(=O)CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872149613	GD	On-Demand	Anodyne	MT-ND1	18	45
NC[C@@H]1CN([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149653	GH	On-Demand	Anodyne	NPY2R	42	38
NC[C@@H]1CN([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872149655	GH	On-Demand	Anodyne	NPY2R	42	38
NC[C@@H]1CN([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149658	GH	On-Demand	Anodyne	NPY2R	42	38
NC[C@@H]1CN([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872149660	GH	On-Demand	Anodyne	NPY2R	42	38
NC[C@@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872149663	GF	On-Demand	Anodyne	GRIN2B	82	45
NC[C@@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872149663	GF	On-Demand	Anodyne	SIGMAR1	17	40
NC[C@@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872149664	GF	On-Demand	Anodyne	GRIN2B	82	45
NC[C@@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872149664	GF	On-Demand	Anodyne	SIGMAR1	17	40
NC[C@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872149665	GF	On-Demand	Anodyne	GRIN2B	82	45
NC[C@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872149665	GF	On-Demand	Anodyne	SIGMAR1	17	40
NC[C@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872149666	GF	On-Demand	Anodyne	GRIN2B	82	45
NC[C@H]1CN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872149666	GF	On-Demand	Anodyne	SIGMAR1	17	40
CCOc1ccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149667	EF	On-Demand	Anodyne	PSMB1	40	40
CCOc1ccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872149668	EF	On-Demand	Anodyne	PSMB1	40	40
CCOc1ccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872149669	EF	On-Demand	Anodyne	PSMB1	40	40
CCOc1ccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149670	EF	On-Demand	Anodyne	PSMB1	40	40
CCOc1ccccc1NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149719	DD	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149719	DD	On-Demand	Anodyne	HCN4	40	31
N#Cc1ccc(CCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149772	CE	On-Demand	Mild	KCNJ1	20	52
N#Cc1ccc(CCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872149774	CE	On-Demand	Mild	KCNJ1	20	52
N#Cc1ccc(CCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872149777	CE	On-Demand	Mild	KCNJ1	20	52
N#Cc1ccc(CCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872149780	CE	On-Demand	Mild	KCNJ1	20	52
CC(C)c1cccc(C(C)C)c1NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149873	EG	On-Demand	Anodyne	SOAT1	54	39
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149893	CD	On-Demand	Anodyne	DRD4	29	52
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872149893	CD	On-Demand	Anodyne	TPP2	60	35
NC[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149896	GD	On-Demand	Anodyne	MAPK14	23	40
NC[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149896	GD	On-Demand	Anodyne	CCR2	56	39
NC[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149897	GD	On-Demand	Anodyne	MAPK14	23	40
NC[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@H]1C(F)(F)F	ZINC000872149897	GD	On-Demand	Anodyne	CCR2	56	39
NC[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149898	GD	On-Demand	Anodyne	MAPK14	23	40
NC[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149898	GD	On-Demand	Anodyne	CCR2	56	39
NC[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149899	GD	On-Demand	Anodyne	MAPK14	23	40
NC[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@@H]1C(F)(F)F	ZINC000872149899	GD	On-Demand	Anodyne	CCR2	56	39
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150063	FE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872150064	FE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872150065	FE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150066	FE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
NC[C@H]1CN(CC(=O)Nc2ccccc2C(F)(F)F)C[C@H]1C(F)(F)F	ZINC000872150088	FF	On-Demand	Anodyne	RBP4	77	37
NC[C@@H]1CN(CC(=O)Nc2ccccc2C(F)(F)F)C[C@@H]1C(F)(F)F	ZINC000872150089	FF	On-Demand	Anodyne	RBP4	77	37
NC[C@@H]1CN(CC(=O)Nc2ccccc2C(F)(F)F)C[C@H]1C(F)(F)F	ZINC000872150090	FF	On-Demand	Anodyne	RBP4	77	37
NC[C@H]1CN(CC(=O)Nc2ccccc2C(F)(F)F)C[C@@H]1C(F)(F)F	ZINC000872150091	FF	On-Demand	Anodyne	RBP4	77	37
NC[C@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872150136	FF	On-Demand	Anodyne	S1PR4	15	40
NC[C@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872150136	FF	On-Demand	Anodyne	S1PR5	35	40
NC[C@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872150138	FF	On-Demand	Anodyne	S1PR4	15	40
NC[C@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872150138	FF	On-Demand	Anodyne	S1PR5	35	40
NC[C@@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872150140	FF	On-Demand	Anodyne	S1PR4	15	40
NC[C@@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872150140	FF	On-Demand	Anodyne	S1PR5	35	40
NC[C@@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872150142	FF	On-Demand	Anodyne	S1PR4	15	40
NC[C@@H]1CN(Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872150142	FF	On-Demand	Anodyne	S1PR5	35	40
NC[C@@H]1CN(CC(=O)N2CCc3ccccc3C2)C[C@@H]1C(F)(F)F	ZINC000872150148	ED	On-Demand	Anodyne	DPP8	22	45
NC[C@H]1CN(CC(=O)N2CCc3ccccc3C2)C[C@@H]1C(F)(F)F	ZINC000872150151	ED	On-Demand	Anodyne	DPP8	22	45
NC[C@@H]1CN(CC(=O)N2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872150155	ED	On-Demand	Anodyne	DPP8	22	45
NC[C@H]1CN(CC(=O)N2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872150158	ED	On-Demand	Anodyne	DPP8	22	45
NC[C@@H]1CN(CC(=O)Nc2ccc(Cl)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872150227	FE	On-Demand	Anodyne	ENV	44	39
NC[C@@H]1CN(CC(=O)Nc2ccc(Cl)c(F)c2)C[C@@H]1C(F)(F)F	ZINC000872150230	FE	On-Demand	Anodyne	ENV	44	39
NC[C@H]1CN(CC(=O)Nc2ccc(Cl)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872150233	FE	On-Demand	Anodyne	ENV	44	39
NC[C@H]1CN(CC(=O)Nc2ccc(Cl)c(F)c2)C[C@@H]1C(F)(F)F	ZINC000872150236	FE	On-Demand	Anodyne	ENV	44	39
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150324	EE	On-Demand	Anodyne	DRD4	30	56
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150324	EE	On-Demand	Anodyne	TPP2	60	36
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872150325	EE	On-Demand	Anodyne	DRD4	30	56
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872150325	EE	On-Demand	Anodyne	TPP2	60	36
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872150326	EE	On-Demand	Anodyne	DRD4	30	56
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872150326	EE	On-Demand	Anodyne	TPP2	60	36
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150327	EE	On-Demand	Anodyne	DRD4	30	56
C[C@@H]1Cc2ccccc2N1C(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872150327	EE	On-Demand	Anodyne	TPP2	60	36
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872150372	GD	On-Demand	Anodyne	TRPV1	18	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872150372	GD	On-Demand	Anodyne	MT-ND1	24	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872150372	GD	On-Demand	Anodyne	CARM1	63	38
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1OC	ZINC000872150372	GD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872150373	GD	On-Demand	Anodyne	TRPV1	18	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872150373	GD	On-Demand	Anodyne	MT-ND1	24	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872150373	GD	On-Demand	Anodyne	CARM1	63	38
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1OC	ZINC000872150373	GD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150374	GD	On-Demand	Anodyne	TRPV1	18	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150374	GD	On-Demand	Anodyne	MT-ND1	24	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150374	GD	On-Demand	Anodyne	CARM1	63	38
COc1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150374	GD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150375	GD	On-Demand	Anodyne	TRPV1	18	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150375	GD	On-Demand	Anodyne	MT-ND1	24	43
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150375	GD	On-Demand	Anodyne	CARM1	63	38
COc1ccc(CNC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1OC	ZINC000872150375	GD	On-Demand	Anodyne	DRTS_TRYCR	44	31
CC(=O)Nc1cccc(CN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872150398	DE	On-Demand	Anodyne	MCHR1	18	43
CC(=O)Nc1cccc(CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872150401	DE	On-Demand	Anodyne	MCHR1	18	43
CC(=O)Nc1cccc(CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872150403	DE	On-Demand	Anodyne	MCHR1	18	43
CC(=O)Nc1cccc(CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872150405	DE	On-Demand	Anodyne	MCHR1	18	43
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150428	GD	On-Demand	Anodyne	MTOR	70	35
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150428	GD	On-Demand	Anodyne	EPHX2	17	40
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150428	GD	On-Demand	Anodyne	STAT6	56	35
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150435	GD	On-Demand	Anodyne	MTOR	70	35
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150435	GD	On-Demand	Anodyne	EPHX2	17	40
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@@H]1C(F)(F)F	ZINC000872150435	GD	On-Demand	Anodyne	STAT6	56	35
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150438	GD	On-Demand	Anodyne	MTOR	70	35
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150438	GD	On-Demand	Anodyne	EPHX2	17	40
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150438	GD	On-Demand	Anodyne	STAT6	56	35
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150440	GD	On-Demand	Anodyne	MTOR	70	35
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150440	GD	On-Demand	Anodyne	EPHX2	17	40
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872150440	GD	On-Demand	Anodyne	STAT6	56	35
NC[C@@H]1CN(CC(=O)NCc2cccnc2)C[C@@H]1C(F)(F)F	ZINC000872150442	DC	On-Demand	Anodyne	NAMPT	55	38
NC[C@H]1CN(CC(=O)NCc2cccnc2)C[C@H]1C(F)(F)F	ZINC000872150443	DC	On-Demand	Anodyne	NAMPT	55	38
NC[C@H]1CN(CC(=O)NCc2cccnc2)C[C@@H]1C(F)(F)F	ZINC000872150445	DC	On-Demand	Anodyne	NAMPT	55	38
NC[C@@H]1CN(CC(=O)NCc2cccnc2)C[C@H]1C(F)(F)F	ZINC000872150447	DC	On-Demand	Anodyne	NAMPT	55	38
CC[C@@H](C)c1ccc(NC(=O)CN2C[C@@H]3CNC[C@]3(C)C2)cc1	ZINC000872150491	DF	On-Demand	Anodyne	SCN2A	15	40
NC[C@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150554	GD	On-Demand	Anodyne	SIGMAR1	45	41
NC[C@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150554	GD	On-Demand	Anodyne	CACNA1G	19	41
NC[C@@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150559	GD	On-Demand	Anodyne	SIGMAR1	45	41
NC[C@@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150559	GD	On-Demand	Anodyne	CACNA1G	19	41
NC[C@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150561	GD	On-Demand	Anodyne	SIGMAR1	45	41
NC[C@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150561	GD	On-Demand	Anodyne	CACNA1G	19	41
NC[C@@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150562	GD	On-Demand	Anodyne	SIGMAR1	45	41
NC[C@@H]1CN(CC(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150562	GD	On-Demand	Anodyne	CACNA1G	19	41
C[C@@H](C(=O)N(C)Cc1ccccc1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872150573	DD	On-Demand	Anodyne	TACR1	20	41
C[C@H](C(=O)N(C)Cc1ccccc1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872150574	DD	On-Demand	Anodyne	TACR1	20	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872150581	ED	On-Demand	Bother	KCNMA1	20	44
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872150583	ED	On-Demand	Bother	KCNMA1	20	44
NC[C@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872150585	GD	On-Demand	Reactive	CACNA1I	36	42
NC[C@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872150586	GD	On-Demand	Reactive	CACNA1I	36	42
NC[C@@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872150587	GD	On-Demand	Reactive	CACNA1I	36	42
NC[C@@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872150589	GD	On-Demand	Reactive	CACNA1I	36	42
Cc1c(NC(=O)[C@H](C)N2C[C@@H]3CNC[C@]3(C)C2)c(=O)n(-c2ccccc2)n1C	ZINC000872150632	GD	On-Demand	Anodyne	FPR2	39	42
Cc1c(NC(=O)[C@@H](C)N2C[C@@H]3CNC[C@]3(C)C2)c(=O)n(-c2ccccc2)n1C	ZINC000872150633	GD	On-Demand	Anodyne	FPR2	39	42
NC[C@H]1CN(CC(=O)N2CCN(c3ccc(F)cc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150806	GD	On-Demand	Anodyne	CCR1	16	46
NC[C@@H]1CN(CC(=O)N2CCN(c3ccc(F)cc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872150808	GD	On-Demand	Anodyne	CCR1	16	46
NC[C@@H]1CN(CC(=O)N2CCN(c3ccc(F)cc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150811	GD	On-Demand	Anodyne	CCR1	16	46
NC[C@H]1CN(CC(=O)N2CCN(c3ccc(F)cc3)CC2)C[C@H]1C(F)(F)F	ZINC000872150814	GD	On-Demand	Anodyne	CCR1	16	46
NC[C@@H]1CN(CC(=O)NC[C@H]2CCN(c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872150830	GD	On-Demand	Anodyne	CACNA1I	41	33
NC[C@@H]1CN(CC(=O)NC[C@H]2CCN(c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872150832	GD	On-Demand	Anodyne	CACNA1I	41	33
NC[C@@H]1CN(CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872150834	GD	On-Demand	Anodyne	CACNA1I	41	33
NC[C@@H]1CN(CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872150837	GD	On-Demand	Anodyne	CACNA1I	41	33
NC[C@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872150889	FD	On-Demand	Anodyne	HTR7	17	51
NC[C@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872150889	FD	On-Demand	Anodyne	SFRP1	60	35
NC[C@@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872150890	FD	On-Demand	Anodyne	HTR7	17	51
NC[C@@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872150890	FD	On-Demand	Anodyne	SFRP1	60	35
NC[C@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872150891	FD	On-Demand	Anodyne	HTR7	17	51
NC[C@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872150891	FD	On-Demand	Anodyne	SFRP1	60	35
NC[C@@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872150892	FD	On-Demand	Anodyne	HTR7	17	51
NC[C@@H]1CN(CCNS(=O)(=O)c2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872150892	FD	On-Demand	Anodyne	SFRP1	60	35
CS(=O)(=O)c1ccc(OCCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872150901	GD	On-Demand	Anodyne	HRH3	47	46
CS(=O)(=O)c1ccc(OCCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872150902	GD	On-Demand	Anodyne	HRH3	47	46
CS(=O)(=O)c1ccc(OCCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872150903	GD	On-Demand	Anodyne	HRH3	47	46
CS(=O)(=O)c1ccc(OCCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872150904	GD	On-Demand	Anodyne	HRH3	47	46
NC[C@@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@H]1C(F)(F)F	ZINC000872150917	FE	On-Demand	Anodyne	CSNK1D	45	48
NC[C@@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@H]1C(F)(F)F	ZINC000872150917	FE	On-Demand	Anodyne	SLC27A1	35	54
NC[C@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@@H]1C(F)(F)F	ZINC000872150918	FE	On-Demand	Anodyne	CSNK1D	45	48
NC[C@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@@H]1C(F)(F)F	ZINC000872150918	FE	On-Demand	Anodyne	SLC27A1	35	54
NC[C@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@H]1C(F)(F)F	ZINC000872150919	FE	On-Demand	Anodyne	CSNK1D	45	48
NC[C@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@H]1C(F)(F)F	ZINC000872150919	FE	On-Demand	Anodyne	SLC27A1	35	54
NC[C@@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@@H]1C(F)(F)F	ZINC000872150920	FE	On-Demand	Anodyne	CSNK1D	45	48
NC[C@@H]1CN(CC(=O)Nc2nc3ccccc3s2)C[C@@H]1C(F)(F)F	ZINC000872150920	FE	On-Demand	Anodyne	SLC27A1	35	54
NC[C@H]1CN(Cc2cc(-c3ccccc3)on2)C[C@H]1C(F)(F)F	ZINC000872150941	EF	On-Demand	Anodyne	GRM7	43	32
NC[C@H]1CN(Cc2cc(-c3ccccc3)on2)C[C@@H]1C(F)(F)F	ZINC000872150942	EF	On-Demand	Anodyne	GRM7	43	32
NC[C@@H]1CN(Cc2cc(-c3ccccc3)on2)C[C@@H]1C(F)(F)F	ZINC000872150943	EF	On-Demand	Anodyne	GRM7	43	32
NC[C@@H]1CN(Cc2cc(-c3ccccc3)on2)C[C@H]1C(F)(F)F	ZINC000872150944	EF	On-Demand	Anodyne	GRM7	43	32
C[C@H](NC(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1)C(=O)N1CCCCC1	ZINC000872151049	FC	On-Demand	Anodyne	DPP7	42	35
C[C@H](NC(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1)C(=O)N1CCCCC1	ZINC000872151050	FC	On-Demand	Anodyne	DPP7	42	35
C[C@H](NC(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1)C(=O)N1CCCCC1	ZINC000872151051	FC	On-Demand	Anodyne	DPP7	42	35
C[C@H](NC(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1)C(=O)N1CCCCC1	ZINC000872151052	FC	On-Demand	Anodyne	DPP7	42	35
NC[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872151081	DE	On-Demand	Bother	KCNJ1	37	55
NC[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872151082	DE	On-Demand	Bother	KCNJ1	37	55
NC[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F	ZINC000872151083	DE	On-Demand	Bother	KCNJ1	37	55
NC[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(F)(F)F	ZINC000872151084	DE	On-Demand	Bother	KCNJ1	37	55
NC[C@H]1CN(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872151093	GG	On-Demand	Anodyne	S1PR4	15	42
NC[C@H]1CN(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872151094	GG	On-Demand	Anodyne	S1PR4	15	42
NC[C@@H]1CN(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)C[C@@H]1C(F)(F)F	ZINC000872151095	GG	On-Demand	Anodyne	S1PR4	15	42
NC[C@@H]1CN(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)C[C@H]1C(F)(F)F	ZINC000872151096	GG	On-Demand	Anodyne	S1PR4	15	42
CCC[C@H](NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1)c1ccccc1	ZINC000872151115	DE	On-Demand	Anodyne	CCR5	20	40
CCC[C@@H](NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1)c1ccccc1	ZINC000872151116	DE	On-Demand	Anodyne	CCR5	20	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872151241	EH	On-Demand	Anodyne	KCNK3	105	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872151241	EH	On-Demand	Anodyne	KCNK9	63	40
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151264	FC	On-Demand	Anodyne	FKBP1A	50	41
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151266	FC	On-Demand	Anodyne	FKBP1A	50	41
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872151268	FC	On-Demand	Anodyne	FKBP1A	50	41
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872151269	FC	On-Demand	Anodyne	FKBP1A	50	41
NC[C@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872151278	GG	On-Demand	Anodyne	CCR2	29	40
NC[C@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872151278	GG	On-Demand	Anodyne	EPHX2	15	42
NC[C@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872151279	GG	On-Demand	Anodyne	CCR2	29	40
NC[C@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872151279	GG	On-Demand	Anodyne	EPHX2	15	42
NC[C@@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872151280	GG	On-Demand	Anodyne	CCR2	29	40
NC[C@@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872151280	GG	On-Demand	Anodyne	EPHX2	15	42
NC[C@@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872151281	GG	On-Demand	Anodyne	CCR2	29	40
NC[C@@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872151281	GG	On-Demand	Anodyne	EPHX2	15	42
Cc1c(NC(=O)[C@H](C)N2C[C@@H]3CNC[C@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000872151288	ED	On-Demand	Bother	COLA	45	38
Cc1c(NC(=O)[C@@H](C)N2C[C@@H]3CNC[C@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000872151289	ED	On-Demand	Bother	COLA	45	38
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151429	FF	On-Demand	Anodyne	PIM1	17	51
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151429	FF	On-Demand	Anodyne	CDC7	19	47
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151429	FF	On-Demand	Anodyne	PIM3	22	51
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151436	FF	On-Demand	Anodyne	PIM1	17	51
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151436	FF	On-Demand	Anodyne	CDC7	19	47
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151436	FF	On-Demand	Anodyne	PIM3	22	51
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151438	FF	On-Demand	Anodyne	PIM1	17	51
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151438	FF	On-Demand	Anodyne	CDC7	19	47
NC[C@@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@H]1C(F)(F)F	ZINC000872151438	FF	On-Demand	Anodyne	PIM3	22	51
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151441	FF	On-Demand	Anodyne	PIM1	17	51
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151441	FF	On-Demand	Anodyne	CDC7	19	47
NC[C@H]1CN(Cc2nc(O)c3oc4ccccc4c3n2)C[C@@H]1C(F)(F)F	ZINC000872151441	FF	On-Demand	Anodyne	PIM3	22	51
COC(=O)c1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872151449	GD	On-Demand	Anodyne	FURIN	48	32
COC(=O)c1ccc(CNC(=O)[C@H](C)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872151450	GD	On-Demand	Anodyne	FURIN	48	32
COC(=O)c1ccc(CNC(=O)[C@H](C)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872151451	GD	On-Demand	Anodyne	FURIN	48	32
COC(=O)c1ccc(CNC(=O)[C@H](C)N2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872151452	GD	On-Demand	Anodyne	FURIN	48	32
CCCN(CC(=O)Nc1ccccc1OC)C(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872151514	GD	On-Demand	Anodyne	MBTPS1	43	30
COc1ccc(CN(C(=O)CN2C[C@@H]3CNC[C@]3(C)C2)C2CC2)cc1	ZINC000872151561	ED	On-Demand	Anodyne	MBTPS1	43	31
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872151569	EF	On-Demand	Anodyne	RBP4	73	34
CCOc1ccc(-c2noc(CN3C[C@H](CN)[C@H](C(F)(F)F)C3)n2)cc1	ZINC000872151621	FF	On-Demand	Anodyne	S1PR1	15	49
CCOc1ccc(-c2noc(CN3C[C@H](CN)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872151622	FF	On-Demand	Anodyne	S1PR1	15	49
CCOc1ccc(-c2noc(CN3C[C@@H](CN)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872151623	FF	On-Demand	Anodyne	S1PR1	15	49
CCOc1ccc(-c2noc(CN3C[C@@H](C(F)(F)F)[C@H](CN)C3)n2)cc1	ZINC000872151624	FF	On-Demand	Anodyne	S1PR1	15	49
CCCOc1cccc(CNC(=O)CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872151660	FE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CNC(=O)CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872151660	FE	On-Demand	Anodyne	PDS	60	39
CCCOc1cccc(CNC(=O)CN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872151662	FE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CNC(=O)CN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872151662	FE	On-Demand	Anodyne	PDS	60	39
CCCOc1cccc(CNC(=O)CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151663	FE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CNC(=O)CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151663	FE	On-Demand	Anodyne	PDS	60	39
CCCOc1cccc(CNC(=O)CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151664	FE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CNC(=O)CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151664	FE	On-Demand	Anodyne	PDS	60	39
NC[C@@H]1CN(CC(=O)NCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872151666	GD	On-Demand	Anodyne	PDS	44	34
NC[C@H]1CN(CC(=O)NCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872151667	GD	On-Demand	Anodyne	PDS	44	34
NC[C@@H]1CN(CC(=O)NCCOc2cccc(Cl)c2)C[C@@H]1C(F)(F)F	ZINC000872151668	GD	On-Demand	Anodyne	PDS	44	34
NC[C@H]1CN(CC(=O)NCCOc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872151669	GD	On-Demand	Anodyne	PDS	44	34
CCOC(=O)c1nc(-c2ccccc2)oc1CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151715	GG	On-Demand	Anodyne	PDE8B	64	37
CCOC(=O)c1nc(-c2ccccc2)oc1CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151717	GG	On-Demand	Anodyne	PDE8B	64	37
CCOC(=O)c1nc(-c2ccccc2)oc1CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872151718	GG	On-Demand	Anodyne	PDE8B	64	37
CCOC(=O)c1nc(-c2ccccc2)oc1CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872151719	GG	On-Demand	Anodyne	PDE8B	64	37
CCCCCNC(=O)[C@H](C)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872151817	DD	On-Demand	Anodyne	ASAH1	66	33
CCCCCNC(=O)[C@H](C)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872151818	DD	On-Demand	Anodyne	ASAH1	66	33
CCCCCNC(=O)[C@H](C)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151819	DD	On-Demand	Anodyne	ASAH1	66	33
CCCCCNC(=O)[C@H](C)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151820	DD	On-Demand	Anodyne	ASAH1	66	33
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151825	FF	On-Demand	Anodyne	CTSA	45	30
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872151826	FF	On-Demand	Anodyne	CTSA	45	30
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872151827	FF	On-Demand	Anodyne	CTSA	45	30
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872151828	FF	On-Demand	Anodyne	CTSA	45	30
NC[C@H]1CN(Cc2cc(Cl)ccc2OCc2cccnc2)C[C@H]1C(F)(F)F	ZINC000872151917	GH	On-Demand	Anodyne	PTGER1	35	41
NC[C@@H]1CN(Cc2cc(Cl)ccc2OCc2cccnc2)C[C@H]1C(F)(F)F	ZINC000872151918	GH	On-Demand	Anodyne	PTGER1	35	41
NC[C@H]1CN(Cc2cc(Cl)ccc2OCc2cccnc2)C[C@@H]1C(F)(F)F	ZINC000872151919	GH	On-Demand	Anodyne	PTGER1	35	41
NC[C@@H]1CN(Cc2cc(Cl)ccc2OCc2cccnc2)C[C@@H]1C(F)(F)F	ZINC000872151920	GH	On-Demand	Anodyne	PTGER1	35	41
COC(=O)c1cccc(CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872151941	DE	On-Demand	Anodyne	CHRM3	15	42
COC(=O)c1cccc(CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151942	DE	On-Demand	Anodyne	CHRM3	15	42
COC(=O)c1cccc(CN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872151943	DE	On-Demand	Anodyne	CHRM3	15	42
COC(=O)c1cccc(CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872151944	DE	On-Demand	Anodyne	CHRM3	15	42
COc1ccc(NC(=O)[C@H](C)N2C[C@@H]3CNC[C@]3(C)C2)cc1OC	ZINC000872151994	ED	On-Demand	Anodyne	ENPP1	71	35
NC[C@@H]1CN(CC(=O)Nc2nc3c(s2)CCC3)C[C@@H]1C(F)(F)F	ZINC000872152011	ED	On-Demand	Anodyne	SLC27A1	58	53
NC[C@H]1CN(CC(=O)Nc2nc3c(s2)CCC3)C[C@H]1C(F)(F)F	ZINC000872152016	ED	On-Demand	Anodyne	SLC27A1	58	53
NC[C@H]1CN(CC(=O)Nc2nc3c(s2)CCC3)C[C@@H]1C(F)(F)F	ZINC000872152017	ED	On-Demand	Anodyne	SLC27A1	58	53
NC[C@@H]1CN(CC(=O)Nc2nc3c(s2)CCC3)C[C@H]1C(F)(F)F	ZINC000872152018	ED	On-Demand	Anodyne	SLC27A1	58	53
COC(=O)C1CCN(C(=O)CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)CC1	ZINC000872152177	FC	On-Demand	Anodyne	PTR1	44	32
COC(=O)C1CCN(C(=O)CN2C[C@H](CN)[C@H](C(F)(F)F)C2)CC1	ZINC000872152178	FC	On-Demand	Anodyne	PTR1	44	32
COC(=O)C1CCN(C(=O)CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)CC1	ZINC000872152179	FC	On-Demand	Anodyne	PTR1	44	32
COC(=O)C1CCN(C(=O)CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)CC1	ZINC000872152180	FC	On-Demand	Anodyne	PTR1	44	32
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152329	DD	On-Demand	Bother	COLA	93	36
COc1cc2c(cc1OC)CN(C(=O)CN1C[C@@H]3CNC[C@]3(C)C1)CC2	ZINC000872152331	FD	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)CN(C(=O)CN1C[C@@H]3CNC[C@]3(C)C1)CC2	ZINC000872152331	FD	On-Demand	Anodyne	ABCB1	16	47
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152335	ED	On-Demand	Bother	KCNMA1	19	43
COC(=O)c1ccc(CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)cc1	ZINC000872152361	DE	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1ccc(CN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872152362	DE	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1ccc(CN2C[C@H](CN)[C@H](C(F)(F)F)C2)cc1	ZINC000872152363	DE	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1ccc(CN2C[C@H](CN)[C@@H](C(F)(F)F)C2)cc1	ZINC000872152364	DE	On-Demand	Anodyne	NOD2	40	36
COc1ccc(OCCCN2C[C@@H]3CNC[C@]3(C)C2)cc1	ZINC000872152369	CE	On-Demand	Anodyne	HRH3	54	44
COc1ccc(OCCCN2C[C@@H]3CNC[C@]3(C)C2)cc1	ZINC000872152369	CE	On-Demand	Anodyne	HTR5A	20	42
C[C@H](C(=O)N1CCCCC1)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872152433	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCC1)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872152434	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCC1)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152435	DD	On-Demand	Anodyne	DPP7	54	39
C[C@H](C(=O)N1CCCCC1)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152436	DD	On-Demand	Anodyne	DPP7	54	39
COc1cccc(OCCN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c1	ZINC000872152437	DE	On-Demand	Anodyne	CHRNA10	27	43
COc1cccc(OCCN2C[C@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872152438	DE	On-Demand	Anodyne	CHRNA10	27	43
COc1cccc(OCCN2C[C@@H](CN)[C@@H](C(F)(F)F)C2)c1	ZINC000872152439	DE	On-Demand	Anodyne	CHRNA10	27	43
COc1cccc(OCCN2C[C@H](CN)[C@H](C(F)(F)F)C2)c1	ZINC000872152440	DE	On-Demand	Anodyne	CHRNA10	27	43
NC[C@@H]1CN(CC(=O)Nc2nc3c(s2)CCCC3)C[C@H]1C(F)(F)F	ZINC000872152445	FE	On-Demand	Anodyne	SLC27A1	60	53
NC[C@H]1CN(CC(=O)Nc2nc3c(s2)CCCC3)C[C@@H]1C(F)(F)F	ZINC000872152446	FE	On-Demand	Anodyne	SLC27A1	60	53
NC[C@H]1CN(CC(=O)Nc2nc3c(s2)CCCC3)C[C@H]1C(F)(F)F	ZINC000872152447	FE	On-Demand	Anodyne	SLC27A1	60	53
NC[C@@H]1CN(CC(=O)Nc2nc3c(s2)CCCC3)C[C@@H]1C(F)(F)F	ZINC000872152448	FE	On-Demand	Anodyne	SLC27A1	60	53
COc1ccc2c(CN3C[C@@H](C(F)(F)F)[C@H](CN)C3)cc(=O)oc2c1	ZINC000872152477	FE	On-Demand	Anodyne	CYP11B1	17	42
COc1ccc2c(CN3C[C@H](CN)[C@@H](C(F)(F)F)C3)cc(=O)oc2c1	ZINC000872152478	FE	On-Demand	Anodyne	CYP11B1	17	42
COc1ccc2c(CN3C[C@@H](CN)[C@@H](C(F)(F)F)C3)cc(=O)oc2c1	ZINC000872152479	FE	On-Demand	Anodyne	CYP11B1	17	42
COc1ccc2c(CN3C[C@H](CN)[C@H](C(F)(F)F)C3)cc(=O)oc2c1	ZINC000872152480	FE	On-Demand	Anodyne	CYP11B1	17	42
CCCCCNC(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872152497	CD	On-Demand	Anodyne	ASAH1	70	36
CCCCCNC(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152498	CD	On-Demand	Anodyne	ASAH1	70	36
CCCCCNC(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152499	CD	On-Demand	Anodyne	ASAH1	70	36
CCCCCNC(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872152500	CD	On-Demand	Anodyne	ASAH1	70	36
C[C@H](C(=O)Nc1nccs1)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152569	DD	On-Demand	Anodyne	MAP1	114	37
C[C@H](C(=O)Nc1nccs1)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872152570	DD	On-Demand	Anodyne	MAP1	114	37
C[C@H](C(=O)Nc1nccs1)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872152571	DD	On-Demand	Anodyne	MAP1	114	37
C[C@H](C(=O)Nc1nccs1)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152572	DD	On-Demand	Anodyne	MAP1	114	37
C[C@H]1CCc2ccccc2N1C(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152600	DD	On-Demand	Anodyne	DRD4	24	42
COc1ccccc1CNC(=O)[C@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152609	DD	On-Demand	Anodyne	MBTPS1	51	33
CCCOc1ccc(OCCN2C[C@@H]3CNC[C@]3(C)C2)cc1	ZINC000872152653	DE	On-Demand	Anodyne	LTA4H	31	40
Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152672	CF	On-Demand	Anodyne	PPARG	56	40
Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152672	CF	On-Demand	Anodyne	PPARA	58	40
Cc1oc(-c2ccccc2)nc1CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152672	CF	On-Demand	Anodyne	PDE8B	73	41
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152681	GE	On-Demand	Anodyne	DGAT1	38	43
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152681	GE	On-Demand	Anodyne	HPGDS	15	41
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152681	GE	On-Demand	Anodyne	SLC27A1	54	41
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152682	GE	On-Demand	Anodyne	DGAT1	38	43
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152682	GE	On-Demand	Anodyne	HPGDS	15	41
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152682	GE	On-Demand	Anodyne	SLC27A1	54	41
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152683	GE	On-Demand	Anodyne	DGAT1	38	43
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152683	GE	On-Demand	Anodyne	HPGDS	15	41
NC[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@H]1C(F)(F)F	ZINC000872152683	GE	On-Demand	Anodyne	SLC27A1	54	41
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152684	GE	On-Demand	Anodyne	DGAT1	38	43
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152684	GE	On-Demand	Anodyne	HPGDS	15	41
NC[C@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)nc2)C[C@@H]1C(F)(F)F	ZINC000872152684	GE	On-Demand	Anodyne	SLC27A1	54	41
NC[C@@H]1CN(CC(=O)Nc2cccnc2Cl)C[C@@H]1C(F)(F)F	ZINC000872152697	ED	On-Demand	Anodyne	G2YM83_BOTF4	63	33
NC[C@H]1CN(CC(=O)Nc2cccnc2Cl)C[C@H]1C(F)(F)F	ZINC000872152698	ED	On-Demand	Anodyne	G2YM83_BOTF4	63	33
NC[C@H]1CN(CC(=O)Nc2cccnc2Cl)C[C@@H]1C(F)(F)F	ZINC000872152699	ED	On-Demand	Anodyne	G2YM83_BOTF4	63	33
NC[C@@H]1CN(CC(=O)Nc2cccnc2Cl)C[C@H]1C(F)(F)F	ZINC000872152700	ED	On-Demand	Anodyne	G2YM83_BOTF4	63	33
COC(=O)c1sccc1NC(=O)CN1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152800	FD	On-Demand	Anodyne	FAS	47	47
COC(=O)c1sccc1NC(=O)CN1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872152802	FD	On-Demand	Anodyne	FAS	47	47
COC(=O)c1sccc1NC(=O)CN1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872152804	FD	On-Demand	Anodyne	FAS	47	47
COC(=O)c1sccc1NC(=O)CN1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872152806	FD	On-Demand	Anodyne	FAS	47	47
CCOc1ccccc1NC(=O)[C@@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152846	DD	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1NC(=O)[C@@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152846	DD	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1NC(=O)[C@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152848	DD	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1NC(=O)[C@H](C)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152848	DD	On-Demand	Anodyne	HCN4	40	33
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872152893	DD	On-Demand	Anodyne	G2YM83_BOTF4	69	35
Cc1cccc(NC(=O)[C@H](C)N2C[C@@H]3CNC[C@]3(C)C2)c1	ZINC000872153094	CD	On-Demand	Anodyne	KCNK3	41	35
Cc1cccc(NC(=O)[C@@H](C)N2C[C@@H]3CNC[C@]3(C)C2)c1	ZINC000872153096	CD	On-Demand	Anodyne	KCNK3	41	35
COc1ccc([C@@H](NC(=O)CN2C[C@@H]3CNC[C@]3(C)C2)C(C)C)cc1	ZINC000872153118	EE	On-Demand	Anodyne	EDNRB	19	43
COc1ccc([C@H](NC(=O)CN2C[C@@H]3CNC[C@]3(C)C2)C(C)C)cc1	ZINC000872153119	EE	On-Demand	Anodyne	EDNRB	19	43
NC[C@@H]1CN(CCC(=O)N2CCN(c3ccccn3)CC2)C[C@@H]1C(F)(F)F	ZINC000872153141	GD	On-Demand	Anodyne	DRD4	27	41
NC[C@H]1CN(CCC(=O)N2CCN(c3ccccn3)CC2)C[C@@H]1C(F)(F)F	ZINC000872153142	GD	On-Demand	Anodyne	DRD4	27	41
NC[C@@H]1CN(CCC(=O)N2CCN(c3ccccn3)CC2)C[C@H]1C(F)(F)F	ZINC000872153143	GD	On-Demand	Anodyne	DRD4	27	41
NC[C@H]1CN(CCC(=O)N2CCN(c3ccccn3)CC2)C[C@H]1C(F)(F)F	ZINC000872153144	GD	On-Demand	Anodyne	DRD4	27	41
CNC(=O)[C@@H](NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1)c1ccccc1	ZINC000872153177	EC	On-Demand	Anodyne	BIRC8	44	32
COC(=O)c1ccc(OC)c2c1CCN(CCN1CCNCC1)C2	ZINC000872153371	EC	On-Demand	Anodyne	HTR4	16	43
CN(CCC(=O)N1CCNCC1)C[C@H]1CN(c2ccccc2)C(=O)O1	ZINC000872153384	EC	On-Demand	Anodyne	SSTR1	46	42
CN(CCC(=O)N1CCNCC1)C[C@@H]1CN(c2ccccc2)C(=O)O1	ZINC000872153387	EC	On-Demand	Anodyne	SSTR1	46	42
C[C@H](C(=O)Nc1nccs1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872153422	CD	On-Demand	Anodyne	MAP1	71	35
C[C@@H](C(=O)Nc1nccs1)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872153423	CD	On-Demand	Anodyne	MAP1	71	35
CC(=O)Nc1ccc2c(c1)CN(Cc1noc(CN)n1)CC2	ZINC000872153465	DD	On-Demand	Anodyne	NOD2	43	38
CC(=O)Nc1ccc2c(c1)CN(Cc1ccc3c(c1)CNCC3)CC2	ZINC000872153491	EF	On-Demand	Anodyne	MLNR	24	48
CC(=O)Nc1ccc2c(c1)CN(Cc1ccc3c(c1)CNCC3)CC2	ZINC000872153491	EF	On-Demand	Anodyne	MCHR2	42	34
CC(=O)Nc1ccc2c(c1)CN(Cc1ccc3c(c1)CNCC3)CC2	ZINC000872153491	EF	On-Demand	Anodyne	NOD1	23	47
CC(=O)Nc1ccc2c(c1)CN(Cc1ccc3c(c1)CNCC3)CC2	ZINC000872153491	EF	On-Demand	Anodyne	NOD2	55	46
CC(=O)Nc1ccc2c(c1)CN(CC1CCNCC1)CC2	ZINC000872153492	CE	On-Demand	Anodyne	NOD2	42	35
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	DRD2	19	42
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	DRD4	28	43
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	ACHE	35	41
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	HRH2	26	41
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	DRD3	16	42
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	HTR4	15	40
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	SIGMAR1	24	41
COC(=O)CC[C@@H]1CCCN(Cc2cccc(N)c2)C1	ZINC000872153499	CE	On-Demand	Anodyne	CCR3	47	39
CCOC(=O)C1=C(CN2C[C@@H]3CNC[C@]3(C)C2)NC(=O)N[C@@H]1c1ccccc1	ZINC000872153544	GD	On-Demand	Anodyne	SLC27A4	78	37
CCOC(=O)C1=C(CN2C[C@@H]3CNC[C@]3(C)C2)NC(=O)N[C@H]1c1ccccc1	ZINC000872153545	GD	On-Demand	Anodyne	SLC27A4	78	37
COc1ccc([C@@H]2CCCCCN2C(=O)CN2C[C@@H]3CNC[C@]3(C)C2)cc1	ZINC000872153585	FF	On-Demand	Anodyne	CPT1A	70	37
CC(=O)Nc1ccc2c(c1)CN(CCCN)CC2	ZINC000872153658	BD	On-Demand	Anodyne	MCHR1	29	42
CC(=O)Nc1ccc2c(c1)CN(CCCN)CC2	ZINC000872153658	BD	On-Demand	Anodyne	NOD2	44	38
CC(=O)Nc1ccc2c(c1)CN(CCC1CCNCC1)CC2	ZINC000872153665	DE	On-Demand	Anodyne	HTR1F	19	41
CC(=O)Nc1ccc2c(c1)CN(CCC1CCNCC1)CC2	ZINC000872153665	DE	On-Demand	Anodyne	NOD2	41	34
COC(=O)CC[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872153667	ED	On-Demand	Anodyne	TACR2	18	40
COC(=O)CC[C@@H]1CCCN(C[C@H](O)[C@@H](N)Cc2ccccc2)C1	ZINC000872153667	ED	On-Demand	Anodyne	REN	85	39
COC(=O)CC[C@@H]1CCCN(Cc2noc(CN)n2)C1	ZINC000872153707	CC	On-Demand	Anodyne	BMP1	27	41
COC(=O)c1ccc(OC)c2c1CCN(CC1CCNCC1)C2	ZINC000872153709	DD	On-Demand	Anodyne	HTR4	18	41
CC(=O)Nc1ccc2c(c1)CN(Cc1cccc3c1CCNC3)CC2	ZINC000872153737	EF	On-Demand	Anodyne	NOD1	21	42
CC(=O)Nc1ccc2c(c1)CN(Cc1cccc3c1CCNC3)CC2	ZINC000872153737	EF	On-Demand	Anodyne	NOD2	49	41
C[C@H](C(=O)Nc1cccnc1Cl)N1CC[C@H](CN)c2ccccc21	ZINC000872153744	EG	On-Demand	Anodyne	KCNQ2	45	34
C[C@H](C(=O)Nc1cccnc1Cl)N1CC[C@H](CN)c2ccccc21	ZINC000872153744	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@H](C(=O)Nc1cccnc1Cl)N1CC[C@@H](CN)c2ccccc21	ZINC000872153745	EG	On-Demand	Anodyne	KCNQ2	45	34
C[C@H](C(=O)Nc1cccnc1Cl)N1CC[C@@H](CN)c2ccccc21	ZINC000872153745	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CCOc1ccccc1NC(=O)CCN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872153852	DD	On-Demand	Anodyne	HCN1	46	32
CC(=O)Nc1ccc2c(c1)CN(CCN)CC2	ZINC000872153883	BC	On-Demand	Anodyne	ABCB1	18	40
CC(=O)Nc1ccc2c(c1)CN(CCN)CC2	ZINC000872153883	BC	On-Demand	Anodyne	NOD1	23	40
CC(=O)Nc1ccc2c(c1)CN(CCN)CC2	ZINC000872153883	BC	On-Demand	Anodyne	NOD2	45	39
CC(=O)Nc1ccc2c(c1)CN(CCN1CCNCC1)CC2	ZINC000872153932	DC	On-Demand	Anodyne	NOD2	43	36
CC(=O)Nc1ccc2c(c1)CN(CCCCCCN)CC2	ZINC000872153934	CF	On-Demand	Anodyne	HTR7	16	46
CC(=O)Nc1ccc2c(c1)CN(CCCCCCN)CC2	ZINC000872153934	CF	On-Demand	Anodyne	MCHR1	26	42
CC(=O)Nc1ccc2c(c1)CN(CCCCCCN)CC2	ZINC000872153934	CF	On-Demand	Anodyne	NOD2	43	37
CC(=O)Nc1ccc2c(c1)CN(CCC(=O)N1CCNCC1)CC2	ZINC000872153941	EC	On-Demand	Anodyne	NOD2	40	34
NC(=O)Nc1ccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)cc1	ZINC000872153952	JJ	On-Demand	Anodyne	KCNK3	52	38
NC(=O)Nc1ccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)cc1	ZINC000872153952	JJ	On-Demand	Anodyne	KCNK9	49	38
CC(=O)Nc1ccc2c(c1)CN(C[C@@H]1CCNC1)CC2	ZINC000872153973	CD	On-Demand	Anodyne	NOD2	40	33
CC(=O)Nc1ccc2c(c1)CN(C[C@H]1CCNC1)CC2	ZINC000872153974	CD	On-Demand	Anodyne	NOD2	40	33
COc1ccccc1[C@H](C)N(C)C(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872154038	ED	On-Demand	Anodyne	MBTPS1	42	30
CC(=O)c1ccc(N2CCN(C(=O)CN3C[C@@H]4CNC[C@]4(C)C3)CC2)c(F)c1	ZINC000872154119	GD	On-Demand	Anodyne	SLC6A9	21	46
COc1ccc2c(CN3C[C@@H]4CNC[C@]4(C)C3)cc(=O)oc2c1	ZINC000872154147	DD	On-Demand	Anodyne	CYP11B1	17	42
NC[C@@H]1CCN(CCc2ccc(C(N)=O)cc2)c2ccccc21	ZINC000872154165	DE	On-Demand	Anodyne	PTGER4	41	34
COC(=O)c1sccc1NC(=O)CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872154166	DD	On-Demand	Anodyne	FAS	43	45
NC[C@H]1CCN(CCc2ccc(C(N)=O)cc2)c2ccccc21	ZINC000872154167	DE	On-Demand	Anodyne	PTGER4	41	34
CC(=O)Nc1ccc2c(c1)CN(C[C@H](O)[C@@H](N)Cc1ccccc1)CC2	ZINC000872154180	FD	On-Demand	Anodyne	NOD2	43	37
COC(=O)c1ccc(OC)c2c1CCN(CCCN)C2	ZINC000872154195	CD	On-Demand	Anodyne	DRD2	18	42
CC(=O)Nc1ccc2c(c1)CN(CCOCCN)CC2	ZINC000872154210	CC	On-Demand	Anodyne	NOD2	43	37
NC[C@@H]1CCN(CC(=O)Nc2ccc(N3CCCC3)cc2)c2ccccc21	ZINC000872154228	FG	On-Demand	Anodyne	KCNQ2	47	40
NC[C@H]1CCN(CC(=O)Nc2ccc(N3CCCC3)cc2)c2ccccc21	ZINC000872154229	FG	On-Demand	Anodyne	KCNQ2	47	40
CN(Cc1ccc2c(c1)CNCC2)CC(C)(C)S(C)(=O)=O	ZINC000872154251	DD	On-Demand	Anodyne	PNMT	19	48
O=C(CCN1CCO[C@@H](C(F)(F)F)CC1)N1CCNCC1	ZINC000872154256	DC	On-Demand	Anodyne	ETHR	45	32
O=C(CCN1CCO[C@H](C(F)(F)F)CC1)N1CCNCC1	ZINC000872154257	DC	On-Demand	Anodyne	ETHR	45	32
COC(=O)c1ccc(OC)c2c1CCN(CCCCCCN)C2	ZINC000872154473	DE	On-Demand	Anodyne	DRD2	16	42
COC(=O)c1ccc(OC)c2c1CCN(CCCCCCN)C2	ZINC000872154473	DE	On-Demand	Anodyne	DRD3	22	42
CS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](CN)c3ccccc32)c1	ZINC000872154476	FD	On-Demand	Anodyne	ST14	43	37
CS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](CN)c3ccccc32)c1	ZINC000872154477	FD	On-Demand	Anodyne	ST14	43	37
COc1cccc(OCCN2C[C@@H]3CNC[C@]3(C)C2)c1	ZINC000872154481	CD	On-Demand	Anodyne	CHRNA10	25	42
NC[C@H]1CCN(CC(=O)Nc2cccnc2Cl)c2ccccc21	ZINC000872154559	EF	On-Demand	Anodyne	G2YM83_BOTF4	57	32
NC[C@@H]1CCN(CC(=O)Nc2cccnc2Cl)c2ccccc21	ZINC000872154560	EF	On-Demand	Anodyne	G2YM83_BOTF4	57	32
COC(=O)c1ccc(OC)c2c1CCN(Cc1cccc(N)c1)C2	ZINC000872154566	EF	On-Demand	Anodyne	DRD2	15	41
COC(=O)c1ccc(OC)c2c1CCN(Cc1cccc(N)c1)C2	ZINC000872154566	EF	On-Demand	Anodyne	DRD4	28	41
COC(=O)c1ccc(OC)c2c1CCN(Cc1cccc(N)c1)C2	ZINC000872154566	EF	On-Demand	Anodyne	ABCG2	37	42
COC(=O)c1ccc(OC)c2c1CCN(Cc1cccc(N)c1)C2	ZINC000872154566	EF	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1ccc(OC)c2c1CCN(CCCCCCCN)C2	ZINC000872154569	EF	On-Demand	Anodyne	DRD2	16	42
COC(=O)c1ccc(OC)c2c1CCN(CCCCCCCN)C2	ZINC000872154569	EF	On-Demand	Anodyne	DRD3	22	42
CCOC(=O)N1CCC(NC(=O)CN2CC[C@@H](CN)c3ccccc32)CC1	ZINC000872154572	FD	On-Demand	Anodyne	CCR8	39	43
CCOC(=O)N1CCC(NC(=O)CN2CC[C@H](CN)c3ccccc32)CC1	ZINC000872154574	FD	On-Demand	Anodyne	CCR8	39	43
CC(=O)Nc1ccc2c(c1)CN(CCCCCCCN)CC2	ZINC000872154588	DF	On-Demand	Anodyne	HTR7	16	46
CC(=O)Nc1ccc2c(c1)CN(CCCCCCCN)CC2	ZINC000872154588	DF	On-Demand	Anodyne	MCHR1	26	42
CC(=O)Nc1ccc2c(c1)CN(CCCCCCCN)CC2	ZINC000872154588	DF	On-Demand	Anodyne	NOD2	43	37
CCOC(=O)c1nc(-c2ccccc2)oc1CN1C[C@@H]2CNC[C@]2(C)C1	ZINC000872154635	FF	On-Demand	Anodyne	PDE8B	60	35
CC(=O)Nc1ccc2c(c1)CN(CC[C@@H]1CCNC1)CC2	ZINC000872154697	CE	On-Demand	Anodyne	HTR1F	18	40
CC(=O)Nc1ccc2c(c1)CN(CC[C@H]1CCNC1)CC2	ZINC000872154698	CE	On-Demand	Anodyne	HTR1F	18	40
NC[C@@H]1CCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)c2ccccc21	ZINC000872154703	GE	On-Demand	Anodyne	STAT6	48	34
NC[C@H]1CCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)c2ccccc21	ZINC000872154704	GE	On-Demand	Anodyne	STAT6	48	34
CC(=O)Nc1ccc2c(c1)CN(Cc1cccc(N)c1)CC2	ZINC000872154732	CF	On-Demand	Anodyne	HRH2	19	41
CC(=O)Nc1ccc2c(c1)CN(Cc1cccc(N)c1)CC2	ZINC000872154732	CF	On-Demand	Anodyne	NOD1	26	45
CC(=O)Nc1ccc2c(c1)CN(Cc1cccc(N)c1)CC2	ZINC000872154732	CF	On-Demand	Anodyne	NOD2	53	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2CC[C@@H](CN)c3ccccc32)CC1	ZINC000872154733	FD	On-Demand	Anodyne	GHRHR	48	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2CC[C@@H](CN)c3ccccc32)CC1	ZINC000872154733	FD	On-Demand	Anodyne	P2RY12	173	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N2CC[C@@H](CN)c3ccccc32)CC1	ZINC000872154734	FD	On-Demand	Anodyne	GHRHR	48	33
CCOC(=O)N1CCN(C(=O)[C@H](C)N2CC[C@@H](CN)c3ccccc32)CC1	ZINC000872154734	FD	On-Demand	Anodyne	P2RY12	173	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2CC[C@H](CN)c3ccccc32)CC1	ZINC000872154735	FD	On-Demand	Anodyne	GHRHR	48	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2CC[C@H](CN)c3ccccc32)CC1	ZINC000872154735	FD	On-Demand	Anodyne	P2RY12	173	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N2CC[C@H](CN)c3ccccc32)CC1	ZINC000872154736	FD	On-Demand	Anodyne	GHRHR	48	33
CCOC(=O)N1CCN(C(=O)[C@H](C)N2CC[C@H](CN)c3ccccc32)CC1	ZINC000872154736	FD	On-Demand	Anodyne	P2RY12	173	41
COc1cc2c(cc1OC)[C@@H](C)N(C[C@@H]1CCNC1)CC2	ZINC000872154741	CE	On-Demand	Anodyne	SLC18A2	51	37
CC(=O)Nc1ccc2c(c1)CN(CCCC1CCNCC1)CC2	ZINC000872154742	DF	On-Demand	Anodyne	MCHR1	30	40
COc1ccc([C@@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154751	FF	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc([C@@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154751	FF	On-Demand	Anodyne	MTNR1B	24	41
COc1ccc([C@@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154751	FF	On-Demand	Anodyne	NOD1	16	45
COc1ccc([C@@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154751	FF	On-Demand	Anodyne	NOD2	44	45
COc1ccc([C@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154752	FF	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc([C@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154752	FF	On-Demand	Anodyne	MTNR1B	24	41
COc1ccc([C@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154752	FF	On-Demand	Anodyne	NOD1	16	45
COc1ccc([C@H](CN)CN2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000872154752	FF	On-Demand	Anodyne	NOD2	44	45
COc1cc2c(cc1OC)[C@@H](C)N(C[C@H]1CCNC1)CC2	ZINC000872154755	CE	On-Demand	Anodyne	SLC18A2	51	37
C[C@H](NC(=O)CN(C)CCCCCCN)c1ccc2ccccc2c1	ZINC000872154768	EG	On-Demand	Anodyne	UTS2	40	39
C[C@@H](NC(=O)CN(C)CCCCCCN)c1ccc2ccccc2c1	ZINC000872154770	EG	On-Demand	Anodyne	UTS2	40	39
COc1cc2c(cc1OC)[C@@H](C)N(CC1CCNCC1)CC2	ZINC000872154779	DF	On-Demand	Anodyne	DRD1	15	40
COc1cc2c(cc1OC)[C@@H](C)N(CC1CCNCC1)CC2	ZINC000872154779	DF	On-Demand	Anodyne	SLC18A2	51	38
CN(CCCCCCN)CC(=O)Nc1ccc2c(c1)CCC2	ZINC000872154803	DF	On-Demand	Anodyne	LTA4H	19	42
COc1cc2c(cc1OC)[C@@H](C)N(CCC(=O)N1CCNCC1)CC2	ZINC000872154817	ED	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(CCC(=O)N1CCNCC1)CC2	ZINC000872154817	ED	On-Demand	Anodyne	MTNR1B	15	42
CN(CCCCCCN)CC(=O)Nc1ccc2c(c1)OCCCO2	ZINC000872154819	EE	On-Demand	Anodyne	LTA4H	17	40
CC(=O)Nc1ccc2c(c1)CN(Cc1nc(C(C)(C)N)no1)CC2	ZINC000872154836	ED	On-Demand	Anodyne	NOD2	42	36
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	SSTR2	62	42
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	DRD5	22	43
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	SSTR4	66	42
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	SSTR5	51	42
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	SSTR1	24	42
CN(CCCCCCN)CC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872154850	EF	On-Demand	Anodyne	SSTR3	22	40
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N(C)CCCCCCN	ZINC000872154856	EH	On-Demand	Anodyne	SOAT1	49	43
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N(C)CCCCCCN	ZINC000872154858	EH	On-Demand	Anodyne	SOAT1	49	43
CN(CCCCCCN)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872154860	GD	On-Demand	Bother	SSTR1	72	56
CN(CCCCCCN)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872154860	GD	On-Demand	Bother	SLC27A4	51	34
CN(CCCCCCN)CC(=O)Nc1ccccc1N1CCCC1=O	ZINC000872154881	EE	On-Demand	Anodyne	KCNQ2	63	37
CN(CCCCCCN)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000872154884	DE	On-Demand	Bother	SLC27A4	50	33
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccccc1	ZINC000872154888	DF	On-Demand	Anodyne	SSTR4	17	40
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccccc1	ZINC000872154888	DF	On-Demand	Anodyne	KLK3	60	34
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccccc1	ZINC000872154888	DF	On-Demand	Anodyne	POLG_WNV	45	30
CN(CCCCCCN)CC(=O)N1CCc2ccccc21	ZINC000872154890	CE	On-Demand	Anodyne	HSD17B3	15	40
CN(CCCCCCN)CC(=O)Nc1ccc(F)c(Cl)c1	ZINC000872154891	DF	On-Demand	Anodyne	LTA4H	18	46
CN(CCCCCCN)CC(=O)Nc1ccc(F)c(Cl)c1	ZINC000872154891	DF	On-Demand	Anodyne	SLC1A1	33	44
CN(CCCCCCN)CC(=O)Nc1ccc(F)c(Cl)c1	ZINC000872154891	DF	On-Demand	Anodyne	SLC1A2	40	44
CN(CCCCCCN)CC(=O)Nc1ccc(F)c(Cl)c1	ZINC000872154891	DF	On-Demand	Anodyne	MCHR1	26	41
CN(CCCCCCN)CC(=O)Nc1ccc(C(=O)N(C)C)cc1	ZINC000872154892	ED	On-Demand	Anodyne	LTA4H	25	50
CN(CCCCCCN)CC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872154904	EF	On-Demand	Anodyne	ACHE	21	40
CN(CCCCCCN)CC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872154904	EF	On-Demand	Anodyne	GRIN2B	89	45
CN(CCCCCCN)CC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872154904	EF	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCCCCCN)CC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872154904	EF	On-Demand	Anodyne	CCR3	35	43
CN(CCCCCCN)CC(=O)NCc1ccccc1F	ZINC000872154912	CD	On-Demand	Anodyne	GRIA1	40	35
CN(CCCCCCN)CC(=O)Nc1ccccc1C(C)(C)C	ZINC000872154914	DG	On-Demand	Anodyne	LTA4H	18	41
COc1cc2c(cc1OC)[C@@H](C)N(C[C@H](O)[C@@H](N)Cc1ccccc1)CC2	ZINC000872154934	FF	On-Demand	Anodyne	DRD1	19	43
COc1cc2c(cc1OC)[C@@H](C)N(C[C@H](O)[C@@H](N)Cc1ccccc1)CC2	ZINC000872154934	FF	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C[C@H](O)[C@@H](N)Cc1ccccc1)CC2	ZINC000872154934	FF	On-Demand	Anodyne	HCRTR1	16	46
CN(CCCCCCN)CC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000872154942	ED	On-Demand	Anodyne	LTA4H	19	42
CN(CCCCCCN)CC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000872154967	EG	On-Demand	Anodyne	LTA4H	24	46
CN(CCCCCCN)CC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000872154967	EG	On-Demand	Anodyne	EPHX2	19	44
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)cc1Cl	ZINC000872154968	EG	On-Demand	Anodyne	CA4	19	45
CC(=O)c1cccc(NC(=O)CN(C)CCCCCCN)c1	ZINC000872154973	DE	On-Demand	Anodyne	LTA4H	19	43
CC(=O)c1cccc(NC(=O)CN(C)CCCCCCN)c1	ZINC000872154973	DE	On-Demand	Anodyne	KCNK3	53	35
CN(CCCCCCN)[C@H](C(=O)NC1CC1)c1ccccc1	ZINC000872154974	DE	On-Demand	Anodyne	SSTR4	42	33
CN(CCCCCCN)[C@H](C(=O)NC1CC1)c1ccccc1	ZINC000872154974	DE	On-Demand	Anodyne	AMY2	47	34
CN(CCCCCCN)[C@@H](C(=O)NC1CC1)c1ccccc1	ZINC000872154975	DE	On-Demand	Anodyne	SSTR4	42	33
CN(CCCCCCN)[C@@H](C(=O)NC1CC1)c1ccccc1	ZINC000872154975	DE	On-Demand	Anodyne	AMY2	47	34
CN(CCCCCCN)CCC(=O)Nc1cccc(Cl)c1	ZINC000872154976	DG	On-Demand	Anodyne	ABAT	19	43
CN(CCCCCCN)CCC(=O)Nc1cccc(Cl)c1	ZINC000872154976	DG	On-Demand	Anodyne	HDAC10	24	42
CN(CCCCCCN)CCC(=O)Nc1cccc(Cl)c1	ZINC000872154976	DG	On-Demand	Anodyne	HDAC3	34	40
CN(CCCCCCN)CCC(=O)Nc1cccc(Cl)c1	ZINC000872154976	DG	On-Demand	Anodyne	KCNK3	32	40
CN(CCCCCCN)CCC(=O)Nc1cccc(Cl)c1	ZINC000872154976	DG	On-Demand	Anodyne	KCNK9	22	40
CN(CCCCCCN)Cc1nc(Cc2ccccc2)no1	ZINC000872154978	DF	On-Demand	Anodyne	TPSAB1	41	34
C[C@H](C(=O)Nc1cccnc1Cl)N(C)CCCCCCN	ZINC000872154981	DF	On-Demand	Anodyne	G2YM83_BOTF4	67	35
COc1cc2c(cc1OC)CN(C(=O)CN(C)CCCCCCN)CC2	ZINC000872155011	FE	On-Demand	Anodyne	ABCB1B	40	32
COc1cc2c(cc1OC)CN(C(=O)CN(C)CCCCCCN)CC2	ZINC000872155011	FE	On-Demand	Anodyne	ABCB1	18	50
CN(CCCCCCN)CC(=O)NCc1ccc(F)cc1	ZINC000872155017	CD	On-Demand	Anodyne	LTA4H	18	44
CN(CCCCCCN)CC(=O)NCc1ccc(F)cc1	ZINC000872155017	CD	On-Demand	Anodyne	GRIA1	41	34
CN(CCCCCCN)CC(=O)NCc1ccc(F)cc1	ZINC000872155017	CD	On-Demand	Anodyne	TPSAB1	18	44
CN(CCCCCCN)CC(=O)Nc1ccc(F)cc1F	ZINC000872155022	CE	On-Demand	Anodyne	LTA4H	16	41
CN(CCCCCCN)CC(=O)Nc1ccc(F)cc1F	ZINC000872155022	CE	On-Demand	Anodyne	CA4	17	45
CN(CCCCCCN)CC(=O)Nc1ccc(F)cc1F	ZINC000872155022	CE	On-Demand	Anodyne	SOAT1	38	48
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	CA2	31	47
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	LTA4H	22	51
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	CA1	32	44
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	CA4	40	47
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	CA12	17	44
CN(CCCCCCN)CC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872155023	ED	On-Demand	Anodyne	CA9	18	44
CN(CCCCCCN)CCC(=O)Nc1ccc(Cl)cc1	ZINC000872155025	DG	On-Demand	Anodyne	LTA4H	31	46
CN(CCCCCCN)CCC(=O)Nc1ccc(Cl)cc1	ZINC000872155025	DG	On-Demand	Anodyne	HDAC10	15	41
CN(CCCCCCN)CC(=O)Nc1ccc2c(c1)OCO2	ZINC000872155033	DD	On-Demand	Anodyne	LTA4H	18	41
CN(CCCCCCN)CCC(=O)N1CCN(c2ccccn2)CC1	ZINC000872155041	ED	On-Demand	Anodyne	DRD4	26	42
CN(CCCCCCN)CCC(=O)N1CCN(c2ccccn2)CC1	ZINC000872155041	ED	On-Demand	Anodyne	SSTR1	58	46
C[C@H](C(=O)Nc1nccs1)N(C)CCCCCCN	ZINC000872155047	CD	On-Demand	Anodyne	MAP1	124	41
C[C@H](C(=O)Nc1nccs1)N(C)CCCCCCN	ZINC000872155047	CD	On-Demand	Anodyne	HPN	64	36
C[C@@H](C(=O)Nc1nccs1)N(C)CCCCCCN	ZINC000872155048	CD	On-Demand	Anodyne	MAP1	124	41
C[C@@H](C(=O)Nc1nccs1)N(C)CCCCCCN	ZINC000872155048	CD	On-Demand	Anodyne	HPN	64	36
CN(CCCCCCN)Cc1cccc(C(=O)N2CCCCC2)c1	ZINC000872155068	EG	On-Demand	Anodyne	DPP7	27	42
C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN(C)CCCCCCN	ZINC000872155088	DF	On-Demand	Anodyne	SLC6A9	24	40
CN(CCCCCCN)CC(=O)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000872155097	GD	On-Demand	Anodyne	EPHX2	17	42
Cc1oc(-c2ccccc2)nc1CN(C)CCCCCCN	ZINC000872155099	DH	On-Demand	Anodyne	PPARG	71	45
Cc1oc(-c2ccccc2)nc1CN(C)CCCCCCN	ZINC000872155099	DH	On-Demand	Anodyne	PPARA	78	45
Cc1oc(-c2ccccc2)nc1CN(C)CCCCCCN	ZINC000872155099	DH	On-Demand	Anodyne	PDE8B	57	35
CN(CCCCCCN)CC(=O)N1c2ccccc2NC(=O)C12CCCC2	ZINC000872155101	FF	On-Demand	Anodyne	CHRM2	17	49
CC(=O)Nc1cccc(NC(=O)[C@H](C)N(C)CCCCCCN)c1	ZINC000872155129	EE	On-Demand	Anodyne	KCNK3	43	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)N(C)CCCCCCN)c1	ZINC000872155129	EE	On-Demand	Anodyne	KCNK9	42	31
CC(=O)Nc1cccc(NC(=O)[C@@H](C)N(C)CCCCCCN)c1	ZINC000872155130	EE	On-Demand	Anodyne	KCNK3	43	33
CC(=O)Nc1cccc(NC(=O)[C@@H](C)N(C)CCCCCCN)c1	ZINC000872155130	EE	On-Demand	Anodyne	KCNK9	42	31
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)CCCCCCN	ZINC000872155131	EE	On-Demand	Anodyne	HTR1A	15	40
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)CCCCCCN	ZINC000872155131	EE	On-Demand	Anodyne	P2RY12	55	35
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)CCCCCCN	ZINC000872155131	EE	On-Demand	Anodyne	HTR7	29	42
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)CCCCCCN	ZINC000872155131	EE	On-Demand	Anodyne	MC4R	29	40
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)CCCCCCN	ZINC000872155131	EE	On-Demand	Anodyne	CCR1	19	42
C[C@H](NC(=O)CN(C)CCCCCCN)c1ccc(Cl)cc1	ZINC000872155138	EF	On-Demand	Anodyne	UTS2	46	37
C[C@@H](NC(=O)CN(C)CCCCCCN)c1ccc(Cl)cc1	ZINC000872155139	EF	On-Demand	Anodyne	UTS2	46	37
CN(CCCCCCN)CCC(=O)Nc1ccccc1Br	ZINC000872155140	FG	On-Demand	Anodyne	ABAT	37	41
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000872155141	FD	On-Demand	Anodyne	CA2	15	50
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000872155141	FD	On-Demand	Anodyne	LTA4H	17	42
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000872155141	FD	On-Demand	Anodyne	CA4	24	50
CN(CCCCCCN)CC(=O)Nc1ccc(Br)cc1F	ZINC000872155143	FF	On-Demand	Anodyne	CA4	15	43
CN(CCCCCCN)CC(=O)Nc1ccc2ccccc2c1	ZINC000872155149	DG	On-Demand	Anodyne	LTA4H	31	51
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	LTA4H	37	52
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	PRNP	45	41
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	ROCK2	15	43
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	HDAC1	39	45
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	HDAC2	26	45
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	PLAU	19	41
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	NOD2	44	38
CN(CCCCCCN)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872155152	EH	On-Demand	Anodyne	KCNK3	74	44
COc1ccc(-c2nc(CN(C)CCCCCCN)cs2)cc1	ZINC000872155159	EH	On-Demand	Anodyne	AVPR1B	21	45
COc1ccc(-c2noc(CN(C)CCCCCCN)n2)cc1	ZINC000872155165	DF	On-Demand	Anodyne	LUCI_PHOPE	15	41
CN(CCCCCCN)CC(=O)N1CCc2ccccc2C1	ZINC000872155166	DE	On-Demand	Anodyne	HTR7	16	52
CN(CCCCCCN)CC(=O)N1CCc2ccccc2C1	ZINC000872155166	DE	On-Demand	Anodyne	DPP8	28	50
COC(=O)[C@@H](c1ccc(Cl)cc1)N(C)CCCCCCN	ZINC000872155172	DG	On-Demand	Anodyne	UTS2	46	37
CN(CCCCCCN)Cc1ncccc1C(F)(F)F	ZINC000872155182	CG	On-Demand	Anodyne	CXCR4	40	49
CN(CCCCCCN)CC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000872155185	EG	On-Demand	Anodyne	LTA4H	23	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN(C)CCCCCCN	ZINC000872155188	EG	On-Demand	Anodyne	UTS2	44	35
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN(C)CCCCCCN	ZINC000872155189	EG	On-Demand	Anodyne	UTS2	44	35
Cc1cccc(C(C)C)c1NC(=O)CN(C)CCCCCCN	ZINC000872155196	DH	On-Demand	Anodyne	SOAT1	44	43
CN(CCCCCCN)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872155202	EG	On-Demand	Anodyne	LTA4H	18	41
CN(CCCCCCN)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872155202	EG	On-Demand	Anodyne	KCNK3	18	40
CN(CCCCCCN)CC(=O)NC(=O)NCc1ccccc1	ZINC000872155206	DD	On-Demand	Anodyne	LTA4H	29	41
CN(CCCCCCN)CC(=O)NC(=O)NCc1ccccc1	ZINC000872155206	DD	On-Demand	Anodyne	SSTR4	42	33
CN(CCCCCCN)CC(=O)NC(=O)NCc1ccccc1	ZINC000872155206	DD	On-Demand	Anodyne	POLG_WNV	42	36
CN(CCCCCCN)CC(=O)Nc1cccc(S(C)(=O)=O)c1	ZINC000872155207	ED	On-Demand	Anodyne	CA2	16	51
CN(CCCCCCN)CC(=O)Nc1cccc(S(C)(=O)=O)c1	ZINC000872155207	ED	On-Demand	Anodyne	LTA4H	17	43
CN(CCCCCCN)CC(=O)Nc1cccc(S(C)(=O)=O)c1	ZINC000872155207	ED	On-Demand	Anodyne	CA4	27	51
CN(CCCCCCN)CC(=O)NC(=O)Nc1ccccc1	ZINC000872155212	DD	On-Demand	Anodyne	LTA4H	37	49
CN(CCCCCCN)CC(=O)NC(=O)Nc1ccccc1	ZINC000872155212	DD	On-Demand	Anodyne	CA1	41	34
CN(CCCCCCN)CC(=O)Nc1ccc(F)cc1Cl	ZINC000872155213	DF	On-Demand	Anodyne	CA1	15	42
CN(CCCCCCN)CC(=O)Nc1ccc(F)cc1Cl	ZINC000872155213	DF	On-Demand	Anodyne	CA4	21	42
CC(C)c1ccccc1NC(=O)CN(C)CCCCCCN	ZINC000872155214	DG	On-Demand	Anodyne	LTA4H	17	40
COc1cc2c(cc1OC)[C@@H](C)N(CCC1CCNCC1)CC2	ZINC000872155216	DG	On-Demand	Anodyne	SLC18A2	49	37
C[C@@H](C(=O)N1CCCc2ccccc21)N(C)CCCCCCN	ZINC000872155217	DF	On-Demand	Anodyne	AVPR2	38	40
C[C@H](C(=O)N1CCCc2ccccc21)N(C)CCCCCCN	ZINC000872155218	DF	On-Demand	Anodyne	AVPR2	38	40
CN(CCCCCCN)CCC(=O)Nc1ccccc1F	ZINC000872155219	CF	On-Demand	Anodyne	ABAT	40	33
CN(CCCCCCN)CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872155220	GC	On-Demand	Anodyne	TGM2	48	36
CN(CCCCCCN)CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872155220	GC	On-Demand	Anodyne	F13A1	64	39
CN(CCCCCCN)CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872155220	GC	On-Demand	Anodyne	AKR1C3	42	35
C[C@H](C(=O)Nc1ccccc1Cl)N(C)CCCCCCN	ZINC000872155223	DG	On-Demand	Anodyne	CXCL8	47	40
CN(CCCCCCN)CC(=O)NCc1ccc(Cl)cc1	ZINC000872155225	DE	On-Demand	Anodyne	GRIA1	44	34
CN(CCCCCCN)CC(=O)NCc1ccc(Cl)cc1	ZINC000872155225	DE	On-Demand	Anodyne	UL54	90	38
CN(CCCCCCN)CC(=O)NCc1ccc(Cl)cc1	ZINC000872155225	DE	On-Demand	Anodyne	TPSAB1	15	45
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccc(Cl)cc1	ZINC000872155229	EG	On-Demand	Anodyne	PRCP	17	47
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccc(Cl)cc1	ZINC000872155229	EG	On-Demand	Anodyne	UTS2	48	37
CN(CCCCCCN)CC(=O)NCc1ccc2c(c1)OCO2	ZINC000872155249	DD	On-Demand	Anodyne	BMP1	46	36
CN(CCCCCCN)CC(=O)NCc1ccc2c(c1)OCO2	ZINC000872155249	DD	On-Demand	Anodyne	NOS2	92	37
C[C@@H]1Cc2ccccc2N1C(=O)CN(C)CCCCCCN	ZINC000872155254	DE	On-Demand	Anodyne	DRD4	27	48
C[C@@H]1Cc2ccccc2N1C(=O)CN(C)CCCCCCN	ZINC000872155254	DE	On-Demand	Anodyne	TPP2	74	41
CN(CCCCCCN)CC(=O)Nc1ccc(F)c(F)c1	ZINC000872155255	CE	On-Demand	Anodyne	LTA4H	21	45
Cc1ccc(CNC(=O)CN(C)CCCCCCN)cc1F	ZINC000872155263	DE	On-Demand	Anodyne	GRIA1	46	35
CN(CCCCCCN)CC(=O)Nc1cccc2ccccc12	ZINC000872155264	DG	On-Demand	Anodyne	ABAT	40	34
CN(CCCCCCN)CC(=O)NCc1cccc(Cl)c1	ZINC000872155265	DE	On-Demand	Anodyne	ABAT	24	41
CN(CCCCCCN)CC(=O)NCc1cccc(Cl)c1	ZINC000872155265	DE	On-Demand	Anodyne	GRIA1	44	34
CN(CCCCCCN)CC(=O)NCc1cccc(Cl)c1	ZINC000872155265	DE	On-Demand	Anodyne	UL54	67	37
CN(CCCCCCN)CC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000872155274	EF	On-Demand	Anodyne	CXCR4	52	42
CN(CCCCCCN)CC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000872155275	EF	On-Demand	Anodyne	CXCR4	52	42
CN(CCCCCCN)CCC(=O)Nc1cccc2ccccc12	ZINC000872155284	EH	On-Demand	Anodyne	ABAT	40	32
COc1cc2c(cc1OC)[C@@H](C)N(CCCCCCN)CC2	ZINC000872155294	DG	On-Demand	Anodyne	DRD1	20	41
COc1cc2c(cc1OC)[C@@H](C)N(CCCCCCN)CC2	ZINC000872155294	DG	On-Demand	Anodyne	SLC18A2	54	38
CN(CCCCCCN)CCC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155295	EG	On-Demand	Anodyne	HTR7	16	55
CN(CCCCCCN)CCC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155295	EG	On-Demand	Anodyne	CXCR4	41	37
CN(CCCCCCN)CCC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155295	EG	On-Demand	Anodyne	BDKRB1	38	44
CN(CCCCCCN)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872155303	FD	On-Demand	Anodyne	DRD4	19	42
CN(CCCCCCN)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872155303	FD	On-Demand	Anodyne	P2RY12	43	34
CN(CCCCCCN)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872155303	FD	On-Demand	Anodyne	MCHR1	20	42
CN(CCCCCCN)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872155303	FD	On-Demand	Anodyne	CCR8	59	38
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	DYRK1A	26	43
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	TGFBR1	15	48
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	CLK1	32	43
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	CLK2	34	43
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	CLK4	49	43
CN(CCCCCCN)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872155326	EG	On-Demand	Anodyne	DYRK1B	21	43
CN(CCCCCCN)Cc1ccc2c(c1)CNCC2	ZINC000872155331	CE	On-Demand	Anodyne	PNMT	19	42
CN(CCCCCCN)Cc1cccc(C(=O)N(C)C)c1	ZINC000872155335	CE	On-Demand	Anodyne	ACHE	15	45
CN(CCCCCCN)Cc1cccc(C(=O)N(C)C)c1	ZINC000872155335	CE	On-Demand	Anodyne	HSD17B2	18	41
Cc1cccc(CNC(=O)CN(C)CCCCCCN)c1	ZINC000872155338	CE	On-Demand	Anodyne	GRIA1	41	32
CN(CCCCCCN)CC(=O)Nc1nc2ccccc2s1	ZINC000872155343	DF	On-Demand	Anodyne	CSNK1D	49	53
CN(CCCCCCN)CC(=O)Nc1nc2ccccc2s1	ZINC000872155343	DF	On-Demand	Anodyne	BCL2L1	40	30
CN(CCCCCCN)CC(=O)Nc1nc2ccccc2s1	ZINC000872155343	DF	On-Demand	Anodyne	TMPRSS6	40	34
CN(CCCCCCN)Cc1nc(-c2ccccn2)no1	ZINC000872155345	CE	On-Demand	Anodyne	LUCI_PHOPE	25	40
CN(CCCCCCN)Cc1nc2cc(-c3ccc(F)cc3)sc2c(=O)[nH]1	ZINC000872155348	GH	On-Demand	Anodyne	PIM2	18	41
CN(CCCCCCN)CC(=O)Nc1nc2c(s1)CCC2	ZINC000872155350	DE	On-Demand	Anodyne	SLC27A1	32	42
COc1ccc2c(CN(C)CCCCCCN)cc(=O)oc2c1	ZINC000872155364	DF	On-Demand	Anodyne	CYP11B1	16	40
COc1ccc2c(CN(C)CCCCCCN)cc(=O)oc2c1	ZINC000872155364	DF	On-Demand	Anodyne	MAOA	40	36
COc1ccc2c(CN(C)CCCCCCN)cc(=O)oc2c1	ZINC000872155364	DF	On-Demand	Anodyne	MAOB	39	45
CN(CCCCCCN)CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872155365	ED	On-Demand	Anodyne	DRD4	43	46
CN(CCCCCCN)CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872155365	ED	On-Demand	Anodyne	ACHE	36	43
CN(CCCCCCN)CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872155365	ED	On-Demand	Anodyne	SIGMAR1	63	46
CN(CCCCCCN)CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872155365	ED	On-Demand	Anodyne	FAAH	22	43
CC(=O)c1ccc(N2CCN(C(=O)CN(C)CCCCCCN)CC2)c(F)c1	ZINC000872155373	GE	On-Demand	Anodyne	NPY2R	47	35
CC(=O)c1ccc(N2CCN(C(=O)CN(C)CCCCCCN)CC2)c(F)c1	ZINC000872155373	GE	On-Demand	Anodyne	SLC6A9	23	46
CC(=O)c1ccc(N2CCN(C(=O)CN(C)CCCCCCN)CC2)c(F)c1	ZINC000872155373	GE	On-Demand	Anodyne	SSTR1	17	43
CN(CCCCCCN)CCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155396	EG	On-Demand	Anodyne	HTR7	16	55
CN(CCCCCCN)CCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155396	EG	On-Demand	Anodyne	CXCR4	41	37
CN(CCCCCCN)CCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155396	EG	On-Demand	Anodyne	BDKRB1	38	44
COc1cc2c(cc1OC)[C@@H](C)N(CCN1CCNCC1)CC2	ZINC000872155401	DD	On-Demand	Anodyne	DRD1	15	40
COc1cc2c(cc1OC)[C@@H](C)N(CCN1CCNCC1)CC2	ZINC000872155401	DD	On-Demand	Anodyne	SLC18A2	51	38
Cc1ccc(CNC(=O)CN(C)CCCCCCN)cc1	ZINC000872155404	CE	On-Demand	Anodyne	GRIA1	44	34
Cc1ccc(CNC(=O)CN(C)CCCCCCN)cc1	ZINC000872155404	CE	On-Demand	Anodyne	TPSAB1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C[C@@H]1CNCCO1)CC2	ZINC000872155412	DD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C[C@H]1CNCCO1)CC2	ZINC000872155413	DD	On-Demand	Anodyne	SLC18A2	48	35
CC(=O)c1ccccc1NC(=O)CN(C)CCCCCCN	ZINC000872155415	DE	On-Demand	Anodyne	LTA4H	18	41
Cc1c(NC(=O)[C@H](C)N(C)CCCCCCN)c(=O)n(-c2ccccc2)n1C	ZINC000872155418	GE	On-Demand	Anodyne	FPR2	51	48
Cc1c(NC(=O)[C@@H](C)N(C)CCCCCCN)c(=O)n(-c2ccccc2)n1C	ZINC000872155419	GE	On-Demand	Anodyne	FPR2	51	48
CN(CCCCCCN)CCC(=O)Nc1ccc(F)cc1	ZINC000872155424	CF	On-Demand	Anodyne	LTA4H	31	46
CN(CCCCCCN)CCC(=O)Nc1ccc(F)cc1	ZINC000872155424	CF	On-Demand	Anodyne	HDAC10	17	40
CN(CCCCCCN)CCC(=O)Nc1ccc(F)cc1	ZINC000872155424	CF	On-Demand	Anodyne	HDAC3	19	53
COc1cc2c(cc1OC)[C@@H](C)N(CC[C@@H]1CCNC1)CC2	ZINC000872155437	DF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(CC[C@H]1CCNC1)CC2	ZINC000872155439	DF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(Cc1noc(CN)n1)CC2	ZINC000872155442	DD	On-Demand	Anodyne	SLC18A2	47	34
C[C@@H](C(=O)N1CCN(c2ccccc2O)CC1)N(C)CCCCCCN	ZINC000872155449	FD	On-Demand	Anodyne	MC4R	74	41
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000872155471	GE	On-Demand	Anodyne	CA2	17	43
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000872155471	GE	On-Demand	Anodyne	CA1	19	43
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000872155471	GE	On-Demand	Anodyne	CA4	28	43
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	LPL	42	34
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	CA4	16	45
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	TGM2	44	36
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	ST14	43	38
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	F13A1	65	44
CN(CCCCCCN)CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872155472	GD	On-Demand	Anodyne	AKR1C3	42	40
CC(C)c1ccc(NC(=O)CN(C)CCCCCCN)cc1	ZINC000872155476	DG	On-Demand	Anodyne	LTA4H	31	46
CC(=O)c1cccc(NC(=O)[C@H](C)N(C)CCCCCCN)c1	ZINC000872155480	DF	On-Demand	Anodyne	KCNK3	46	35
CC(=O)c1cccc(NC(=O)[C@@H](C)N(C)CCCCCCN)c1	ZINC000872155481	DF	On-Demand	Anodyne	KCNK3	46	35
Cc1ccccc1CNC(=O)[C@H](C)N(C)CCCCCCN	ZINC000872155486	DE	On-Demand	Anodyne	GRIA1	50	35
Cc1ccccc1CNC(=O)[C@H](C)N(C)CCCCCCN	ZINC000872155486	DE	On-Demand	Anodyne	AMP1_PLAFQ	24	44
Cc1ccccc1CNC(=O)[C@H](C)N(C)CCCCCCN	ZINC000872155486	DE	On-Demand	Anodyne	POLG_WNV	46	30
Cc1ccccc1CNC(=O)[C@@H](C)N(C)CCCCCCN	ZINC000872155487	DE	On-Demand	Anodyne	GRIA1	50	35
Cc1ccccc1CNC(=O)[C@@H](C)N(C)CCCCCCN	ZINC000872155487	DE	On-Demand	Anodyne	AMP1_PLAFQ	24	44
Cc1ccccc1CNC(=O)[C@@H](C)N(C)CCCCCCN	ZINC000872155487	DE	On-Demand	Anodyne	POLG_WNV	46	30
COc1ccc(N2CCN(C(=O)CN(C)CCCCCCN)CC2)cc1	ZINC000872155497	FD	On-Demand	Clean	HTR1D	15	40
COc1ccc(N2CCN(C(=O)CN(C)CCCCCCN)CC2)cc1	ZINC000872155497	FD	On-Demand	Clean	SSTR1	45	40
COC(=O)[C@@H](c1cccc(Cl)c1)N(C)CCCCCCN	ZINC000872155516	DG	On-Demand	Anodyne	UTS2	40	30
CN(CCCCCCN)CC(=O)Nc1nc2c(s1)CCCC2	ZINC000872155524	DE	On-Demand	Anodyne	SLC27A1	38	41
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)cn1	ZINC000872155544	CE	On-Demand	Anodyne	KLKB1	19	43
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)cn1	ZINC000872155544	CE	On-Demand	Anodyne	F10	44	44
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	ACHE	16	42
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	LTA4H	27	44
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	CPT1A	43	30
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	PRNP	26	40
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	PLAU	16	42
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	KCNK3	114	44
CN(CCCCCCN)Cc1cccc(C(=O)Nc2ccccc2)c1	ZINC000872155560	EH	On-Demand	Anodyne	KCNK9	62	43
CN(CCCCCCN)CC(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872155567	EF	On-Demand	Anodyne	LTA4H	25	44
CN(CCCCCCN)CC(=O)NNC(=O)c1ccccc1Cl	ZINC000872155575	ED	On-Demand	Reactive	ECR	42	37
CN(CCCCCCN)Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1	ZINC000872155576	GG	On-Demand	Anodyne	PTGS2	45	35
CN(CCCCCCN)CCC(=O)NC(=O)Nc1ccccc1	ZINC000872155587	DE	On-Demand	Anodyne	LTA4H	41	46
CN(CCCCCCN)Cc1ccc(-n2ccnc2)cc1	ZINC000872155593	CF	On-Demand	Anodyne	CYP2C19	18	43
CN(CCCCCCN)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872155609	FE	On-Demand	Anodyne	EPHX2	23	42
CN(CCCCCCN)CCC(=O)Nc1ccccc1Cl	ZINC000872155619	DG	On-Demand	Anodyne	ABAT	40	32
Cc1cc(C)cc(NC(=O)CN(C)CCCCCCN)c1	ZINC000872155620	CF	On-Demand	Anodyne	LTA4H	17	41
CN(CCCCCCN)CC(=O)Nc1ccccc1-c1ccccc1	ZINC000872155622	EH	On-Demand	Anodyne	LTA4H	22	41
CSc1ccc(NC(=O)CN(C)CCCCCCN)cc1	ZINC000872155629	DF	On-Demand	Anodyne	LTA4H	22	46
CN(CCCCCCN)CC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155630	DF	On-Demand	Anodyne	HTR7	15	50
CN(CCCCCCN)CC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155630	DF	On-Demand	Anodyne	CXCR4	41	37
CN(CCCCCCN)CC(=O)N[C@@H]1CCCc2ccccc21	ZINC000872155630	DF	On-Demand	Anodyne	BDKRB1	48	44
CN(CCCCCCN)CC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155631	DF	On-Demand	Anodyne	HTR7	15	50
CN(CCCCCCN)CC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155631	DF	On-Demand	Anodyne	CXCR4	41	37
CN(CCCCCCN)CC(=O)N[C@H]1CCCc2ccccc21	ZINC000872155631	DF	On-Demand	Anodyne	BDKRB1	48	44
COc1cc2c(cc1OC)[C@@H](C)N(Cc1cccc(N)c1)CC2	ZINC000872155632	DG	On-Demand	Anodyne	DRD1	19	41
COc1cc2c(cc1OC)[C@@H](C)N(Cc1cccc(N)c1)CC2	ZINC000872155632	DG	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(Cc1cccc(N)c1)CC2	ZINC000872155632	DG	On-Demand	Anodyne	HCRTR1	22	45
COc1cc2c(cc1OC)[C@@H](C)N(Cc1cccc(N)c1)CC2	ZINC000872155632	DG	On-Demand	Anodyne	HCRTR2	16	41
Cc1cccc(NC(=O)[C@H](C)N(C)CCCCCCN)c1	ZINC000872155654	CF	On-Demand	Anodyne	KCNK3	63	39
Cc1cccc(NC(=O)[C@H](C)N(C)CCCCCCN)c1	ZINC000872155654	CF	On-Demand	Anodyne	KCNK9	48	39
Cc1cccc(NC(=O)[C@@H](C)N(C)CCCCCCN)c1	ZINC000872155655	CF	On-Demand	Anodyne	KCNK3	63	39
Cc1cccc(NC(=O)[C@@H](C)N(C)CCCCCCN)c1	ZINC000872155655	CF	On-Demand	Anodyne	KCNK9	48	39
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	CA2	19	44
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	LTA4H	31	40
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	BMP1	45	36
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	CA1	52	37
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	MTNR1A	21	44
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	MTNR1B	21	44
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	MMP3	19	41
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	NPY5R	29	44
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	CA12	27	44
COc1ccc(NC(=O)[C@H](C)N(C)CCCCCCN)cc1	ZINC000872155659	DE	On-Demand	Anodyne	CA9	28	44
COc1cc2c(cc1OC)[C@@H](C)N(CC[C@@H]1CCCNC1)CC2	ZINC000872155662	DG	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(CC[C@H]1CCCNC1)CC2	ZINC000872155664	DG	On-Demand	Anodyne	SLC18A2	48	35
CN(CCCCCCN)CCCn1c(O)nc2ccccc21	ZINC000872155669	DF	On-Demand	Anodyne	CXCR4	16	43
COc1cc2c(cc1OC)[C@@H](C)N(CCOCCN)CC2	ZINC000872155670	CD	On-Demand	Anodyne	DRD1	16	40
COc1cc2c(cc1OC)[C@@H](C)N(CCOCCN)CC2	ZINC000872155670	CD	On-Demand	Anodyne	SLC18A2	52	38
CN(CCCCCCN)CC(=O)Nc1cc(F)ccc1F	ZINC000872155672	CE	On-Demand	Anodyne	LTA4H	16	41
CN(CCCCCCN)CC(=O)Nc1cc(F)ccc1F	ZINC000872155672	CE	On-Demand	Anodyne	SOAT1	18	41
CC(C)c1cccc(NC(=O)CN(C)CCCCCCN)c1	ZINC000872155673	DG	On-Demand	Anodyne	LTA4H	19	41
C[C@H](C(=O)Nc1cccc(Cl)c1Cl)N(C)CCCCCCN	ZINC000872155677	EH	On-Demand	Anodyne	CXCL8	40	39
C[C@@H](C(=O)N(C)Cc1ccccc1)N(C)CCCCCCN	ZINC000872155689	DE	On-Demand	Anodyne	TACR1	18	44
C[C@@H](C(=O)N(C)Cc1ccccc1)N(C)CCCCCCN	ZINC000872155689	DE	On-Demand	Anodyne	KLK3	41	32
C[C@H](C(=O)N(C)Cc1ccccc1)N(C)CCCCCCN	ZINC000872155690	DE	On-Demand	Anodyne	TACR1	18	44
C[C@H](C(=O)N(C)Cc1ccccc1)N(C)CCCCCCN	ZINC000872155690	DE	On-Demand	Anodyne	KLK3	41	32
C[C@H]1CCc2ccccc2N1C(=O)CN(C)CCCCCCN	ZINC000872155695	DF	On-Demand	Anodyne	ACE	18	40
C[C@H]1CCc2ccccc2N1C(=O)CN(C)CCCCCCN	ZINC000872155695	DF	On-Demand	Anodyne	TPP2	52	38
CN(CCCCCCN)CC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000872155698	FD	On-Demand	Anodyne	CCR1	15	46
CN(CCCCCCN)CC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000872155698	FD	On-Demand	Anodyne	SSTR1	49	51
CN(CCCCCCN)Cc1ccc(-n2cccn2)cc1	ZINC000872155715	CF	On-Demand	Anodyne	AMP1_PLAFQ	50	37
COc1ccccc1N1CC[C@H](N(C)CCCCCCN)C1=O	ZINC000872155726	DE	On-Demand	Anodyne	HTR1A	54	40
COc1ccccc1N1CC[C@H](N(C)CCCCCCN)C1=O	ZINC000872155726	DE	On-Demand	Anodyne	DRD2	30	40
COc1ccccc1N1CC[C@@H](N(C)CCCCCCN)C1=O	ZINC000872155727	DE	On-Demand	Anodyne	HTR1A	54	40
COc1ccccc1N1CC[C@@H](N(C)CCCCCCN)C1=O	ZINC000872155727	DE	On-Demand	Anodyne	DRD2	30	40
CN(CCCCCCN)CCC(=O)Nc1cccnc1	ZINC000872155731	CD	On-Demand	Anodyne	LTA4H	21	43
CN(CCCCCCN)CCC(=O)Nc1cccnc1	ZINC000872155731	CD	On-Demand	Anodyne	HDAC3	15	57
CN(CCCCCCN)CCC(=O)Nc1cccnc1	ZINC000872155731	CD	On-Demand	Anodyne	NAMPT	18	40
C[C@H](NC(=O)CN(C)CCCCCCN)C(=O)N1CCCCC1	ZINC000872155732	EC	On-Demand	Anodyne	DPP7	31	41
C[C@@H](NC(=O)CN(C)CCCCCCN)C(=O)N1CCCCC1	ZINC000872155733	EC	On-Demand	Anodyne	DPP7	31	41
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000872155737	FD	On-Demand	Anodyne	CA2	15	43
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000872155737	FD	On-Demand	Anodyne	CA1	18	43
CN(CCCCCCN)CC(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000872155737	FD	On-Demand	Anodyne	CA4	25	43
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)nc1	ZINC000872155738	CE	On-Demand	Anodyne	LTA4H	18	44
CN(CCCCCCN)CC(=O)NCc1cccnc1	ZINC000872155742	CD	On-Demand	Anodyne	NAMPT	62	40
C[C@H]1CN(c2ccc(NC(=O)CN(C)CCCCCCN)cc2)C[C@@H](C)O1	ZINC000872155746	GF	On-Demand	Anodyne	LTA4H	21	40
C[C@H]1CN(c2ccc(NC(=O)CN(C)CCCCCCN)cc2)C[C@H](C)O1	ZINC000872155748	GF	On-Demand	Anodyne	LTA4H	21	40
CN(CCCCCCN)Cc1nc(O)c2c3c(sc2n1)CCC3	ZINC000872155756	EF	On-Demand	Anodyne	CEL	19	41
CN(CCCCCCN)CC(=O)NNC(=O)c1cccc(Cl)c1	ZINC000872155757	ED	On-Demand	Reactive	ABAT	26	46
C[C@@H](C(=O)N(C)c1ccccc1)N(C)CCCCCCN	ZINC000872155760	CE	On-Demand	Anodyne	AMY2	55	35
C[C@H](C(=O)N(C)c1ccccc1)N(C)CCCCCCN	ZINC000872155761	CE	On-Demand	Anodyne	AMY2	55	35
CN(CCCCCCN)CCC(=O)Nc1cccc(F)c1	ZINC000872155779	CF	On-Demand	Anodyne	HDAC10	23	42
CN(CCCCCCN)CCC(=O)Nc1cccc(F)c1	ZINC000872155779	CF	On-Demand	Anodyne	HDAC6	24	40
CN(CCCCCCN)CCC(=O)Nc1cccc(F)c1	ZINC000872155779	CF	On-Demand	Anodyne	KCNK3	30	40
CN(CCCCCCN)CCC(=O)Nc1cccc(F)c1	ZINC000872155779	CF	On-Demand	Anodyne	KCNK9	22	40
CN(CCCCCCN)CC(=O)NNC(=O)c1ccccc1	ZINC000872155797	DC	On-Demand	Reactive	LTA4H	23	40
CN(CCCCCCN)CCC(=O)Nc1ccc2c(c1)OCO2	ZINC000872155800	DE	On-Demand	Anodyne	DYRK2	64	36
C[C@H](NC(=O)[C@@H](C)N(C)CCCCCCN)c1ccc2c(c1)OCCO2	ZINC000872155808	FE	On-Demand	Anodyne	KCNQ2	22	40
CN(CCCCCCN)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000872155825	EC	On-Demand	Anodyne	SSTR1	43	44
CN(CCCCCCN)CC(=O)N1CCN(c2ccccc2F)CC1	ZINC000872155826	FD	On-Demand	Anodyne	HTR1A	16	42
CN(CCCCCCN)CC(=O)N1CCN(c2ccccc2F)CC1	ZINC000872155826	FD	On-Demand	Anodyne	NPY2R	40	34
CN(CCCCCCN)CC(=O)N1CCN(c2ccccc2F)CC1	ZINC000872155826	FD	On-Demand	Anodyne	SSTR1	38	45
CN(CCCCCCN)CC(=O)Nc1cccc(C(=O)N2CCSCC2)c1	ZINC000872155850	GE	On-Demand	Anodyne	EPHX2	15	44
NC(=O)[C@H](c1ccccc1)N1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872155922	EF	On-Demand	Anodyne	DPEP1	43	38
NC(=O)[C@H](c1ccccc1)N1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872155923	EF	On-Demand	Anodyne	DPEP1	43	38
NC(=O)[C@H](c1ccccc1)N1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872155924	EF	On-Demand	Anodyne	DPEP1	43	38
NC(=O)[C@H](c1ccccc1)N1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872155925	EF	On-Demand	Anodyne	DPEP1	43	38
CO[C@@H](CN(C)CCCCCCN)c1ccc(F)cc1	ZINC000872155955	CF	On-Demand	Anodyne	AOC3	22	63
CO[C@@H](CN(C)CCCCCCN)c1ccc(F)cc1	ZINC000872155955	CF	On-Demand	Anodyne	LEF	24	41
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)c(F)c1	ZINC000872156079	DF	On-Demand	Anodyne	LTA4H	18	44
CN(CCCCCCN)CC(=O)Nc1ccc(Cl)c(F)c1	ZINC000872156079	DF	On-Demand	Anodyne	ENV	43	38
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156118	EE	On-Demand	Anodyne	C3AR1	40	41
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156118	EE	On-Demand	Anodyne	NAMPT	54	40
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156119	EE	On-Demand	Anodyne	C3AR1	40	41
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156119	EE	On-Demand	Anodyne	NAMPT	54	40
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156120	EE	On-Demand	Anodyne	C3AR1	40	41
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156120	EE	On-Demand	Anodyne	NAMPT	54	40
N[C@H](C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156121	EE	On-Demand	Anodyne	C3AR1	40	41
N[C@H](C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1)C1CCCC1	ZINC000872156121	EE	On-Demand	Anodyne	NAMPT	54	40
NC(=O)c1ccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156163	EF	On-Demand	Anodyne	CHEK2	25	43
NC(=O)c1ccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156163	EF	On-Demand	Anodyne	CCR3	50	35
NC(=O)c1ccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156163	EF	On-Demand	Anodyne	PROC	41	34
NC(=O)c1ccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156164	EF	On-Demand	Anodyne	CHEK2	25	43
NC(=O)c1ccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156164	EF	On-Demand	Anodyne	CCR3	50	35
NC(=O)c1ccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156164	EF	On-Demand	Anodyne	PROC	41	34
NC(=O)c1ccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156165	EF	On-Demand	Anodyne	CHEK2	25	43
NC(=O)c1ccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156165	EF	On-Demand	Anodyne	CCR3	50	35
NC(=O)c1ccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156165	EF	On-Demand	Anodyne	PROC	41	34
NC(=O)c1ccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156166	EF	On-Demand	Anodyne	CHEK2	25	43
NC(=O)c1ccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156166	EF	On-Demand	Anodyne	CCR3	50	35
NC(=O)c1ccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156166	EF	On-Demand	Anodyne	PROC	41	34
NC(=O)[C@H](c1ccc(F)cc1)N1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872156210	EF	On-Demand	Anodyne	CCR3	41	33
NC(=O)[C@H](c1ccc(F)cc1)N1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872156211	EF	On-Demand	Anodyne	CCR3	41	33
NC(=O)[C@H](c1ccc(F)cc1)N1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872156212	EF	On-Demand	Anodyne	CCR3	41	33
NC(=O)[C@H](c1ccc(F)cc1)N1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872156213	EF	On-Demand	Anodyne	CCR3	41	33
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156326	EF	On-Demand	Anodyne	CCR3	59	34
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156326	EF	On-Demand	Anodyne	PROC	40	33
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156326	EF	On-Demand	Anodyne	BIRC2	41	41
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156327	EF	On-Demand	Anodyne	CCR3	59	34
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156327	EF	On-Demand	Anodyne	PROC	40	33
NC(=O)c1ccc(CCN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156327	EF	On-Demand	Anodyne	BIRC2	41	41
NC(=O)c1ccc(CCN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156328	EF	On-Demand	Anodyne	CCR3	59	34
NC(=O)c1ccc(CCN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156328	EF	On-Demand	Anodyne	PROC	40	33
NC(=O)c1ccc(CCN2CCC[C@H](C[C@H](N)C3CCCC3)C2)cc1	ZINC000872156328	EF	On-Demand	Anodyne	BIRC2	41	41
NC(=O)c1ccc(CCN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156329	EF	On-Demand	Anodyne	CCR3	59	34
NC(=O)c1ccc(CCN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156329	EF	On-Demand	Anodyne	PROC	40	33
NC(=O)c1ccc(CCN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)cc1	ZINC000872156329	EF	On-Demand	Anodyne	BIRC2	41	41
CN(CCCCCCN)CC(=O)Nc1ccccn1	ZINC000872156366	CD	On-Demand	Anodyne	LTA4H	22	40
N[C@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156367	GI	On-Demand	Anodyne	PIM1	19	54
N[C@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156367	GI	On-Demand	Anodyne	PIM2	15	54
N[C@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156367	GI	On-Demand	Anodyne	CDC7	22	54
N[C@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156367	GI	On-Demand	Anodyne	PIM3	21	54
N[C@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156368	GI	On-Demand	Anodyne	PIM1	19	54
N[C@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156368	GI	On-Demand	Anodyne	PIM2	15	54
N[C@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156368	GI	On-Demand	Anodyne	CDC7	22	54
N[C@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156368	GI	On-Demand	Anodyne	PIM3	21	54
N[C@@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156369	GI	On-Demand	Anodyne	PIM1	19	54
N[C@@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156369	GI	On-Demand	Anodyne	PIM2	15	54
N[C@@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156369	GI	On-Demand	Anodyne	CDC7	22	54
N[C@@H](C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156369	GI	On-Demand	Anodyne	PIM3	21	54
N[C@@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156370	GI	On-Demand	Anodyne	PIM1	19	54
N[C@@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156370	GI	On-Demand	Anodyne	PIM2	15	54
N[C@@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156370	GI	On-Demand	Anodyne	CDC7	22	54
N[C@@H](C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1)C1CCCC1	ZINC000872156370	GI	On-Demand	Anodyne	PIM3	21	54
N[C@@H](C[C@@H]1CCCN(Cc2cscn2)C1)C1CCCC1	ZINC000872156392	CG	On-Demand	Anodyne	SCN5A	40	32
N[C@@H](C[C@H]1CCCN(Cc2cscn2)C1)C1CCCC1	ZINC000872156393	CG	On-Demand	Anodyne	SCN5A	40	32
N[C@H](C[C@H]1CCCN(Cc2cscn2)C1)C1CCCC1	ZINC000872156394	CG	On-Demand	Anodyne	SCN5A	40	32
N[C@H](C[C@@H]1CCCN(Cc2cscn2)C1)C1CCCC1	ZINC000872156395	CG	On-Demand	Anodyne	SCN5A	40	32
C[C@H](C(=O)N1CCCCC1)N1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872156491	EG	On-Demand	Anodyne	DPP7	57	44
C[C@H](C(=O)N1CCCCC1)N1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872156492	EG	On-Demand	Anodyne	DPP7	57	44
C[C@H](C(=O)N1CCCCC1)N1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872156493	EG	On-Demand	Anodyne	DPP7	57	44
C[C@H](C(=O)N1CCCCC1)N1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872156494	EG	On-Demand	Anodyne	DPP7	57	44
Cc1ccc(CN2CCO[C@H](c3cccc(F)c3)C2)cc1C(=O)O	ZINC000872156507	EG	On-Demand	Anodyne	DRD4	26	41
Cc1ccc(CN2CCO[C@H](c3cccc(F)c3)C2)cc1C(=O)O	ZINC000872156507	EG	On-Demand	Anodyne	FABP4	28	42
Cc1ccc(CN2CCO[C@H](c3cccc(F)c3)C2)cc1C(=O)O	ZINC000872156507	EG	On-Demand	Anodyne	CCR5	81	33
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	HTR1A	20	40
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	DRD2	52	46
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	DRD3	23	43
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	TACR1	17	41
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	FABP4	26	43
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	SIGMAR1	18	43
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	CCR3	26	41
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	MBTPS1	61	46
COc1ccccc1C[C@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156514	EH	On-Demand	Anodyne	ACKR3	76	40
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	HTR1A	20	40
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	DRD2	52	46
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	DRD3	23	43
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	TACR1	17	41
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	FABP4	26	43
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	SIGMAR1	18	43
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	CCR3	26	41
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	MBTPS1	61	46
COc1ccccc1C[C@@H]1CCCN1Cc1ccc(C)c(C(=O)O)c1	ZINC000872156515	EH	On-Demand	Anodyne	ACKR3	76	40
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	DRD4	32	49
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	SLC6A1	79	38
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	SSTR5	47	43
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	CCR3	58	51
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	UTS2R	22	42
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	CCR2	18	43
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	MCHR1	34	52
CC(=O)N[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156518	CD	On-Demand	Anodyne	BIRC2	36	42
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	DRD4	32	49
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	SLC6A1	79	38
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	SSTR5	47	43
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	CCR3	58	51
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	UTS2R	22	42
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	CCR2	18	43
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	MCHR1	34	52
CC(=O)N[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872156519	CD	On-Demand	Anodyne	BIRC2	36	42
CCc1csc([C@H]2CCCN(Cc3ccc(C)c(C(=O)O)c3)C2)n1	ZINC000872156538	EI	On-Demand	Anodyne	SLC6A1	57	34
CCc1csc([C@@H]2CCCN(Cc3ccc(C)c(C(=O)O)c3)C2)n1	ZINC000872156539	EI	On-Demand	Anodyne	SLC6A1	57	34
COc1cccc([C@@H](C(=O)O)N2CCC(c3cn[nH]c3)CC2)c1	ZINC000872156544	DE	On-Demand	Anodyne	ROCK1	39	40
COc1cccc([C@@H](C(=O)O)N2CCC(c3cn[nH]c3)CC2)c1	ZINC000872156544	DE	On-Demand	Anodyne	ROCK2	56	40
COc1cccc([C@H](C(=O)O)N2CCC(c3cn[nH]c3)CC2)c1	ZINC000872156545	DE	On-Demand	Anodyne	ROCK1	39	40
COc1cccc([C@H](C(=O)O)N2CCC(c3cn[nH]c3)CC2)c1	ZINC000872156545	DE	On-Demand	Anodyne	ROCK2	56	40
O=C(O)c1csc(CN2CC[C@@H](c3cccnc3)C2)c1	ZINC000872156546	CF	On-Demand	Anodyne	MGEA5	26	41
O=C(O)c1csc(CN2CC[C@H](c3cccnc3)C2)c1	ZINC000872156547	CF	On-Demand	Anodyne	MGEA5	26	41
Cc1ccc(CN2CCO[C@H](c3ccccc3Cl)C2)cc1C(=O)O	ZINC000872156553	EH	On-Demand	Anodyne	DRD4	49	45
Cc1ccc(CN2CCO[C@H](c3ccccc3Cl)C2)cc1C(=O)O	ZINC000872156553	EH	On-Demand	Anodyne	SLC6A1	53	37
Cc1ccc(CN2CCO[C@H](c3ccccc3Cl)C2)cc1C(=O)O	ZINC000872156553	EH	On-Demand	Anodyne	CCR3	19	40
Cc1ccc(CN2CCO[C@H](c3ccccc3Cl)C2)cc1C(=O)O	ZINC000872156553	EH	On-Demand	Anodyne	PYGM	40	40
COc1ccc(CC[C@@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156558	GJ	On-Demand	Anodyne	DRD2	50	41
COc1ccc(CC[C@@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156558	GJ	On-Demand	Anodyne	FKBP1A	51	42
COc1ccc(CC[C@@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156558	GJ	On-Demand	Anodyne	ACKR3	66	37
COc1ccc(CC[C@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156559	GJ	On-Demand	Anodyne	DRD2	50	41
COc1ccc(CC[C@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156559	GJ	On-Demand	Anodyne	FKBP1A	51	42
COc1ccc(CC[C@H]2CCCCN2Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872156559	GJ	On-Demand	Anodyne	ACKR3	66	37
O=C(O)c1csc(CN2CCC(OCCc3ccccc3)CC2)c1	ZINC000872156562	EH	On-Demand	Anodyne	ACHE	43	42
O=C(O)c1csc(CN2CCC(OCCc3ccccc3)CC2)c1	ZINC000872156562	EH	On-Demand	Anodyne	SIGMAR1	64	53
O=C(O)c1csc(CN2CCC(OCCc3ccccc3)CC2)c1	ZINC000872156562	EH	On-Demand	Anodyne	CYP2J2	45	33
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	HTR1A	18	48
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	HTR1D	37	45
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	HTR1B	33	45
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	SLC6A4	15	53
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	HRH1	17	43
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	HTR1F	67	39
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	SIGMAR1	19	44
O=C(O)c1csc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1	ZINC000872156594	EI	On-Demand	Anodyne	CCR2	34	49
N[C@H](C[C@H]1CCCN(CC(=O)NCc2cccs2)C1)C1CCCC1	ZINC000872156606	EF	On-Demand	Anodyne	CTSC	22	42
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2cccs2)C1)C1CCCC1	ZINC000872156607	EF	On-Demand	Anodyne	CTSC	22	42
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2cccs2)C1)C1CCCC1	ZINC000872156608	EF	On-Demand	Anodyne	CTSC	22	42
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2cccs2)C1)C1CCCC1	ZINC000872156609	EF	On-Demand	Anodyne	CTSC	22	42
O=C(O)c1csc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000872156616	EF	On-Demand	Bother	HTR1A	28	49
O=C(O)c1csc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000872156616	EF	On-Demand	Bother	DRD2	23	49
O=C(O)c1csc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000872156616	EF	On-Demand	Bother	DRD4	20	49
O=C(O)c1csc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000872156616	EF	On-Demand	Bother	DRD3	19	42
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	DRD4	42	32
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	OPRD1	15	43
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	KCNQ2	27	45
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	NPY2R	32	42
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	MTNR1A	29	40
CCS(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156638	EC	On-Demand	Anodyne	MTNR1B	35	40
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	DRD4	42	32
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	OPRD1	15	43
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	KCNQ2	27	45
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	NPY2R	32	42
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	MTNR1A	29	40
CCS(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156640	EC	On-Demand	Anodyne	MTNR1B	35	40
Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(C(=O)O)cs3)CC2)cc1C	ZINC000872156644	GF	On-Demand	Anodyne	AKR1C3	54	38
C=CCN(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872156664	BE	On-Demand	Mild	SHC	26	51
C=CCN(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872156664	BE	On-Demand	Mild	LSS	48	51
O=C(O)c1csc(CN2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872156700	EG	On-Demand	Anodyne	SLC6A3	16	40
O=C(O)c1csc(CN2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872156700	EG	On-Demand	Anodyne	SIGMAR1	26	40
O=C(O)c1csc(CN2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872156700	EG	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1csc(CN2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872156703	EG	On-Demand	Anodyne	SLC6A3	16	40
O=C(O)c1csc(CN2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872156703	EG	On-Demand	Anodyne	SIGMAR1	26	40
O=C(O)c1csc(CN2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872156703	EG	On-Demand	Anodyne	CYP2J2	44	31
COc1ccc(CN(C)Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872156705	DG	On-Demand	Anodyne	PRKCZ	22	42
COc1ccc(CN(C)Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872156705	DG	On-Demand	Anodyne	MT-ND1	20	46
CC(=O)c1ccc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c(F)c1	ZINC000872156747	FG	On-Demand	Anodyne	HTR1A	17	42
CC(=O)c1ccc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c(F)c1	ZINC000872156747	FG	On-Demand	Anodyne	DRD2	19	42
CC(=O)c1ccc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c(F)c1	ZINC000872156747	FG	On-Demand	Anodyne	DRD4	35	41
CC(=O)c1ccc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c(F)c1	ZINC000872156747	FG	On-Demand	Anodyne	NPY2R	72	42
CC(=O)c1ccc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c(F)c1	ZINC000872156747	FG	On-Demand	Anodyne	SLC6A9	17	43
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	ALOX5	15	49
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	BMP1	20	40
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	MTNR1A	50	41
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	MTNR1B	52	41
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	MMP3	16	41
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	HSD17B2	23	41
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	AOC3	25	47
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	FFAR1	27	40
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156757	CF	On-Demand	Anodyne	PDS	43	32
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	ALOX5	15	49
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	BMP1	20	40
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	MTNR1A	50	41
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	MTNR1B	52	41
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	MMP3	16	41
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	HSD17B2	23	41
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	AOC3	25	47
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	FFAR1	27	40
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2)c1	ZINC000872156759	CF	On-Demand	Anodyne	PDS	43	32
CCN(Cc1ccc(C)c(C(=O)O)c1)[C@@H](C)Cc1ccc(OC)cc1	ZINC000872156761	EI	On-Demand	Anodyne	BMP1	44	36
CCN(Cc1ccc(C)c(C(=O)O)c1)[C@H](C)Cc1ccc(OC)cc1	ZINC000872156767	EI	On-Demand	Anodyne	BMP1	44	36
O=C(O)c1csc(CN2CCN(c3ncccn3)CC2)c1	ZINC000872156784	DD	On-Demand	Anodyne	DRD4	23	44
O=C(O)c1csc(CN2CCC(c3nc4ccccc4s3)CC2)c1	ZINC000872156787	FI	On-Demand	Anodyne	DRD4	20	53
O=C(O)c1csc(CN2CCC(c3nc4ccccc4s3)CC2)c1	ZINC000872156787	FI	On-Demand	Anodyne	ACHE	18	41
O=C(O)c1csc(CN2CCC(c3nc4ccccc4s3)CC2)c1	ZINC000872156787	FI	On-Demand	Anodyne	LTA4H	31	43
O=C(O)c1csc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000872156799	EF	On-Demand	Bother	HTR1A	23	57
O=C(O)c1csc(CN2CCC(C(=O)c3ccccc3)CC2)c1	ZINC000872156805	EH	On-Demand	Anodyne	ACHE	29	44
O=C(O)c1csc(CN2CCC(C(=O)c3ccccc3)CC2)c1	ZINC000872156805	EH	On-Demand	Anodyne	SIGMAR1	39	45
O=C(O)c1csc(CN2CCC(C(=O)c3ccccc3)CC2)c1	ZINC000872156805	EH	On-Demand	Anodyne	SLC18A3	42	43
O=C(O)c1csc(CN2CCC(C(=O)c3ccccc3)CC2)c1	ZINC000872156805	EH	On-Demand	Anodyne	CYP2J2	45	32
COc1cccc([C@H]2CN(Cc3cc(C(=O)O)cs3)CCO2)c1	ZINC000872156807	EG	On-Demand	Anodyne	DRD4	41	31
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	DRD5	18	41
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	MTNR1B	23	42
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	ABCB1	23	45
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	AKR1C3	43	48
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	NOD1	17	47
COc1ccc2c(c1)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872156813	DG	On-Demand	Anodyne	NOD2	47	47
O=C(O)c1csc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1	ZINC000872156818	EH	On-Demand	Bother	COLA	124	42
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	DRD2	30	56
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	DRD4	79	51
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	ACHE	36	46
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	SLC6A1	81	40
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	HRH1	28	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	DRD3	22	42
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	SIGMAR1	57	47
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	PRCP	15	40
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	CCR3	43	42
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	CCR5	82	44
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	SLC18A3	66	47
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	MCHR1	48	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	MCHR2	43	31
Cc1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872156820	CH	On-Demand	Anodyne	MGEA5	25	40
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	DRD2	45	52
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	DRD4	68	43
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	ACHE	40	48
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	HRH1	38	46
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	DRD3	37	51
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	KCNH2	19	40
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	HTR4	30	40
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	CHRM3	18	41
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	SIGMAR1	42	45
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	SSTR5	73	40
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	CCR3	54	47
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	MCHR1	41	45
COc1cccc(OC)c1OC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156827	GH	On-Demand	Anodyne	CCR8	34	46
Cc1ccc(CN2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1C(=O)O	ZINC000872156829	FI	On-Demand	Anodyne	DRD4	27	41
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	DRD2	15	48
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	DRD4	49	48
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	ACHE	20	47
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	HRH1	19	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	KCNA5	18	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	SIGMAR1	37	46
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	CCR3	42	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	SLC18A3	25	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	MCHR1	40	47
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872156836	EH	On-Demand	Anodyne	CARM1	45	32
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	PRCP	24	42
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	CPT1A	47	41
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	S1PR4	18	40
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	GRM5	20	45
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	S1PR1	20	50
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	SMO	39	40
O=C(O)c1csc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1	ZINC000872156843	FH	On-Demand	Anodyne	ETHR	82	56
O=C(O)c1csc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1	ZINC000872156846	GE	On-Demand	Anodyne	SIGMAR1	17	46
O=C(O)c1csc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1	ZINC000872156846	GE	On-Demand	Anodyne	CCR8	40	32
O=C(O)c1csc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1	ZINC000872156846	GE	On-Demand	Anodyne	SFRP1	119	38
O=C(O)c1csc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1	ZINC000872156846	GE	On-Demand	Anodyne	WNT3	75	34
O=C(O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)c1	ZINC000872156848	FI	On-Demand	Anodyne	ACHE	28	41
O=C(O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)c1	ZINC000872156848	FI	On-Demand	Anodyne	SIGMAR1	34	46
O=C(O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)c1	ZINC000872156848	FI	On-Demand	Anodyne	CCR3	52	40
O=C(O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)c1	ZINC000872156848	FI	On-Demand	Anodyne	CACNA1I	42	35
Cc1noc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)n1	ZINC000872156854	DF	On-Demand	Anodyne	ETHR	67	40
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156857	GI	On-Demand	Anodyne	CPT1A	38	40
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156857	GI	On-Demand	Anodyne	GRM5	23	55
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156857	GI	On-Demand	Anodyne	S1PR1	16	46
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156857	GI	On-Demand	Anodyne	ETHR	69	54
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156858	GI	On-Demand	Anodyne	CPT1A	38	40
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156858	GI	On-Demand	Anodyne	GRM5	23	55
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156858	GI	On-Demand	Anodyne	S1PR1	16	46
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000872156858	GI	On-Demand	Anodyne	ETHR	69	54
Cc1ccc(CN2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1C(=O)O	ZINC000872156866	GJ	On-Demand	Anodyne	DRD4	26	45
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872156870	EG	On-Demand	Anodyne	DRD4	21	40
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872156870	EG	On-Demand	Anodyne	CCR3	44	40
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872156870	EG	On-Demand	Anodyne	MLNR	52	34
CCCO[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156877	DG	On-Demand	Anodyne	SLC6A1	61	35
CCCO[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156877	DG	On-Demand	Anodyne	SIGMAR1	24	41
CCCO[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156877	DG	On-Demand	Anodyne	SSTR5	57	42
CCCO[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156878	DG	On-Demand	Anodyne	SLC6A1	61	35
CCCO[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156878	DG	On-Demand	Anodyne	SIGMAR1	24	41
CCCO[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872156878	DG	On-Demand	Anodyne	SSTR5	57	42
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	DRD4	28	43
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	SIGMAR1	34	40
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	PRCP	25	43
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	CCR1	34	41
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	CCR2	16	40
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	MCHR1	27	44
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	CACNA1I	41	33
O=C(O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)c1	ZINC000872156883	EI	On-Demand	Anodyne	MGEA5	26	42
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	DRD2	22	44
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	DRD4	70	46
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	ACHE	31	47
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	SLC6A1	61	39
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	HRH1	29	43
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	DRD3	16	42
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	SIGMAR1	46	39
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	CCR3	39	43
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	MCHR1	29	42
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	MCHR2	43	34
Cc1ccc(CN2CC[C@@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872156886	DH	On-Demand	Anodyne	MBTPS1	28	43
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	ACHE	45	43
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	HTR4	47	37
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	GRIN2B	24	42
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	SIGMAR1	58	53
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	CHEK2	23	44
O=C(O)c1csc(CN2CCC(COc3ccccc3)CC2)c1	ZINC000872156887	EH	On-Demand	Anodyne	CPT1A	64	39
CCN(CC)S(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156961	GD	On-Demand	Anodyne	OPRD1	15	44
CCN(CC)S(=O)(=O)N1CCN([C@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156961	GD	On-Demand	Anodyne	NPY2R	37	43
CCN(CC)S(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156967	GD	On-Demand	Anodyne	OPRD1	15	44
CCN(CC)S(=O)(=O)N1CCN([C@@H](C(=O)O)c2cccc(OC)c2)CC1	ZINC000872156967	GD	On-Demand	Anodyne	NPY2R	37	43
COc1ccccc1-c1nc(CN2CCC[C@@H]2C(=O)O)co1	ZINC000872156980	DE	On-Demand	Anodyne	DRD3	15	47
COc1ccccc1-c1nc(CN2CCC[C@H]2C(=O)O)co1	ZINC000872156984	DE	On-Demand	Anodyne	DRD3	15	47
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	FDPS	21	42
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	BMP1	55	36
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	SLC6A9	17	41
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	PLA2G4B	53	37
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	IKBKE	15	40
COc1ccc(OCCN(C)Cc2cc(C(=O)O)cs2)cc1	ZINC000872156992	DF	On-Demand	Anodyne	TBK1	15	40
COc1cccc([C@@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872156999	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872156999	GF	On-Demand	Anodyne	KCNQ2	32	42
COc1cccc([C@@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872156999	GF	On-Demand	Anodyne	NPY2R	116	56
COc1cccc([C@@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872156999	GF	On-Demand	Anodyne	PRNP	16	41
COc1cccc([C@@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872156999	GF	On-Demand	Anodyne	TAAR1	35	40
COc1cccc([C@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872157000	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872157000	GF	On-Demand	Anodyne	KCNQ2	32	42
COc1cccc([C@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872157000	GF	On-Demand	Anodyne	NPY2R	116	56
COc1cccc([C@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872157000	GF	On-Demand	Anodyne	PRNP	16	41
COc1cccc([C@H](C(=O)O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000872157000	GF	On-Demand	Anodyne	TAAR1	35	40
COc1ccccc1[C@@H]1CSCCCN1C[C@H]1CCNC1	ZINC000872157003	DF	On-Demand	Anodyne	MBTPS1	49	35
COc1ccccc1[C@@H]1CSCCCN1C[C@@H]1CCNC1	ZINC000872157004	DF	On-Demand	Anodyne	MBTPS1	49	35
O=C(O)CCC1CCN(Cc2cc(C(F)(F)F)co2)CC1	ZINC000872157029	DG	On-Demand	Anodyne	ACHE	27	42
COc1ccc([C@H](CN)CN2CC[C@H]3[C@H]2CCCN3C)cc1	ZINC000872157031	DD	On-Demand	Anodyne	CHRNA10	40	36
COc1ccc([C@H](CN)CN2CC[C@@H]3[C@H]2CCCN3C)cc1	ZINC000872157032	DD	On-Demand	Anodyne	CHRNA10	40	36
COc1ccc([C@H](CN)CN2CC[C@H]3[C@@H]2CCCN3C)cc1	ZINC000872157034	DD	On-Demand	Anodyne	CHRNA10	40	36
COc1ccc([C@H](CN)CN2CC[C@@H]3[C@@H]2CCCN3C)cc1	ZINC000872157036	DD	On-Demand	Anodyne	CHRNA10	40	36
COc1ccnc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)n1	ZINC000872157050	ED	On-Demand	Anodyne	ALS	50	31
CCN(Cc1ccc(C)c(C(=O)O)c1)Cc1nc(O)c2ccccc2n1	ZINC000872157057	FG	On-Demand	Anodyne	TSPO	26	44
COc1cccc([C@@H](C(=O)O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872157059	FG	On-Demand	Anodyne	OPRD1	16	44
COc1cccc([C@@H](C(=O)O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872157059	FG	On-Demand	Anodyne	KCNQ2	24	44
COc1cccc([C@H](C(=O)O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872157060	FG	On-Demand	Anodyne	OPRD1	16	44
COc1cccc([C@H](C(=O)O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000872157060	FG	On-Demand	Anodyne	KCNQ2	24	44
COc1cccc([C@@H](C(=O)O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872157061	FG	On-Demand	Anodyne	OPRD1	16	44
COc1cccc([C@@H](C(=O)O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872157061	FG	On-Demand	Anodyne	KCNQ2	24	44
COc1cccc([C@H](C(=O)O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872157062	FG	On-Demand	Anodyne	OPRD1	16	44
COc1cccc([C@H](C(=O)O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000872157062	FG	On-Demand	Anodyne	KCNQ2	24	44
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	ACHE	19	44
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	PPARG	44	40
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	PPARA	45	40
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	LTA4H	39	47
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	BMP1	56	35
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	SLC6A9	15	41
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	PLA2G4B	53	33
COc1ccc(OCCN(C)Cc2ccc(C)c(C(=O)O)c2)cc1	ZINC000872157064	EG	On-Demand	Anodyne	AKR1C2	40	37
CN(CCOc1ccc(Br)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157066	FH	On-Demand	Anodyne	SHC	64	43
CN(CCOc1ccc(Br)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157066	FH	On-Demand	Anodyne	PLA2G4B	47	35
CN(CCOc1ccc(Br)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157066	FH	On-Demand	Anodyne	LSS	69	43
O=C(O)c1csc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000872157094	FH	On-Demand	Anodyne	DRD4	18	41
O=C(O)c1csc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000872157094	FH	On-Demand	Anodyne	AKT2	60	44
O=C(O)c1csc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000872157094	FH	On-Demand	Anodyne	AKT1	35	44
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	HTR1A	19	50
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	DRD4	22	42
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	ACHE	15	41
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	HTR1D	48	47
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	HTR1B	40	47
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	HRH1	18	44
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	HTR1F	84	42
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	SIGMAR1	20	53
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	SSTR5	42	36
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	MTNR1A	23	52
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	MTNR1B	20	52
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	CCR2	21	50
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	MCHR1	27	43
COc1ccc2[nH]cc(C3CCN(Cc4ccc(C)c(C(=O)O)c4)CC3)c2c1	ZINC000872157110	GJ	On-Demand	Anodyne	CCR8	18	40
Cc1noc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)n1	ZINC000872157140	DF	On-Demand	Anodyne	DRD4	30	41
Cc1noc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)n1	ZINC000872157140	DF	On-Demand	Anodyne	SSTR5	45	36
Cc1noc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)n1	ZINC000872157140	DF	On-Demand	Anodyne	ETHR	53	35
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	DRD2	23	47
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	DRD4	41	44
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	ACHE	31	46
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	DRD3	23	50
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	HTR4	15	40
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	ADRA2C	17	44
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	HCRTR1	21	41
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	SIGMAR1	19	47
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	ABCB1B	67	43
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	ABCB1	31	52
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	HCRTR2	20	42
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	MCHR1	15	41
COc1cc2c(cc1OC)CCN(Cc1ccc(C)c(C(=O)O)c1)CC2	ZINC000872157145	FG	On-Demand	Anodyne	ABCG2	38	43
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	DRD2	16	50
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	ACHE	35	49
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	HTR2A	18	49
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	HRH1	20	40
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	SLC6A3	19	40
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	GRIN2B	68	44
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	SIGMAR1	48	50
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	CCR3	127	51
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	CCR5	18	40
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	GRIN2C	22	43
O=C(O)c1csc(CN2CCC(Cc3ccc(F)cc3)CC2)c1	ZINC000872157146	EI	On-Demand	Anodyne	MCHR1	25	40
COc1ccc([C@@H]2CCN(Cc3cc(C(=O)O)cs3)C2)cc1	ZINC000872157154	DG	On-Demand	Anodyne	DRD4	22	42
COc1ccc([C@@H]2CCN(Cc3cc(C(=O)O)cs3)C2)cc1	ZINC000872157154	DG	On-Demand	Anodyne	EDNRB	41	35
COc1ccc([C@@H]2CCN(Cc3cc(C(=O)O)cs3)C2)cc1	ZINC000872157154	DG	On-Demand	Anodyne	SIGMAR1	23	41
COc1ccc([C@@H]2CCN(Cc3cc(C(=O)O)cs3)C2)cc1	ZINC000872157154	DG	On-Demand	Anodyne	SLC18A3	21	40
N[C@H](C[C@@H]1CCCN(CCCc2ccncc2)C1)C1CCCC1	ZINC000872157170	DH	On-Demand	Anodyne	BIRC2	19	40
N[C@@H](C[C@@H]1CCCN(CCCc2ccncc2)C1)C1CCCC1	ZINC000872157172	DH	On-Demand	Anodyne	BIRC2	19	40
N[C@@H](C[C@H]1CCCN(CCCc2ccncc2)C1)C1CCCC1	ZINC000872157173	DH	On-Demand	Anodyne	BIRC2	19	40
N[C@H](C[C@H]1CCCN(CCCc2ccncc2)C1)C1CCCC1	ZINC000872157174	DH	On-Demand	Anodyne	BIRC2	19	40
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	DRD2	18	46
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	DRD4	43	32
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	ACHE	20	43
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	SIGMAR1	35	45
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	CCR5	24	48
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	MCHR1	42	46
COc1cccc(C2CCN(Cc3cc(C(=O)O)cs3)CC2)c1	ZINC000872157185	EH	On-Demand	Anodyne	MGEA5	29	45
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872157187	FD	On-Demand	Anodyne	ACHE	22	42
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872157187	FD	On-Demand	Anodyne	SIGMAR1	27	40
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872157187	FD	On-Demand	Anodyne	SSTR5	46	38
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	ACHE	28	40
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	SLC6A1	91	36
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	GRIN2B	46	40
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	SIGMAR1	44	37
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	CCR3	92	40
O=C(O)c1csc(CN2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000872157195	DH	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	ACHE	28	40
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	SLC6A1	91	36
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	GRIN2B	46	40
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	SIGMAR1	44	37
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	CCR3	92	40
O=C(O)c1csc(CN2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000872157199	DH	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1csc(CN2CCC[C@H]2Cc2ccc(F)cc2)c1	ZINC000872157200	DH	On-Demand	Anodyne	CCR3	49	42
O=C(O)c1csc(CN2CCC[C@@H]2Cc2ccc(F)cc2)c1	ZINC000872157201	DH	On-Demand	Anodyne	CCR3	49	42
CCCCNC(=O)CCN1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872157212	DF	On-Demand	Anodyne	NOD1	54	40
CCCCNC(=O)CCN1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872157213	DF	On-Demand	Anodyne	NOD1	54	40
CCCCNC(=O)CCN1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872157215	DF	On-Demand	Anodyne	NOD1	54	40
CCCCNC(=O)CCN1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872157217	DF	On-Demand	Anodyne	NOD1	54	40
COc1ccccc1-c1nc(CN2CCCC[C@H]2C(=O)O)co1	ZINC000872157300	DF	On-Demand	Anodyne	FKBP1A	47	39
COc1ccccc1-c1nc(CN2CCCC[C@@H]2C(=O)O)co1	ZINC000872157302	DF	On-Demand	Anodyne	FKBP1A	47	39
CCN(Cc1cc(C(=O)O)cs1)[C@H](C)Cc1ccc(OC)cc1	ZINC000872157354	EH	On-Demand	Anodyne	BMP1	79	40
CCN(Cc1cc(C(=O)O)cs1)[C@@H](C)Cc1ccc(OC)cc1	ZINC000872157355	EH	On-Demand	Anodyne	BMP1	79	40
CCS(=O)(=O)N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872157364	ED	On-Demand	Anodyne	SIGMAR1	19	51
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	DRD2	22	45
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	DRD4	43	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	ACHE	60	51
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	HRH1	24	48
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	GRIN2B	84	51
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	SIGMAR1	89	49
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	CCR3	67	50
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	CCR5	22	43
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	GRIN2C	25	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3)CC2)c1	ZINC000872157373	DH	On-Demand	Anodyne	CYP2J2	49	34
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	DRD2	21	46
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	DRD4	41	46
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	ACHE	62	53
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	HRH1	18	40
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	SLC6A3	16	41
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	SLC18A2	41	35
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	GRIN2B	43	42
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	SIGMAR1	84	44
O=C(O)c1csc(CN2CCC(CCc3ccccc3)CC2)c1	ZINC000872157378	EI	On-Demand	Anodyne	CYP2J2	47	35
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	DRD4	21	44
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	SLC6A1	54	35
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	SIGMAR1	40	47
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	PRCP	17	41
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	CCR5	27	41
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	SLC18A3	55	42
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1csc(CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157398	DI	On-Demand	Anodyne	MGEA5	37	48
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	DRD4	21	44
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	SLC6A1	54	35
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	SIGMAR1	40	47
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	PRCP	17	41
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	CCR5	27	41
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	SLC18A3	55	42
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1csc(CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157399	DI	On-Demand	Anodyne	MGEA5	37	48
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	HTR1A	22	41
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	DRD2	25	43
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	ACHE	26	42
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	DRD3	19	40
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	SIGMAR1	25	40
COc1cccc(OC)c1OC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157400	GH	On-Demand	Anodyne	SSTR5	29	40
O=C(O)c1csc(CN2CCCC[C@H]2Cc2ccccc2)c1	ZINC000872157412	DI	On-Demand	Anodyne	SIGMAR1	25	47
O=C(O)c1csc(CN2CCCC[C@@H]2Cc2ccccc2)c1	ZINC000872157414	DI	On-Demand	Anodyne	SIGMAR1	25	47
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	DRD2	15	43
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	DRD4	23	43
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	ACHE	47	50
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	HTR2A	15	41
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	HRH1	15	40
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	GRIN2B	61	43
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	SIGMAR1	52	48
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	CCR3	71	43
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	MCHR1	15	43
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	CACNA1G	28	41
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3)CC2)c1	ZINC000872157415	EI	On-Demand	Anodyne	CYP2J2	43	31
CCCN(Cc1cc(C(=O)O)cs1)[C@H]1CCc2ccccc2C1	ZINC000872157419	EI	On-Demand	Anodyne	HTR1A	30	58
CCCN(Cc1cc(C(=O)O)cs1)[C@H]1CCc2ccccc2C1	ZINC000872157419	EI	On-Demand	Anodyne	DRD2	37	51
CCCN(Cc1cc(C(=O)O)cs1)[C@H]1CCc2ccccc2C1	ZINC000872157419	EI	On-Demand	Anodyne	HTR1D	17	47
CCCN(Cc1cc(C(=O)O)cs1)[C@H]1CCc2ccccc2C1	ZINC000872157419	EI	On-Demand	Anodyne	DRD3	61	49
CCCN(Cc1cc(C(=O)O)cs1)[C@@H]1CCc2ccccc2C1	ZINC000872157420	EI	On-Demand	Anodyne	HTR1A	30	58
CCCN(Cc1cc(C(=O)O)cs1)[C@@H]1CCc2ccccc2C1	ZINC000872157420	EI	On-Demand	Anodyne	DRD2	37	51
CCCN(Cc1cc(C(=O)O)cs1)[C@@H]1CCc2ccccc2C1	ZINC000872157420	EI	On-Demand	Anodyne	HTR1D	17	47
CCCN(Cc1cc(C(=O)O)cs1)[C@@H]1CCc2ccccc2C1	ZINC000872157420	EI	On-Demand	Anodyne	DRD3	61	49
O=C(O)c1csc(CN2CCC(c3cn[nH]c3)CC2)c1	ZINC000872157428	CF	On-Demand	Anodyne	MGEA5	26	40
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	DRD4	19	45
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	ACHE	30	40
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	HRH1	33	47
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	KCNH2	41	39
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	CHRM3	20	44
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	LTA4H	22	42
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	PRSS2	41	32
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	CCR3	38	47
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	EPHX2	17	40
O=C(O)c1csc(CN2CCC(Oc3ccccc3)CC2)c1	ZINC000872157435	DG	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)c1csc(CN2CCN(c3ncnc4ccsc34)CC2)c1	ZINC000872157456	FF	On-Demand	Anodyne	SIRT3	89	40
O=C(O)c1csc(CN2CCN(c3ncnc4ccsc34)CC2)c1	ZINC000872157456	FF	On-Demand	Anodyne	SIRT2	74	40
O=C(O)c1csc(CN2CCN(c3ncnc4ccsc34)CC2)c1	ZINC000872157456	FF	On-Demand	Anodyne	SIRT1	65	40
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2nccs2)C1)C1CCCC1	ZINC000872157464	EF	On-Demand	Anodyne	MAP1	73	48
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2nccs2)C1)C1CCCC1	ZINC000872157465	EF	On-Demand	Anodyne	MAP1	73	48
N[C@H](C[C@H]1CCCN(CC(=O)Nc2nccs2)C1)C1CCCC1	ZINC000872157466	EF	On-Demand	Anodyne	MAP1	73	48
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2nccs2)C1)C1CCCC1	ZINC000872157468	EF	On-Demand	Anodyne	MAP1	73	48
Cc1ccc(CN2CCO[C@H](c3ccccc3F)C2)cc1C(=O)O	ZINC000872157469	EG	On-Demand	Anodyne	DRD4	34	40
Cc1ccc(CN2CCO[C@H](c3ccccc3F)C2)cc1C(=O)O	ZINC000872157469	EG	On-Demand	Anodyne	SLC6A1	43	36
O=C(O)c1csc(CN2CCCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872157472	GE	On-Demand	Anodyne	PKM	27	40
O=C(O)c1csc(CN2CCCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872157472	GE	On-Demand	Anodyne	AKR1C3	61	43
NC(=O)c1cccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157489	EF	On-Demand	Anodyne	SLC6A1	43	34
NC(=O)c1cccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157489	EF	On-Demand	Anodyne	SIGMAR1	15	43
NC(=O)c1cccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157489	EF	On-Demand	Anodyne	CHEK2	25	42
NC(=O)c1cccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157491	EF	On-Demand	Anodyne	SLC6A1	43	34
NC(=O)c1cccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157491	EF	On-Demand	Anodyne	SIGMAR1	15	43
NC(=O)c1cccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157491	EF	On-Demand	Anodyne	CHEK2	25	42
O=C(O)c1csc(CN2CCC(c3cccc4ccccc34)CC2)c1	ZINC000872157492	FJ	On-Demand	Anodyne	DRD4	24	40
O=C(O)c1csc(CN2CCC(c3cccc4ccccc34)CC2)c1	ZINC000872157492	FJ	On-Demand	Anodyne	HRH1	24	48
O=C(O)c1csc(CN2CCC(c3cccc4ccccc34)CC2)c1	ZINC000872157492	FJ	On-Demand	Anodyne	SIGMAR1	28	40
NC(=O)c1cccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157493	EF	On-Demand	Anodyne	SLC6A1	43	34
NC(=O)c1cccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157493	EF	On-Demand	Anodyne	SIGMAR1	15	43
NC(=O)c1cccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157493	EF	On-Demand	Anodyne	CHEK2	25	42
NC(=O)c1cccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157494	EF	On-Demand	Anodyne	SLC6A1	43	34
NC(=O)c1cccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157494	EF	On-Demand	Anodyne	SIGMAR1	15	43
NC(=O)c1cccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157494	EF	On-Demand	Anodyne	CHEK2	25	42
O=C(O)c1csc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157502	GF	On-Demand	Anodyne	CCR3	17	41
O=C(O)c1csc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157502	GF	On-Demand	Anodyne	SFRP1	127	38
O=C(O)c1csc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157502	GF	On-Demand	Anodyne	WNT3	85	38
N[C@@H](C[C@@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157504	GE	On-Demand	Anodyne	LTA4H	42	44
N[C@@H](C[C@@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157504	GE	On-Demand	Anodyne	PSMB1	40	36
O=C(O)c1csc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157505	GF	On-Demand	Anodyne	CCR3	17	41
O=C(O)c1csc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157505	GF	On-Demand	Anodyne	SFRP1	127	38
O=C(O)c1csc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000872157505	GF	On-Demand	Anodyne	WNT3	85	38
N[C@H](C[C@@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157506	GE	On-Demand	Anodyne	LTA4H	42	44
N[C@H](C[C@@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157506	GE	On-Demand	Anodyne	PSMB1	40	36
N[C@H](C[C@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157508	GE	On-Demand	Anodyne	LTA4H	42	44
N[C@H](C[C@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157508	GE	On-Demand	Anodyne	PSMB1	40	36
N[C@@H](C[C@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157510	GE	On-Demand	Anodyne	LTA4H	42	44
N[C@@H](C[C@H]1CCCN(CCOc2ccc(S(N)(=O)=O)cc2)C1)C1CCCC1	ZINC000872157510	GE	On-Demand	Anodyne	PSMB1	40	36
O=C(O)c1csc(CN2CCC(c3ccc(F)c(F)c3)CC2)c1	ZINC000872157569	EI	On-Demand	Anodyne	ADRA1D	15	40
O=C(O)c1csc(CN2CCC(c3ccc(F)c(F)c3)CC2)c1	ZINC000872157569	EI	On-Demand	Anodyne	ADRA1A	27	40
O=C(O)c1csc(CN2CCC(c3ccc(F)c(F)c3)CC2)c1	ZINC000872157569	EI	On-Demand	Anodyne	ADRA1B	18	40
O=C(O)c1csc(CN2CCC(c3ccc(F)c(F)c3)CC2)c1	ZINC000872157569	EI	On-Demand	Anodyne	SIGMAR1	17	40
O=C(O)c1csc(CN2CCC(c3ccc(F)c(F)c3)CC2)c1	ZINC000872157569	EI	On-Demand	Anodyne	MCHR1	22	40
O=C(O)c1csc(CN(C2CCCCC2)C2CC2)c1	ZINC000872157572	CH	On-Demand	Anodyne	ACE	45	32
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	HTR1A	38	49
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	DRD2	38	49
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	DRD4	26	40
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	ADRA1D	29	42
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	ADRA1A	23	42
CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157575	GD	On-Demand	Anodyne	ADRA1B	16	42
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	HTR1A	18	50
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	HTR1D	39	43
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	HTR1B	36	43
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	HTR1F	80	42
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	MTNR1A	21	52
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	MTNR1B	17	52
COc1ccc2[nH]cc(C3CCN(Cc4cc(C(=O)O)cs4)CC3)c2c1	ZINC000872157581	FI	On-Demand	Anodyne	CCR2	20	48
O=C(O)c1csc(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1	ZINC000872157586	FI	On-Demand	Anodyne	DRD4	19	47
O=C(O)c1csc(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1	ZINC000872157586	FI	On-Demand	Anodyne	SIGMAR1	27	43
O=C(O)c1csc(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1	ZINC000872157586	FI	On-Demand	Anodyne	SLC18A3	28	40
Cc1ccc(CN2CC[C@@H](c3cccnc3)C2)cc1C(=O)O	ZINC000872157590	CG	On-Demand	Anodyne	DRD4	42	40
Cc1ccc(CN2CC[C@@H](c3cccnc3)C2)cc1C(=O)O	ZINC000872157590	CG	On-Demand	Anodyne	ACHE	16	41
Cc1ccc(CN2CC[C@@H](c3cccnc3)C2)cc1C(=O)O	ZINC000872157590	CG	On-Demand	Anodyne	SSTR5	43	38
Cc1ccc(CN2CC[C@@H](c3cccnc3)C2)cc1C(=O)O	ZINC000872157590	CG	On-Demand	Anodyne	CCR5	83	35
Cc1ccc(CN2CCO[C@H](c3ccccc3)C2)cc1C(=O)O	ZINC000872157604	DG	On-Demand	Anodyne	DRD4	40	43
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157611	EF	On-Demand	Anodyne	F2	39	41
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157611	EF	On-Demand	Anodyne	PROC	48	39
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157611	EF	On-Demand	Anodyne	BIRC2	40	39
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157611	EF	On-Demand	Anodyne	TMPRSS11D	59	39
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157612	EF	On-Demand	Anodyne	F2	39	41
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157612	EF	On-Demand	Anodyne	PROC	48	39
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157612	EF	On-Demand	Anodyne	BIRC2	40	39
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157612	EF	On-Demand	Anodyne	TMPRSS11D	59	39
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157613	EF	On-Demand	Anodyne	F2	39	41
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157613	EF	On-Demand	Anodyne	PROC	48	39
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157613	EF	On-Demand	Anodyne	BIRC2	40	39
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157613	EF	On-Demand	Anodyne	TMPRSS11D	59	39
N[C@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157614	EF	On-Demand	Anodyne	F2	39	41
N[C@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157614	EF	On-Demand	Anodyne	PROC	48	39
N[C@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157614	EF	On-Demand	Anodyne	BIRC2	40	39
N[C@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1	ZINC000872157614	EF	On-Demand	Anodyne	TMPRSS11D	59	39
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR1A	151	63
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ADRA2A	18	49
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	DRD2	121	63
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	DRD1	26	58
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	DRD4	94	56
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ACHE	15	43
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ADRA1D	110	57
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR1D	16	45
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR1B	27	44
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR2A	40	58
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR2C	16	45
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ADRA1A	102	55
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ADRA1B	81	57
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	DRD3	117	58
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	HTR7	85	55
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	SIGMAR1	24	45
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	UTS2R	15	40
COc1ccccc1N1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157620	EF	On-Demand	Anodyne	ABCB1	43	35
COc1ccccc1[C@@H]1CSCCCN1CC[C@@H]1CCNC1	ZINC000872157631	DG	On-Demand	Anodyne	MBTPS1	44	35
COc1ccccc1[C@@H]1CSCCCN1CC[C@H]1CCNC1	ZINC000872157632	DG	On-Demand	Anodyne	MBTPS1	44	35
CN(CCOc1ccc(Cl)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157638	EH	On-Demand	Anodyne	FDPS	20	49
CN(CCOc1ccc(Cl)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157638	EH	On-Demand	Anodyne	LTA4H	24	40
CN(CCOc1ccc(Cl)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157638	EH	On-Demand	Anodyne	SLC6A9	19	40
CN(CCOc1ccc(Cl)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157638	EH	On-Demand	Anodyne	PLA2G4B	47	35
COc1ccccc1[C@@H]1CSCCCN1CCN1CCNCC1	ZINC000872157642	EE	On-Demand	Anodyne	HTR1A	19	40
COc1ccc(CN(C)Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872157650	EG	On-Demand	Anodyne	ACHE	15	54
COc1ccc(CN(C)Cc2ccc(C)c(C(=O)O)c2)cc1OC	ZINC000872157650	EG	On-Demand	Anodyne	MT-ND1	18	43
COc1cc2c(cc1OC)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157653	EG	On-Demand	Anodyne	ADRA2C	17	51
COc1cc2c(cc1OC)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157653	EG	On-Demand	Anodyne	ABCB1B	66	41
COc1cc2c(cc1OC)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157653	EG	On-Demand	Anodyne	ABCB1	27	50
COc1cc2c(cc1OC)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157653	EG	On-Demand	Anodyne	ABCG2	35	40
COc1cc2c(cc1OC)CN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157653	EG	On-Demand	Anodyne	NOD2	40	38
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157662	GG	On-Demand	Anodyne	CCR3	49	40
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872157663	GG	On-Demand	Anodyne	CCR3	49	40
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157664	GG	On-Demand	Anodyne	CCR3	49	40
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872157665	GG	On-Demand	Anodyne	CCR3	49	40
C[C@H](C(=O)O)[C@@H](C)NCc1cnc(-c2ccccc2)nc1	ZINC000872157676	CE	On-Demand	Anodyne	MME	46	37
C[C@H](C(=O)O)[C@@H](C)NCc1cnc(-c2ccccc2)nc1	ZINC000872157676	CE	On-Demand	Anodyne	ANPEP	40	33
C[C@H](C(=O)O)[C@@H](C)NCc1cnc(-c2ccccc2)nc1	ZINC000872157676	CE	On-Demand	Anodyne	CPA1	33	40
C[C@H](C(=O)O)[C@@H](C)NCc1cnc(-c2ccccc2)nc1	ZINC000872157676	CE	On-Demand	Anodyne	TPH1	43	34
C[C@H](C(=O)O)[C@@H](C)NCc1cnc(-c2ccccc2)nc1	ZINC000872157676	CE	On-Demand	Anodyne	ACE2	48	35
C=CCN(CC=C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157685	BF	On-Demand	Mild	SHC	22	40
C=CCN(CC=C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157685	BF	On-Demand	Mild	LSS	35	40
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccon2)C1)C1CCCC1	ZINC000872157728	DE	On-Demand	Anodyne	DPEP1	40	31
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccon2)C1)C1CCCC1	ZINC000872157729	DE	On-Demand	Anodyne	DPEP1	40	31
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccon2)C1)C1CCCC1	ZINC000872157730	DE	On-Demand	Anodyne	DPEP1	40	31
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccon2)C1)C1CCCC1	ZINC000872157731	DE	On-Demand	Anodyne	DPEP1	40	31
COc1cccc([C@@H](C(=O)O)N(C)CCOc2cccc(F)c2)c1	ZINC000872157799	EF	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc([C@@H](C(=O)O)N(C)CCOc2cccc(F)c2)c1	ZINC000872157799	EF	On-Demand	Anodyne	MTNR1B	25	40
COc1cccc([C@H](C(=O)O)N(C)CCOc2cccc(F)c2)c1	ZINC000872157800	EF	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc([C@H](C(=O)O)N(C)CCOc2cccc(F)c2)c1	ZINC000872157800	EF	On-Demand	Anodyne	MTNR1B	25	40
COc1cc2c(cc1OC)CCN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157801	EG	On-Demand	Anodyne	ABCB1B	58	37
COc1cc2c(cc1OC)CCN(Cc1cc(C(=O)O)cs1)CC2	ZINC000872157801	EG	On-Demand	Anodyne	ABCB1	23	42
Cc1ccc(CN2CCO[C@H](c3ccc(Cl)cc3)C2)cc1C(=O)O	ZINC000872157812	EH	On-Demand	Anodyne	DRD4	43	47
COc1cccc([C@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157816	EI	On-Demand	Anodyne	KCNQ2	19	42
COc1cccc([C@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157816	EI	On-Demand	Anodyne	CCR5	40	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157816	EI	On-Demand	Anodyne	SLC18A3	40	37
COc1cccc([C@@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157817	EI	On-Demand	Anodyne	KCNQ2	19	42
COc1cccc([C@@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157817	EI	On-Demand	Anodyne	CCR5	40	45
COc1cccc([C@@H](C(=O)O)N2CCC[C@H](c3ccccc3)CC2)c1	ZINC000872157817	EI	On-Demand	Anodyne	SLC18A3	40	37
COc1cccc([C@@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157818	EI	On-Demand	Anodyne	KCNQ2	19	42
COc1cccc([C@@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157818	EI	On-Demand	Anodyne	CCR5	40	45
COc1cccc([C@@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157818	EI	On-Demand	Anodyne	SLC18A3	40	37
COc1cccc([C@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157819	EI	On-Demand	Anodyne	KCNQ2	19	42
COc1cccc([C@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157819	EI	On-Demand	Anodyne	CCR5	40	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000872157819	EI	On-Demand	Anodyne	SLC18A3	40	37
O=C(O)c1csc(CN2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1	ZINC000872157825	GE	On-Demand	Anodyne	SIGMAR1	40	61
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157832	EG	On-Demand	Anodyne	SLC6A1	50	34
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157832	EG	On-Demand	Anodyne	DPEP1	42	35
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157832	EG	On-Demand	Anodyne	CCR3	35	41
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157833	EG	On-Demand	Anodyne	SLC6A1	50	34
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157833	EG	On-Demand	Anodyne	DPEP1	42	35
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157833	EG	On-Demand	Anodyne	CCR3	35	41
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157834	EG	On-Demand	Anodyne	SLC6A1	50	34
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157834	EG	On-Demand	Anodyne	DPEP1	42	35
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157834	EG	On-Demand	Anodyne	CCR3	35	41
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157835	EG	On-Demand	Anodyne	SLC6A1	50	34
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157835	EG	On-Demand	Anodyne	DPEP1	42	35
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1)C1CCCC1	ZINC000872157835	EG	On-Demand	Anodyne	CCR3	35	41
COc1ccccc1-c1nc(CN(C)C[C@@H](C)C(=O)O)co1	ZINC000872157853	DF	On-Demand	Anodyne	LUCI_PHOPE	23	41
COc1ccccc1-c1nc(CN(C)C[C@H](C)C(=O)O)co1	ZINC000872157854	DF	On-Demand	Anodyne	LUCI_PHOPE	23	41
CN(CCOc1cccc(Cl)c1)Cc1cc(C(=O)O)cs1	ZINC000872157856	EH	On-Demand	Anodyne	PTGER1	15	44
CN(CCOc1cccc(Cl)c1)Cc1cc(C(=O)O)cs1	ZINC000872157856	EH	On-Demand	Anodyne	SLC6A9	19	41
CN(CCOc1cccc(Cl)c1)Cc1cc(C(=O)O)cs1	ZINC000872157856	EH	On-Demand	Anodyne	PDS	30	40
CN(CCOc1ccc(F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157857	DG	On-Demand	Anodyne	FDPS	19	43
CN(CCOc1ccc(F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157857	DG	On-Demand	Anodyne	LTA4H	26	40
CN(CCOc1ccc(F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157857	DG	On-Demand	Anodyne	PLA2G4B	47	35
CN(CCOc1ccc(F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872157857	DG	On-Demand	Anodyne	LSS	26	43
O=C(O)c1csc(CN(C2CCCC2)C2CC2)c1	ZINC000872157863	CG	On-Demand	Anodyne	ACE	46	33
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	DHODH	15	40
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	KCNQ2	41	50
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	NPY2R	15	40
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	MTNR1B	44	39
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	HSD17B2	17	40
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	ALS	47	30
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	AKR1C3	22	40
COc1cccc([C@@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157864	CG	On-Demand	Anodyne	AKR1C2	40	35
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	DHODH	15	40
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	KCNQ2	41	50
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	NPY2R	15	40
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	MTNR1B	44	39
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	HSD17B2	17	40
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	ALS	47	30
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	AKR1C3	22	40
COc1cccc([C@H](C(=O)O)N2CCCCCCC2)c1	ZINC000872157865	CG	On-Demand	Anodyne	AKR1C2	40	35
CN(Cc1ccc2c(c1)OCO2)Cc1cc(C(=O)O)cs1	ZINC000872157874	DF	On-Demand	Anodyne	BMP1	68	43
COc1ccccc1C[C@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157880	EH	On-Demand	Anodyne	ACHE	15	40
COc1ccccc1C[C@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157880	EH	On-Demand	Anodyne	TSPO	45	40
COc1ccccc1C[C@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157880	EH	On-Demand	Anodyne	PTPRA	64	36
COc1ccccc1C[C@@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157885	EH	On-Demand	Anodyne	ACHE	15	40
COc1ccccc1C[C@@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157885	EH	On-Demand	Anodyne	TSPO	45	40
COc1ccccc1C[C@@H](C)N(C)Cc1ccc(C)c(C(=O)O)c1	ZINC000872157885	EH	On-Demand	Anodyne	PTPRA	64	36
COc1ccccc1C[C@@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157890	EH	On-Demand	Anodyne	DRD2	38	41
COc1ccccc1C[C@@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157890	EH	On-Demand	Anodyne	MBTPS1	46	41
COc1ccccc1C[C@@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157890	EH	On-Demand	Anodyne	ACKR3	76	37
COc1ccccc1C[C@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157892	EH	On-Demand	Anodyne	DRD2	38	41
COc1ccccc1C[C@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157892	EH	On-Demand	Anodyne	MBTPS1	46	41
COc1ccccc1C[C@H]1CCCN1Cc1cc(C(=O)O)cs1	ZINC000872157892	EH	On-Demand	Anodyne	ACKR3	76	37
COc1ccnc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)n1	ZINC000872157899	ED	On-Demand	Anodyne	DRD4	29	45
COc1ccnc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)n1	ZINC000872157899	ED	On-Demand	Anodyne	DRD3	16	45
CC(=O)c1ccc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)c(F)c1	ZINC000872157903	FG	On-Demand	Anodyne	NPY2R	82	38
CC(=O)c1ccc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)c(F)c1	ZINC000872157903	FG	On-Demand	Anodyne	SLC6A9	15	45
Cc1ccc(CN2CCO[C@H](Cc3ccccc3)C2)cc1C(=O)O	ZINC000872157906	EG	On-Demand	Anodyne	DRD4	52	51
Cc1ccc(CN2CCO[C@H](Cc3ccccc3)C2)cc1C(=O)O	ZINC000872157906	EG	On-Demand	Anodyne	ACHE	19	40
Cc1ccc(CN2CCO[C@H](Cc3ccccc3)C2)cc1C(=O)O	ZINC000872157906	EG	On-Demand	Anodyne	CCR3	26	43
O=C(O)c1csc(CN2CCN(c3ncnc4sccc34)CC2)c1	ZINC000872157912	FF	On-Demand	Anodyne	SIRT3	45	33
COc1cccc([C@H]2CN(Cc3ccc(C)c(C(=O)O)c3)CCO2)c1	ZINC000872157913	EG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H]2CN(Cc3ccc(C)c(C(=O)O)c3)CCO2)c1	ZINC000872157913	EG	On-Demand	Anodyne	DRD3	15	44
COc1cccc([C@H]2CN(Cc3ccc(C)c(C(=O)O)c3)CCO2)c1	ZINC000872157913	EG	On-Demand	Anodyne	FABP4	16	43
COc1cccc([C@H]2CN(Cc3ccc(C)c(C(=O)O)c3)CCO2)c1	ZINC000872157913	EG	On-Demand	Anodyne	MCHR1	21	43
COc1cccc([C@@H](C(=O)O)N(C)Cc2ccc(OC)c(F)c2)c1	ZINC000872157914	EG	On-Demand	Anodyne	TSPO	45	39
COc1cccc([C@@H](C(=O)O)N(C)Cc2ccc(OC)c(F)c2)c1	ZINC000872157914	EG	On-Demand	Anodyne	HSD17B2	27	42
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157915	DG	On-Demand	Anodyne	NQO2	20	43
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157915	DG	On-Demand	Anodyne	MTNR1A	54	41
COc1cccc([C@@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157915	DG	On-Demand	Anodyne	MTNR1B	46	39
COc1cccc([C@H](C(=O)O)N(C)Cc2ccc(OC)c(F)c2)c1	ZINC000872157916	EG	On-Demand	Anodyne	TSPO	45	39
COc1cccc([C@H](C(=O)O)N(C)Cc2ccc(OC)c(F)c2)c1	ZINC000872157916	EG	On-Demand	Anodyne	HSD17B2	27	42
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	DRD4	34	47
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	ACHE	30	42
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	HRH1	15	46
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	SIGMAR1	50	51
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	PRCP	18	40
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	CCR5	30	44
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	SLC18A3	62	43
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	MCHR1	34	42
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1csc(CN2CCC(c3ccccc3)CC2)c1	ZINC000872157924	DH	On-Demand	Anodyne	MGEA5	40	52
COc1ccccc1-c1nc(CN2CCC(CCC(=O)O)CC2)co1	ZINC000872157931	EG	On-Demand	Anodyne	DRD2	17	52
COc1ccccc1-c1nc(CN2CCC(CCC(=O)O)CC2)co1	ZINC000872157931	EG	On-Demand	Anodyne	DRD4	23	52
COc1ccccc1-c1nc(CN2CCC(CCC(=O)O)CC2)co1	ZINC000872157931	EG	On-Demand	Anodyne	ACHE	48	46
COc1ccccc1-c1nc(CN2CCC(CCC(=O)O)CC2)co1	ZINC000872157931	EG	On-Demand	Anodyne	DRD3	15	50
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157932	DG	On-Demand	Anodyne	NQO2	20	43
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157932	DG	On-Demand	Anodyne	MTNR1A	54	41
COc1cccc([C@H](C(=O)O)N(C)CCc2ccccc2F)c1	ZINC000872157932	DG	On-Demand	Anodyne	MTNR1B	46	39
O=C(O)c1csc(CN2CCC[C@H]2Cc2ccccc2)c1	ZINC000872157940	DH	On-Demand	Anodyne	CYP2J2	42	29
O=C(O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000872157941	FI	On-Demand	Anodyne	HRH1	36	43
O=C(O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000872157941	FI	On-Demand	Anodyne	CCR3	37	43
O=C(O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000872157941	FI	On-Demand	Anodyne	UTS2R	16	41
O=C(O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000872157941	FI	On-Demand	Anodyne	SCD1	46	45
O=C(O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000872157941	FI	On-Demand	Anodyne	SCD	27	43
O=C(O)c1csc(CN2CCC[C@@H]2Cc2ccccc2)c1	ZINC000872157942	DH	On-Demand	Anodyne	CYP2J2	42	29
COc1cccc([C@@H](C(=O)O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872157953	FG	On-Demand	Anodyne	CCR3	20	41
COc1cccc([C@H](C(=O)O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872157955	FG	On-Demand	Anodyne	CCR3	20	41
COc1cccc([C@@H](C(=O)O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872157957	FG	On-Demand	Anodyne	CCR3	20	41
COc1cccc([C@H](C(=O)O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872157959	FG	On-Demand	Anodyne	CCR3	20	41
O=C(O)c1csc(CN2CCC[C@H]2CCc2ccccc2)c1	ZINC000872157964	DI	On-Demand	Anodyne	SLC18A2	54	42
O=C(O)c1csc(CN2CCC[C@H]2CCc2ccccc2)c1	ZINC000872157964	DI	On-Demand	Anodyne	SIGMAR1	25	42
O=C(O)c1csc(CN2CCC[C@H]2CCc2ccccc2)c1	ZINC000872157964	DI	On-Demand	Anodyne	PREP	52	35
O=C(O)c1csc(CN2CCC[C@@H]2CCc2ccccc2)c1	ZINC000872157965	DI	On-Demand	Anodyne	SLC18A2	54	42
O=C(O)c1csc(CN2CCC[C@@H]2CCc2ccccc2)c1	ZINC000872157965	DI	On-Demand	Anodyne	SIGMAR1	25	42
O=C(O)c1csc(CN2CCC[C@@H]2CCc2ccccc2)c1	ZINC000872157965	DI	On-Demand	Anodyne	PREP	52	35
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	PRCP	15	42
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	S1PR4	27	40
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	GRM5	19	61
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	S1PR1	24	46
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	S1PR5	39	40
O=C(O)c1csc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157971	GI	On-Demand	Anodyne	ETHR	67	42
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	PRCP	15	42
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	S1PR4	27	40
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	GRM5	19	61
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	S1PR1	24	46
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	S1PR5	39	40
O=C(O)c1csc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000872157972	GI	On-Demand	Anodyne	ETHR	67	42
COc1cccc([C@H](C(=O)O)N(C)CCOc2ccccc2OC)c1	ZINC000872157973	EF	On-Demand	Anodyne	SLC6A9	24	44
COc1cccc([C@@H](C(=O)O)N(C)CCOc2ccccc2OC)c1	ZINC000872157974	EF	On-Demand	Anodyne	SLC6A9	24	44
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@H]1CCc2ccccc2C1	ZINC000872157982	EI	On-Demand	Anodyne	HTR1A	28	58
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@H]1CCc2ccccc2C1	ZINC000872157982	EI	On-Demand	Anodyne	DRD2	35	52
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@H]1CCc2ccccc2C1	ZINC000872157982	EI	On-Demand	Anodyne	HTR1D	17	49
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@H]1CCc2ccccc2C1	ZINC000872157982	EI	On-Demand	Anodyne	DRD3	53	51
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@@H]1CCc2ccccc2C1	ZINC000872157983	EI	On-Demand	Anodyne	HTR1A	28	58
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@@H]1CCc2ccccc2C1	ZINC000872157983	EI	On-Demand	Anodyne	DRD2	35	52
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@@H]1CCc2ccccc2C1	ZINC000872157983	EI	On-Demand	Anodyne	HTR1D	17	49
CCCN(Cc1ccc(C)c(C(=O)O)c1)[C@@H]1CCc2ccccc2C1	ZINC000872157983	EI	On-Demand	Anodyne	DRD3	53	51
Cc1ccccc1C1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157984	DI	On-Demand	Anodyne	DRD4	29	47
Cc1ccccc1C1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157984	DI	On-Demand	Anodyne	ACHE	26	40
Cc1ccccc1C1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157984	DI	On-Demand	Anodyne	HRH1	25	42
Cc1ccccc1C1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872157984	DI	On-Demand	Anodyne	MGEA5	33	40
O=C(O)c1csc(CN2CCC(Oc3ccc(F)cc3F)CC2)c1	ZINC000872157990	FH	On-Demand	Anodyne	CCR3	26	41
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	HTR1A	17	44
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	DRD2	30	52
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	DRD4	68	50
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	ACHE	37	50
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	HRH1	23	44
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	DRD3	26	44
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	KCNH2	15	42
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	FABP4	23	46
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	SIGMAR1	52	50
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	SSTR5	43	38
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	NPY1R	16	47
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	CCR3	39	43
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	CCR5	57	35
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	CXCR3	15	40
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	MCHR1	67	52
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	CACNA1G	20	41
COc1cccc(C2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)c1	ZINC000872157991	EI	On-Demand	Anodyne	CCR8	27	43
C[C@H](NC(=O)CN1CCC[C@@H](C[C@H](N)C2CCCC2)C1)C(=O)N1CCCCC1	ZINC000872158026	GE	On-Demand	Anodyne	DPP7	32	41
C[C@H](NC(=O)CN1CCC[C@@H](C[C@@H](N)C2CCCC2)C1)C(=O)N1CCCCC1	ZINC000872158027	GE	On-Demand	Anodyne	DPP7	32	41
C[C@H](NC(=O)CN1CCC[C@H](C[C@@H](N)C2CCCC2)C1)C(=O)N1CCCCC1	ZINC000872158029	GE	On-Demand	Anodyne	DPP7	32	41
C[C@H](NC(=O)CN1CCC[C@H](C[C@H](N)C2CCCC2)C1)C(=O)N1CCCCC1	ZINC000872158031	GE	On-Demand	Anodyne	DPP7	32	41
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	DRD2	45	44
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	DRD4	41	33
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	DRD3	16	45
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	FABP4	19	48
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	SIGMAR1	21	45
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	CHRNA10	28	40
COc1cccc(C[C@@H]2CCCN2Cc2ccc(C)c(C(=O)O)c2)c1	ZINC000872158044	EH	On-Demand	Anodyne	ACKR3	58	34
COc1ccc(CC[C@@H]2CCCCN2Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872158048	GI	On-Demand	Anodyne	FKBP1A	53	41
COc1ccc(CC[C@@H]2CCCCN2Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872158048	GI	On-Demand	Anodyne	ACKR3	64	36
COc1ccc(CC[C@H]2CCCCN2Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872158051	GI	On-Demand	Anodyne	FKBP1A	53	41
COc1ccc(CC[C@H]2CCCCN2Cc2cc(C(=O)O)cs2)cc1OC	ZINC000872158051	GI	On-Demand	Anodyne	ACKR3	64	36
O=C(O)c1csc(CN2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872158058	EH	On-Demand	Anodyne	SIGMAR1	15	46
O=C(O)c1csc(CN2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000872158060	EH	On-Demand	Anodyne	SIGMAR1	15	46
COc1cccc(C[C@@H]2CCCN2Cc2cc(C(=O)O)cs2)c1	ZINC000872158063	EH	On-Demand	Anodyne	DRD2	34	40
COc1cccc(C[C@@H]2CCCN2Cc2cc(C(=O)O)cs2)c1	ZINC000872158063	EH	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H]2CCCN2Cc2cc(C(=O)O)cs2)c1	ZINC000872158063	EH	On-Demand	Anodyne	SIGMAR1	23	42
COc1cccc(C[C@@H]2CCCN2Cc2cc(C(=O)O)cs2)c1	ZINC000872158063	EH	On-Demand	Anodyne	ACKR3	58	33
N[C@@H](C[C@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158072	EG	On-Demand	Anodyne	CHRNA7	17	45
N[C@@H](C[C@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158072	EG	On-Demand	Anodyne	NAMPT	18	40
N[C@@H](C[C@@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158074	EG	On-Demand	Anodyne	CHRNA7	17	45
N[C@@H](C[C@@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158074	EG	On-Demand	Anodyne	NAMPT	18	40
N[C@H](C[C@@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158075	EG	On-Demand	Anodyne	CHRNA7	17	45
N[C@H](C[C@@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158075	EG	On-Demand	Anodyne	NAMPT	18	40
N[C@H](C[C@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158076	EG	On-Demand	Anodyne	CHRNA7	17	45
N[C@H](C[C@H]1CCCN(CCC(=O)Nc2cccnc2)C1)C1CCCC1	ZINC000872158076	EG	On-Demand	Anodyne	NAMPT	18	40
O=C(O)c1csc(CN(CC2CC2)C2CCCCC2)c1	ZINC000872158087	CH	On-Demand	Anodyne	ACE	40	32
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158095	EF	On-Demand	Anodyne	GRIN2B	17	41
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158095	EF	On-Demand	Anodyne	GCK	15	42
N[C@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158095	EF	On-Demand	Anodyne	BIRC2	34	40
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158097	EF	On-Demand	Anodyne	GRIN2B	17	41
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158097	EF	On-Demand	Anodyne	GCK	15	42
N[C@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158097	EF	On-Demand	Anodyne	BIRC2	34	40
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158098	EF	On-Demand	Anodyne	GRIN2B	17	41
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158098	EF	On-Demand	Anodyne	GCK	15	42
N[C@@H](C[C@@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158098	EF	On-Demand	Anodyne	BIRC2	34	40
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158100	EF	On-Demand	Anodyne	GRIN2B	17	41
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158100	EF	On-Demand	Anodyne	GCK	15	42
N[C@@H](C[C@H]1CCCN(CC(=O)Nc2ccccn2)C1)C1CCCC1	ZINC000872158100	EF	On-Demand	Anodyne	BIRC2	34	40
CCN(Cc1ccc(OC)c(OC)c1)Cc1cc(C(=O)O)cs1	ZINC000872158161	EG	On-Demand	Anodyne	MT-ND1	19	42
CCN(Cc1ccc(OC)c(OC)c1)Cc1cc(C(=O)O)cs1	ZINC000872158161	EG	On-Demand	Anodyne	HCRTR2	15	40
O=C(O)c1csc(CN2CCO[C@@H](Cc3ccccc3)C2)c1	ZINC000872158171	DF	On-Demand	Anodyne	DRD4	20	48
O=C(O)c1csc(CN2CCO[C@H](Cc3ccccc3)C2)c1	ZINC000872158172	DF	On-Demand	Anodyne	DRD4	20	48
O=C(O)c1csc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872158178	FD	On-Demand	Anodyne	PKM	29	43
O=C(O)c1csc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872158178	FD	On-Demand	Anodyne	TGM2	47	38
O=C(O)c1csc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872158178	FD	On-Demand	Anodyne	F13A1	52	38
O=C(O)c1csc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000872158178	FD	On-Demand	Anodyne	AKR1C3	67	46
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR1A	163	59
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ADRA2A	21	49
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	DRD2	143	59
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	DRD1	32	58
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	DRD4	136	63
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ACHE	29	48
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HRH2	18	58
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ADRA1D	116	51
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR1D	27	41
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR1B	37	42
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR2A	63	58
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR2C	37	48
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	SLC6A4	26	50
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ADRA1A	112	51
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HRH1	16	58
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ADRA1B	87	51
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	DRD3	140	58
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ABCC8	18	40
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR2B	15	48
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	HTR7	95	57
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	FABP4	40	43
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	SIGMAR1	41	50
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	CCR3	15	45
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	UTS2R	21	49
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	ABCB1	61	47
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	MCHR1	18	40
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	CACNA1G	24	43
COc1ccccc1N1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158181	EG	On-Demand	Anodyne	CCR8	33	41
CN(CCOc1ccccc1)Cc1cc(C(=O)O)cs1	ZINC000872158191	CF	On-Demand	Anodyne	FDPS	25	48
CN(CCOc1ccccc1)Cc1cc(C(=O)O)cs1	ZINC000872158191	CF	On-Demand	Anodyne	LTA4H	35	44
CN(CCOc1ccccc1)Cc1cc(C(=O)O)cs1	ZINC000872158191	CF	On-Demand	Anodyne	PLA2G4B	63	38
CN(CCOc1ccccc1)Cc1cc(C(=O)O)cs1	ZINC000872158191	CF	On-Demand	Anodyne	ESRRG	47	36
CN(CCCCCCN)Cc1cccnc1N	ZINC000872158221	BD	On-Demand	Anodyne	CXCR4	38	41
COC(=O)CCCc1nc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)no1	ZINC000872158251	GF	On-Demand	Anodyne	BMP1	27	40
COC(=O)CCCc1nc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)no1	ZINC000872158252	GF	On-Demand	Anodyne	BMP1	27	40
COC(=O)CCCc1nc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)no1	ZINC000872158253	GF	On-Demand	Anodyne	BMP1	27	40
COC(=O)CCCc1nc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)no1	ZINC000872158254	GF	On-Demand	Anodyne	BMP1	27	40
CCCNC(=O)[C@H](C)N1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872158255	DF	On-Demand	Anodyne	HLA-DRB3	47	33
CCCNC(=O)[C@H](C)N1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872158256	DF	On-Demand	Anodyne	HLA-DRB3	47	33
CCCNC(=O)[C@H](C)N1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872158257	DF	On-Demand	Anodyne	HLA-DRB3	47	33
CCCNC(=O)[C@H](C)N1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872158258	DF	On-Demand	Anodyne	HLA-DRB3	47	33
N[C@@H](C[C@@H]1CCCN(CCc2cccnc2)C1)C1CCCC1	ZINC000872158267	DG	On-Demand	Anodyne	C3AR1	40	42
N[C@H](C[C@H]1CCCN(CCc2cccnc2)C1)C1CCCC1	ZINC000872158268	DG	On-Demand	Anodyne	C3AR1	40	42
N[C@@H](C[C@H]1CCCN(CCc2cccnc2)C1)C1CCCC1	ZINC000872158269	DG	On-Demand	Anodyne	C3AR1	40	42
N[C@H](C[C@@H]1CCCN(CCc2cccnc2)C1)C1CCCC1	ZINC000872158270	DG	On-Demand	Anodyne	C3AR1	40	42
O=C(O)c1csc(CN2CCC(c3ccsc3)CC2)c1	ZINC000872158331	DH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(O)c1csc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158332	FI	On-Demand	Anodyne	HRH1	44	52
O=C(O)c1csc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158332	FI	On-Demand	Anodyne	CHEK2	18	43
O=C(O)c1csc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158332	FI	On-Demand	Anodyne	CCR3	52	56
O=C(O)c1csc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158332	FI	On-Demand	Anodyne	UTS2R	19	48
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158333	FI	On-Demand	Anodyne	HRH1	44	52
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158333	FI	On-Demand	Anodyne	CHEK2	18	43
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158333	FI	On-Demand	Anodyne	CCR3	52	56
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1	ZINC000872158333	FI	On-Demand	Anodyne	UTS2R	19	48
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	DRD2	18	42
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	DRD4	58	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	ACHE	27	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	SLC6A1	45	35
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	SIGMAR1	41	41
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	CCR3	31	41
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	CCR5	53	38
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1C(=O)O	ZINC000872158350	DI	On-Demand	Anodyne	MCHR1	28	41
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	DRD2	18	42
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	DRD4	58	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	ACHE	27	43
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	SLC6A1	45	35
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	SIGMAR1	41	41
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	CCR3	31	41
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	CCR5	53	38
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1C(=O)O	ZINC000872158351	DI	On-Demand	Anodyne	MCHR1	28	41
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	HTR1A	33	42
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	DRD2	36	48
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	DRD4	48	48
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	ACHE	25	41
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	ADRA1D	50	35
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	HRH1	28	40
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	ADRA1B	45	35
COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158368	DG	On-Demand	Anodyne	SIGMAR1	29	42
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	HTR1A	33	42
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	DRD2	36	48
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	DRD4	48	48
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	ACHE	25	41
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	ADRA1D	50	35
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	HRH1	28	40
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	ADRA1B	45	35
COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)O)cs2)C1	ZINC000872158369	DG	On-Demand	Anodyne	SIGMAR1	29	42
O=C(O)c1csc(CN2CCCC[C@@H]2CCCc2ccccc2)c1	ZINC000872158404	EJ	On-Demand	Anodyne	FKBP1A	44	37
O=C(O)c1csc(CN2CCCC[C@@H]2CCCc2ccccc2)c1	ZINC000872158404	EJ	On-Demand	Anodyne	SLC18A2	41	43
O=C(O)c1csc(CN2CCCC[C@@H]2CCCc2ccccc2)c1	ZINC000872158404	EJ	On-Demand	Anodyne	SIGMAR1	21	44
O=C(O)c1csc(CN2CCCC[C@@H]2CCCc2ccccc2)c1	ZINC000872158404	EJ	On-Demand	Anodyne	PREP	45	36
O=C(O)c1csc(CN2CCCC[C@H]2CCCc2ccccc2)c1	ZINC000872158405	EJ	On-Demand	Anodyne	FKBP1A	44	37
O=C(O)c1csc(CN2CCCC[C@H]2CCCc2ccccc2)c1	ZINC000872158405	EJ	On-Demand	Anodyne	SLC18A2	41	43
O=C(O)c1csc(CN2CCCC[C@H]2CCCc2ccccc2)c1	ZINC000872158405	EJ	On-Demand	Anodyne	SIGMAR1	21	44
O=C(O)c1csc(CN2CCCC[C@H]2CCCc2ccccc2)c1	ZINC000872158405	EJ	On-Demand	Anodyne	PREP	45	36
N[C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccn2)C1)C1CCCC1	ZINC000872158415	EE	On-Demand	Anodyne	BIRC2	23	42
N[C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccn2)C1)C1CCCC1	ZINC000872158416	EE	On-Demand	Anodyne	BIRC2	23	42
N[C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccn2)C1)C1CCCC1	ZINC000872158417	EE	On-Demand	Anodyne	BIRC2	23	42
N[C@H](C[C@H]1CCCN(CC(=O)NCc2ccccn2)C1)C1CCCC1	ZINC000872158418	EE	On-Demand	Anodyne	BIRC2	23	42
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)CCCCCCN)CC1	ZINC000872158511	ED	On-Demand	Anodyne	P2RY12	50	37
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	DRD2	17	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	DRD4	53	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	ACHE	23	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	SLC6A1	63	36
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	SIGMAR1	36	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	CCR3	24	40
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@@H]1c1ccccc1	ZINC000872158524	EJ	On-Demand	Anodyne	CCR5	68	43
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	DRD2	17	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	DRD4	53	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	ACHE	23	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	SLC6A1	63	36
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	SIGMAR1	36	41
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	CCR3	24	40
CC[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CC[C@H]1c1ccccc1	ZINC000872158525	EJ	On-Demand	Anodyne	CCR5	68	43
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)c1	ZINC000872158529	EH	On-Demand	Anodyne	UTS2R	24	40
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)c1	ZINC000872158529	EH	On-Demand	Anodyne	SCD1	33	42
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)c1	ZINC000872158529	EH	On-Demand	Anodyne	SCD	18	40
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)c1	ZINC000872158530	EH	On-Demand	Anodyne	UTS2R	24	40
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)c1	ZINC000872158530	EH	On-Demand	Anodyne	SCD1	33	42
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)c1	ZINC000872158530	EH	On-Demand	Anodyne	SCD	18	40
COCCCOC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158545	DF	On-Demand	Anodyne	ACHE	26	42
COCCCOC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158545	DF	On-Demand	Anodyne	SIGMAR1	25	47
COCCCOC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158545	DF	On-Demand	Anodyne	SSTR5	59	39
COCCCOC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158545	DF	On-Demand	Anodyne	CCR3	23	40
COCCCOC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158545	DF	On-Demand	Anodyne	MCHR1	34	40
CCC1(O)CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872158553	CE	On-Demand	Anodyne	MCHR2	69	35
O=C(O)c1csc(CN2CCC(c3cccc(Br)c3)CC2)c1	ZINC000872158554	GJ	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)c1csc(CN2CCC(c3cccc(Br)c3)CC2)c1	ZINC000872158554	GJ	On-Demand	Anodyne	MCHR1	24	40
O=C(O)c1csc(CN2CCC(c3cccc(Br)c3)CC2)c1	ZINC000872158554	GJ	On-Demand	Anodyne	MGEA5	28	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)CCCCCCN)CC1	ZINC000872158595	ED	On-Demand	Anodyne	P2RY12	50	37
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	DRD2	17	56
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	DRD4	36	46
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	SIGMAR1	24	49
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	CACNA1B	53	39
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	CCR5	63	37
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	MLNR	15	40
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	CCR2	78	46
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	MCHR1	43	49
Cc1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872158597	FJ	On-Demand	Anodyne	LIPG	52	38
CC(=O)Nc1cccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872158610	EH	On-Demand	Anodyne	CCR3	87	43
CC(=O)Nc1cccc(CN2CCC[C@@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872158610	EH	On-Demand	Anodyne	MCHR1	26	43
CC(=O)Nc1cccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872158611	EH	On-Demand	Anodyne	CCR3	87	43
CC(=O)Nc1cccc(CN2CCC[C@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872158611	EH	On-Demand	Anodyne	MCHR1	26	43
CC(=O)Nc1cccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872158612	EH	On-Demand	Anodyne	CCR3	87	43
CC(=O)Nc1cccc(CN2CCC[C@@H](C[C@H](N)C3CCCC3)C2)c1	ZINC000872158612	EH	On-Demand	Anodyne	MCHR1	26	43
CC(=O)Nc1cccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872158613	EH	On-Demand	Anodyne	CCR3	87	43
CC(=O)Nc1cccc(CN2CCC[C@H](C[C@@H](N)C3CCCC3)C2)c1	ZINC000872158613	EH	On-Demand	Anodyne	MCHR1	26	43
Cc1ccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)cc1C(=O)O	ZINC000872158615	GI	On-Demand	Anodyne	RBP4	89	39
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	DRD2	20	46
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	DRD4	39	42
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	ACHE	29	49
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	HTR2A	15	45
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	SLC6A1	40	36
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	HRH1	24	40
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	SLC6A3	17	40
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	KCNH2	16	43
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	GRIN2B	56	45
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	SIGMAR1	42	46
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	CCR3	176	47
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	CCR5	26	42
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	SLC18A3	18	40
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	MLNR	69	44
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	CYP2D6	25	42
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	GRIN2C	18	40
Cc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158716	EH	On-Demand	Anodyne	MCHR1	34	42
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	DRD2	20	46
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	DRD4	39	42
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	ACHE	29	49
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	HTR2A	15	45
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	SLC6A1	40	36
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	HRH1	24	40
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	SLC6A3	17	40
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	KCNH2	16	43
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	GRIN2B	56	45
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	SIGMAR1	42	46
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	CCR3	176	47
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	CCR5	26	42
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	SLC18A3	18	40
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	MLNR	69	44
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	CYP2D6	25	42
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	GRIN2C	18	40
Cc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)O	ZINC000872158717	EH	On-Demand	Anodyne	MCHR1	34	42
Cc1ccc(CN2CC[C@@]3(CC[C@@H](C)C3)C2)cc1C(=O)O	ZINC000872158719	CH	On-Demand	Anodyne	MCHR2	41	33
Cc1ccc(CN2CC[C@@]3(CC[C@H](C)C3)C2)cc1C(=O)O	ZINC000872158720	CH	On-Demand	Anodyne	MCHR2	41	33
COCCN(Cc1ccc2c(c1)OCO2)Cc1cc(C(=O)O)cs1	ZINC000872158730	EF	On-Demand	Anodyne	EDNRA	42	38
COCCN(Cc1ccc2c(c1)OCO2)Cc1cc(C(=O)O)cs1	ZINC000872158730	EF	On-Demand	Anodyne	BMP1	69	42
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	DRD2	21	43
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	FKBP1A	45	38
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	DRD4	49	41
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	ACHE	40	42
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	SLC6A1	54	36
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	DRD3	15	41
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	SIGMAR1	62	58
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	CCR3	35	40
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	UTS2R	18	40
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	S1PR5	18	44
Cc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1C(=O)O	ZINC000872158758	FH	On-Demand	Anodyne	MCHR1	25	42
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	DRD4	42	42
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	ACHE	42	46
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	SLC6A1	42	34
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	SIGMAR1	39	40
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	CCR3	53	40
Cc1ccc(CN2CC[C@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158851	EI	On-Demand	Anodyne	MCHR1	19	40
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	DRD4	42	42
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	ACHE	42	46
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	SLC6A1	42	34
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	SIGMAR1	39	40
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	CCR3	53	40
Cc1ccc(CN2CC[C@@H](CSc3ccccc3)C2)cc1C(=O)O	ZINC000872158857	EI	On-Demand	Anodyne	MCHR1	19	40
O=C(O)c1csc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000872158870	FI	On-Demand	Anodyne	RBP4	81	41
O=C(O)c1csc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000872158874	FI	On-Demand	Anodyne	RBP4	81	41
N[C@@H](C[C@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158972	FE	On-Demand	Reactive	SLC6A1	63	35
N[C@@H](C[C@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158972	FE	On-Demand	Reactive	DPEP1	40	35
N[C@@H](C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158973	FE	On-Demand	Reactive	SLC6A1	63	35
N[C@@H](C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158973	FE	On-Demand	Reactive	DPEP1	40	35
N[C@H](C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158974	FE	On-Demand	Reactive	SLC6A1	63	35
N[C@H](C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158974	FE	On-Demand	Reactive	DPEP1	40	35
N[C@H](C[C@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158975	FE	On-Demand	Reactive	SLC6A1	63	35
N[C@H](C[C@H]1CCCN(CC(=O)NNC(=O)c2ccccc2)C1)C1CCCC1	ZINC000872158975	FE	On-Demand	Reactive	DPEP1	40	35
O=C(O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158985	FI	On-Demand	Anodyne	CCR2	71	43
O=C(O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158985	FI	On-Demand	Anodyne	MCHR1	15	42
O=C(O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158985	FI	On-Demand	Anodyne	LIPG	45	33
O=C(O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158986	FI	On-Demand	Anodyne	CCR2	71	43
O=C(O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158986	FI	On-Demand	Anodyne	MCHR1	15	42
O=C(O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872158986	FI	On-Demand	Anodyne	LIPG	45	33
O=C(O)c1csc(CN2CCC(CN3CCCCC3=O)CC2)c1	ZINC000872159006	EF	On-Demand	Anodyne	ACHE	18	48
O=C(O)c1csc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000872159008	FG	On-Demand	Bother	HRH1	16	41
Cc1ccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)cc1C(=O)O	ZINC000872159014	EH	On-Demand	Anodyne	DRD4	36	44
CC[C@@H]1CN(Cc2cc(C(=O)O)cs2)CC[C@@H]1c1ccccc1	ZINC000872159031	EI	On-Demand	Anodyne	CCR5	49	40
CC[C@@H]1CN(Cc2cc(C(=O)O)cs2)CC[C@H]1c1ccccc1	ZINC000872159033	EI	On-Demand	Anodyne	CCR5	49	40
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000872159042	EH	On-Demand	Anodyne	DHODH	15	40
COc1cccc([C@H](C(=O)O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000872159043	EH	On-Demand	Anodyne	DHODH	15	40
COc1cccc([C@H](C(=O)O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000872159044	EH	On-Demand	Anodyne	DHODH	15	40
COc1cccc([C@@H](C(=O)O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000872159045	EH	On-Demand	Anodyne	DHODH	15	40
C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)Cc1cc(C(=O)O)cs1	ZINC000872159054	EJ	On-Demand	Anodyne	UTS2	41	32
C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)Cc1cc(C(=O)O)cs1	ZINC000872159055	EJ	On-Demand	Anodyne	UTS2	41	32
C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)Cc1cc(C(=O)O)cs1	ZINC000872159056	EJ	On-Demand	Anodyne	UTS2	41	32
C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)Cc1cc(C(=O)O)cs1	ZINC000872159057	EJ	On-Demand	Anodyne	UTS2	41	32
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@H]2C)cc1C(=O)O	ZINC000872159058	DI	On-Demand	Anodyne	DRD4	20	40
Cc1ccc(CN2CC[C@@H](c3ccccc3)[C@@H]2C)cc1C(=O)O	ZINC000872159059	DI	On-Demand	Anodyne	DRD4	20	40
Cc1ccc(CN2CC[C@@H](C)C(C)(C)C2)cc1C(=O)O	ZINC000872159074	CH	On-Demand	Anodyne	DRD4	28	40
Cc1ccc(CN2CC[C@H](C)C(C)(C)C2)cc1C(=O)O	ZINC000872159075	CH	On-Demand	Anodyne	DRD4	28	40
O=C(O)c1csc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159102	EH	On-Demand	Anodyne	HTR2A	15	42
O=C(O)c1csc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159102	EH	On-Demand	Anodyne	SLC6A1	147	41
O=C(O)c1csc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159102	EH	On-Demand	Anodyne	SLC18A3	22	44
O=C(O)c1csc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159102	EH	On-Demand	Anodyne	WNT3A	47	33
O=C(O)c1csc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159103	EH	On-Demand	Anodyne	HTR2A	15	42
O=C(O)c1csc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159103	EH	On-Demand	Anodyne	SLC6A1	147	41
O=C(O)c1csc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159103	EH	On-Demand	Anodyne	SLC18A3	22	44
O=C(O)c1csc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1	ZINC000872159103	EH	On-Demand	Anodyne	WNT3A	47	33
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	DRD2	23	45
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	DRD4	64	45
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	ACHE	33	43
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	SLC6A1	79	39
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	HRH1	43	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	DRD3	18	45
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	HTR4	23	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	SIGMAR1	39	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	SSTR5	55	39
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	CCR3	67	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	UTS2R	33	50
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	S1PR1	15	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	S1PR5	25	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	MCHR1	28	45
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	CCR8	17	42
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	SCD1	29	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	NOX1	40	33
Cc1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1C(=O)O	ZINC000872159111	EH	On-Demand	Anodyne	NOX5	40	32
O=C(O)c1csc(CN2CC[C@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159125	DH	On-Demand	Anodyne	ACHE	21	45
O=C(O)c1csc(CN2CC[C@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159125	DH	On-Demand	Anodyne	HTR2A	15	45
O=C(O)c1csc(CN2CC[C@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159125	DH	On-Demand	Anodyne	GRIN2B	48	41
O=C(O)c1csc(CN2CC[C@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159125	DH	On-Demand	Anodyne	SIGMAR1	31	45
O=C(O)c1csc(CN2CC[C@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159125	DH	On-Demand	Anodyne	CCR3	149	40
O=C(O)c1csc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159126	DH	On-Demand	Anodyne	ACHE	21	45
O=C(O)c1csc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159126	DH	On-Demand	Anodyne	HTR2A	15	45
O=C(O)c1csc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159126	DH	On-Demand	Anodyne	GRIN2B	48	41
O=C(O)c1csc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159126	DH	On-Demand	Anodyne	SIGMAR1	31	45
O=C(O)c1csc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)c1	ZINC000872159126	DH	On-Demand	Anodyne	CCR3	149	40
O=C(O)c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)c1	ZINC000872159155	EJ	On-Demand	Anodyne	ACHE	29	42
O=C(O)c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)c1	ZINC000872159155	EJ	On-Demand	Anodyne	SLC6A1	57	34
O=C(O)c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)c1	ZINC000872159155	EJ	On-Demand	Anodyne	SIGMAR1	37	40
O=C(O)c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)c1	ZINC000872159155	EJ	On-Demand	Anodyne	CCR5	17	44
O=C(O)c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)c1	ZINC000872159155	EJ	On-Demand	Anodyne	PREP	44	35
O=C(O)c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)c1	ZINC000872159156	EJ	On-Demand	Anodyne	ACHE	29	42
O=C(O)c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)c1	ZINC000872159156	EJ	On-Demand	Anodyne	SLC6A1	57	34
O=C(O)c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)c1	ZINC000872159156	EJ	On-Demand	Anodyne	SIGMAR1	37	40
O=C(O)c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)c1	ZINC000872159156	EJ	On-Demand	Anodyne	CCR5	17	44
O=C(O)c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)c1	ZINC000872159156	EJ	On-Demand	Anodyne	PREP	44	35
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	DRD4	20	41
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	HRH1	25	40
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	KCNH2	40	38
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	CHRM3	21	50
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	CCR3	29	41
O=C(O)c1csc(CN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000872159168	DG	On-Demand	Anodyne	CYP2J2	45	32
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	DRD4	44	46
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	ACHE	47	49
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	SIGMAR1	39	43
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	SSTR5	43	38
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	CCR3	45	39
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	MCHR1	43	41
CNC(=O)CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159183	DE	On-Demand	Anodyne	CACNA1I	37	42
O=C(O)c1csc(CN2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000872159185	FJ	On-Demand	Anodyne	SIGMAR1	16	45
O=C(O)c1csc(CN2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000872159185	FJ	On-Demand	Anodyne	CCR2	42	41
O=C(O)c1csc(CN2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000872159185	FJ	On-Demand	Anodyne	MGEA5	26	40
O=C(O)CN(CCCC1CC1)CCc1ccccc1	ZINC000872159208	CF	On-Demand	Anodyne	ACE	46	37
O=C(O)CN(CCCC1CC1)CCc1ccccc1	ZINC000872159208	CF	On-Demand	Anodyne	SLC18A2	42	37
O=C(O)CN(CCCC1CC1)CCc1ccccc1	ZINC000872159208	CF	On-Demand	Anodyne	AMY2	47	34
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1C(=O)O	ZINC000872159218	FI	On-Demand	Anodyne	DRD4	28	46
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1C(=O)O	ZINC000872159218	FI	On-Demand	Anodyne	CCR3	42	39
Cc1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1C(=O)O	ZINC000872159218	FI	On-Demand	Anodyne	MLNR	42	34
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)C(C)(C)C)CC2	ZINC000872159266	EH	On-Demand	Anodyne	DRD1	15	42
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)C(C)(C)C)CC2	ZINC000872159266	EH	On-Demand	Anodyne	SLC18A2	55	40
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)C(C)(C)C)CC2	ZINC000872159266	EH	On-Demand	Anodyne	HCRTR1	16	48
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)C(C)(C)C)CC2	ZINC000872159266	EH	On-Demand	Anodyne	MTNR1B	18	50
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)C(C)(C)C)CC2	ZINC000872159266	EH	On-Demand	Anodyne	HCRTR2	15	43
COc1cccc([C@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159267	DC	On-Demand	Anodyne	ADRB3	16	43
COc1cccc([C@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159267	DC	On-Demand	Anodyne	MTNR1A	52	42
COc1cccc([C@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159267	DC	On-Demand	Anodyne	MTNR1B	47	42
COc1cccc([C@@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159268	DC	On-Demand	Anodyne	ADRB3	16	43
COc1cccc([C@@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159268	DC	On-Demand	Anodyne	MTNR1A	52	42
COc1cccc([C@@H](C(=O)O)N(C)CCNS(C)(=O)=O)c1	ZINC000872159268	DC	On-Demand	Anodyne	MTNR1B	47	42
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)C(C)(C)C)CC2	ZINC000872159269	EH	On-Demand	Anodyne	DRD1	15	42
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)C(C)(C)C)CC2	ZINC000872159269	EH	On-Demand	Anodyne	SLC18A2	55	40
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)C(C)(C)C)CC2	ZINC000872159269	EH	On-Demand	Anodyne	HCRTR1	16	48
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)C(C)(C)C)CC2	ZINC000872159269	EH	On-Demand	Anodyne	MTNR1B	18	50
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)C(C)(C)C)CC2	ZINC000872159269	EH	On-Demand	Anodyne	HCRTR2	15	43
O=C(O)c1csc(CN2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159273	EH	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(O)c1csc(CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159274	EH	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(O)c1csc(CN2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159275	EH	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(O)c1csc(CN2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159276	EH	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
CN(CCOc1ccc(C(F)(F)F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872159280	FH	On-Demand	Anodyne	PPARA	28	40
CN(CCOc1ccc(C(F)(F)F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872159280	FH	On-Demand	Anodyne	PPARD	61	40
CN(CCOc1ccc(C(F)(F)F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872159280	FH	On-Demand	Anodyne	SLC6A9	22	45
CN(CCOc1ccc(C(F)(F)F)cc1)Cc1cc(C(=O)O)cs1	ZINC000872159280	FH	On-Demand	Anodyne	PLA2G4B	45	33
COc1cccc([C@@H](C(=O)O)N2CCC(O)(c3cccc(C)c3C)CC2)c1	ZINC000872159283	FG	On-Demand	Anodyne	OPRL1	23	51
COc1cccc([C@H](C(=O)O)N2CCC(O)(c3cccc(C)c3C)CC2)c1	ZINC000872159285	FG	On-Demand	Anodyne	OPRL1	23	51
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	DRD2	17	44
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	DRD4	58	41
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	ACHE	18	43
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	SLC6A1	56	38
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	HRH1	19	43
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	SIGMAR1	34	43
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	CCR3	54	41
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	SLC18A3	32	41
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	MLNR	53	38
Cc1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000872159305	EH	On-Demand	Anodyne	MCHR1	41	40
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159307	FG	On-Demand	Anodyne	SLC18A2	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159307	FG	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159307	FG	On-Demand	Anodyne	CHRNA10	38	41
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159307	FG	On-Demand	Anodyne	Q8WSF8_APLCA	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159307	FG	On-Demand	Anodyne	ACKR3	53	34
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159309	FG	On-Demand	Anodyne	SLC18A2	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159309	FG	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159309	FG	On-Demand	Anodyne	CHRNA10	38	41
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159309	FG	On-Demand	Anodyne	Q8WSF8_APLCA	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000872159309	FG	On-Demand	Anodyne	ACKR3	53	34
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159311	FG	On-Demand	Anodyne	SLC18A2	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159311	FG	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159311	FG	On-Demand	Anodyne	CHRNA10	38	41
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159311	FG	On-Demand	Anodyne	Q8WSF8_APLCA	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159311	FG	On-Demand	Anodyne	ACKR3	53	34
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159313	FG	On-Demand	Anodyne	SLC18A2	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159313	FG	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159313	FG	On-Demand	Anodyne	CHRNA10	38	41
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159313	FG	On-Demand	Anodyne	Q8WSF8_APLCA	23	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000872159313	FG	On-Demand	Anodyne	ACKR3	53	34
COc1cccc([C@H](C(=O)O)N2CC[C@@H](OC)C2)c1	ZINC000872159315	CD	On-Demand	Anodyne	CCR3	20	43
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](OC)C2)c1	ZINC000872159316	CD	On-Demand	Anodyne	CCR3	20	43
C[C@@H](Cc1ccc(Cl)cc1)N(C)Cc1cc(C(=O)O)cs1	ZINC000872159326	DI	On-Demand	Anodyne	UL54	54	35
CCN(CC(=O)O)Cc1cnc(-c2ccccc2)nc1	ZINC000872159338	CE	On-Demand	Anodyne	TSPO	23	43
O=C(O)c1ccc(S(=O)(=O)N2CCN(CCCC3CC3)CC2)cc1	ZINC000872159355	FD	On-Demand	Anodyne	APP	19	40
O=C(O)c1ccc(S(=O)(=O)N2CCN(CCCC3CC3)CC2)cc1	ZINC000872159355	FD	On-Demand	Anodyne	TGM2	81	46
O=C(O)c1ccc(S(=O)(=O)N2CCN(CCCC3CC3)CC2)cc1	ZINC000872159355	FD	On-Demand	Anodyne	F13A1	80	46
O=C(O)c1ccc(S(=O)(=O)N2CCN(CCCC3CC3)CC2)cc1	ZINC000872159355	FD	On-Demand	Anodyne	AKR1C3	40	34
O=C(O)c1ccc(S(=O)(=O)N2CCN(CCCC3CC3)CC2)cc1	ZINC000872159355	FD	On-Demand	Anodyne	CYP2J2	49	34
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(Cc1nc3c(o1)CCCC3)CC2	ZINC000872159387	GG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(Cc1nc3c(o1)CCCC3)CC2	ZINC000872159387	GG	On-Demand	Anodyne	HCRTR1	15	42
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	DRD2	20	48
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	DRD4	47	43
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	ACHE	53	48
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	GRIN2B	40	38
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	HRH3	18	44
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	SIGMAR1	64	58
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	SSTR5	40	39
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	FAAH	20	47
O=C(O)CC1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872159392	DF	On-Demand	Anodyne	MCHR1	25	41
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H]1CCC(C)(C)CO1)CC2	ZINC000872159419	GG	On-Demand	Anodyne	SLC18A2	49	37
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	DRD4	21	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	ACHE	43	45
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	HRH1	17	41
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	SIGMAR1	45	46
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	CCR3	44	41
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	MCHR1	15	43
O=C(O)c1csc(CN2CCC(Cc3ccccc3F)CC2)c1	ZINC000872159420	EI	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1csc(CN2CCC(OCc3ccc(F)cc3)CC2)c1	ZINC000872159421	EH	On-Demand	Anodyne	SIGMAR1	30	42
O=C(O)c1csc(CN2CCC(OCc3ccc(F)cc3)CC2)c1	ZINC000872159421	EH	On-Demand	Anodyne	CCR3	45	40
O=C(O)c1csc(CN2CCC(OCc3ccc(F)cc3)CC2)c1	ZINC000872159421	EH	On-Demand	Anodyne	LIPG	42	47
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H]1CCC(C)(C)CO1)CC2	ZINC000872159422	GG	On-Demand	Anodyne	SLC18A2	49	37
O=C(O)c1csc(CN2CCN(c3cc(F)ccc3F)CC2)c1	ZINC000872159433	EG	On-Demand	Anodyne	HTR1A	15	47
O=C(O)c1csc(CN2CCN(c3cc(F)ccc3F)CC2)c1	ZINC000872159433	EG	On-Demand	Anodyne	DRD4	19	43
O=C(O)c1csc(CN2CC[C@H](OCCCc3ccccc3)C2)c1	ZINC000872159436	EH	On-Demand	Anodyne	SIGMAR1	52	55
O=C(O)c1csc(CN2CC[C@H](OCCCc3ccccc3)C2)c1	ZINC000872159436	EH	On-Demand	Anodyne	CYP2J2	45	34
O=C(O)c1csc(CN2CC[C@@H](OCCCc3ccccc3)C2)c1	ZINC000872159437	EH	On-Demand	Anodyne	SIGMAR1	52	55
O=C(O)c1csc(CN2CC[C@@H](OCCCc3ccccc3)C2)c1	ZINC000872159437	EH	On-Demand	Anodyne	CYP2J2	45	34
O=C(O)c1csc(CN2CCC[C@@H]2CCCc2ccccc2)c1	ZINC000872159438	EI	On-Demand	Anodyne	SLC18A2	44	44
O=C(O)c1csc(CN2CCC[C@@H]2CCCc2ccccc2)c1	ZINC000872159438	EI	On-Demand	Anodyne	SIGMAR1	23	40
O=C(O)c1csc(CN2CCC[C@@H]2CCCc2ccccc2)c1	ZINC000872159438	EI	On-Demand	Anodyne	PREP	50	38
O=C(O)c1csc(CN2CCC[C@H]2CCCc2ccccc2)c1	ZINC000872159439	EI	On-Demand	Anodyne	SLC18A2	44	44
O=C(O)c1csc(CN2CCC[C@H]2CCCc2ccccc2)c1	ZINC000872159439	EI	On-Demand	Anodyne	SIGMAR1	23	40
O=C(O)c1csc(CN2CCC[C@H]2CCCc2ccccc2)c1	ZINC000872159439	EI	On-Demand	Anodyne	PREP	50	38
C=CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159457	CG	On-Demand	Mild	DRD4	41	39
C=CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159457	CG	On-Demand	Mild	ACHE	28	44
C=CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159457	CG	On-Demand	Mild	SSTR5	40	38
C=CC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159457	CG	On-Demand	Mild	MCHR1	37	40
O=C(O)c1csc(CN2CCC3(CCc4ccccc4C3)CC2)c1	ZINC000872159497	EI	On-Demand	Anodyne	SIGMAR1	34	57
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	DRD4	32	43
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	ACHE	15	43
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	SIGMAR1	23	42
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	SSTR5	51	39
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	CCR3	33	47
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	UTS2R	21	41
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	MCHR1	37	45
Cc1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(=O)O	ZINC000872159500	DC	On-Demand	Anodyne	CCR8	55	35
Cc1ccc(CN2CCO[C@H](c3c(F)cccc3Cl)C2)cc1C(=O)O	ZINC000872159505	FI	On-Demand	Anodyne	DRD4	34	44
C[C@H](CN1Cc2ccccc2C[C@H]1C(=O)O)CC(C)(C)C	ZINC000872159512	CH	On-Demand	Anodyne	ACE	45	50
C[C@H](CN1Cc2ccccc2C[C@H]1C(=O)O)CC(C)(C)C	ZINC000872159512	CH	On-Demand	Anodyne	OPRM1	17	43
C[C@H](CN1Cc2ccccc2C[C@H]1C(=O)O)CC(C)(C)C	ZINC000872159512	CH	On-Demand	Anodyne	OPRD1	52	43
C[C@H](CN1Cc2ccccc2C[C@H]1C(=O)O)CC(C)(C)C	ZINC000872159512	CH	On-Demand	Anodyne	ADAM9	55	35
C[C@H](CN1Cc2ccccc2C[C@H]1C(=O)O)CC(C)(C)C	ZINC000872159512	CH	On-Demand	Anodyne	TPP2	51	33
C[C@H](CN1Cc2ccccc2C[C@@H]1C(=O)O)CC(C)(C)C	ZINC000872159518	CH	On-Demand	Anodyne	ACE	45	50
C[C@H](CN1Cc2ccccc2C[C@@H]1C(=O)O)CC(C)(C)C	ZINC000872159518	CH	On-Demand	Anodyne	OPRM1	17	43
C[C@H](CN1Cc2ccccc2C[C@@H]1C(=O)O)CC(C)(C)C	ZINC000872159518	CH	On-Demand	Anodyne	OPRD1	52	43
C[C@H](CN1Cc2ccccc2C[C@@H]1C(=O)O)CC(C)(C)C	ZINC000872159518	CH	On-Demand	Anodyne	ADAM9	55	35
C[C@H](CN1Cc2ccccc2C[C@@H]1C(=O)O)CC(C)(C)C	ZINC000872159518	CH	On-Demand	Anodyne	TPP2	51	33
Cc1ccc(CN2CC[C@@](C)(CCc3ccccc3)C2)cc1C(=O)O	ZINC000872159521	EJ	On-Demand	Anodyne	MCHR2	66	32
COc1cccc([C@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159530	GI	On-Demand	Anodyne	TACR1	19	44
COc1cccc([C@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159530	GI	On-Demand	Anodyne	CCR5	61	36
COc1cccc([C@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159530	GI	On-Demand	Anodyne	CCR2	35	43
COc1cccc([C@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159530	GI	On-Demand	Anodyne	PDS	40	32
COc1cccc([C@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159531	GI	On-Demand	Anodyne	TACR1	19	44
COc1cccc([C@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159531	GI	On-Demand	Anodyne	CCR5	61	36
COc1cccc([C@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159531	GI	On-Demand	Anodyne	CCR2	35	43
COc1cccc([C@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159531	GI	On-Demand	Anodyne	PDS	40	32
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159533	GI	On-Demand	Anodyne	TACR1	19	44
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159533	GI	On-Demand	Anodyne	CCR5	61	36
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159533	GI	On-Demand	Anodyne	CCR2	35	43
COc1cccc([C@@H](C(=O)O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159533	GI	On-Demand	Anodyne	PDS	40	32
COc1cccc([C@@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159534	GI	On-Demand	Anodyne	TACR1	19	44
COc1cccc([C@@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159534	GI	On-Demand	Anodyne	CCR5	61	36
COc1cccc([C@@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159534	GI	On-Demand	Anodyne	CCR2	35	43
COc1cccc([C@@H](C(=O)O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000872159534	GI	On-Demand	Anodyne	PDS	40	32
CCOC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159565	CF	On-Demand	Anodyne	SLC6A1	92	37
CCOC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159565	CF	On-Demand	Anodyne	SIGMAR1	15	41
CCOC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159565	CF	On-Demand	Anodyne	SSTR5	35	40
CCOC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159565	CF	On-Demand	Anodyne	CCR3	43	39
Cc1ccc(CN2CCO[C@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872159567	EH	On-Demand	Anodyne	DRD4	37	42
Cc1ccc(CN2CCO[C@H](c3ccccc3C)C2)cc1C(=O)O	ZINC000872159567	EH	On-Demand	Anodyne	MCHR2	42	33
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(Cc1nocc1C)CC2	ZINC000872159573	EF	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(Cc1nocc1C)CC2	ZINC000872159573	EF	On-Demand	Anodyne	HCRTR1	15	43
O=C(O)c1csc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000872159607	EG	On-Demand	Anodyne	ADK	15	42
O=C(O)c1csc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000872159607	EG	On-Demand	Anodyne	SIGMAR1	42	38
CN(C)S(=O)(=O)c1cccc2c1CCN(Cc1cc(C(=O)O)cs1)C2	ZINC000872159629	GE	On-Demand	Anodyne	AKR1C3	43	36
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(CCCC1CC1)CC2	ZINC000872159631	EG	On-Demand	Anodyne	DRD1	15	41
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(CCCC1CC1)CC2	ZINC000872159631	EG	On-Demand	Anodyne	SLC18A2	54	39
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(CCCC1CC1)CC2	ZINC000872159631	EG	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(CCCC1CC1)CC2	ZINC000872159631	EG	On-Demand	Anodyne	PPARD	34	40
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(CCCC1CC1)CC2	ZINC000872159631	EG	On-Demand	Anodyne	MTNR1B	20	48
Cc1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1C(=O)O	ZINC000872159659	GI	On-Demand	Anodyne	DRD4	15	44
Cc1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1C(=O)O	ZINC000872159659	GI	On-Demand	Anodyne	CCR2	19	42
Cc1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1C(=O)O	ZINC000872159659	GI	On-Demand	Anodyne	LIPG	46	36
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	HTR1A	39	43
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	DRD2	56	48
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	DRD4	85	49
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	ACHE	41	44
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	SLC6A1	53	41
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	HRH1	35	51
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	ADRA1B	28	41
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	DRD3	44	46
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	HTR4	25	40
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	SIGMAR1	53	47
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	SSTR5	67	38
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	CCR3	53	47
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	CCR5	27	41
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	MLNR	44	35
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	MCHR1	37	44
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	CCR8	22	43
COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159670	EH	On-Demand	Anodyne	MBTPS1	54	44
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	HTR1A	39	43
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	DRD2	56	48
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	DRD4	85	49
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	ACHE	41	44
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	SLC6A1	53	41
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	HRH1	35	51
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	ADRA1B	28	41
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	DRD3	44	46
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	HTR4	25	40
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	SIGMAR1	53	47
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	SSTR5	67	38
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	CCR3	53	47
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	CCR5	27	41
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	MLNR	44	35
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	MCHR1	37	44
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	CCR8	22	43
COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872159671	EH	On-Demand	Anodyne	MBTPS1	54	44
O=C(O)c1csc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000872159682	EG	On-Demand	Anodyne	DRD4	21	65
O=C(O)c1csc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000872159684	EG	On-Demand	Anodyne	DRD4	21	65
O=C(O)c1csc(CN2CCC(c3ccccc3Br)CC2)c1	ZINC000872159707	GJ	On-Demand	Anodyne	HRH1	19	42
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	DRD2	40	45
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	DRD4	60	43
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	ACHE	47	49
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	HRH1	27	45
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	DRD3	35	43
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	HTR4	19	43
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	TACR1	18	41
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	SIGMAR1	45	51
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	SSTR5	71	40
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	CCR3	50	47
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	MCHR1	37	46
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	CCR8	30	46
COc1ccccc1COC1CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159708	FH	On-Demand	Anodyne	MBTPS1	58	40
O=C(O)c1csc(CN2CCC(Oc3cccc(Br)c3)CC2)c1	ZINC000872159729	GI	On-Demand	Anodyne	HRH1	24	46
O=C(O)c1csc(CN2CCC(Oc3cccc(Br)c3)CC2)c1	ZINC000872159729	GI	On-Demand	Anodyne	CCR3	28	46
O=C(O)c1csc(CN2CCN(c3ccc(F)cc3Cl)CC2)c1	ZINC000872159736	FH	On-Demand	Anodyne	DRD2	19	46
O=C(O)c1csc(CN2CCN(c3ccc(F)cc3Cl)CC2)c1	ZINC000872159736	FH	On-Demand	Anodyne	DRD4	27	41
O=C(O)c1csc(CN2CCN(c3ccc(F)cc3Cl)CC2)c1	ZINC000872159736	FH	On-Demand	Anodyne	DRD3	21	41
O=C(O)c1csc(CN2CCN(c3ccc(F)cc3Cl)CC2)c1	ZINC000872159736	FH	On-Demand	Anodyne	NPY2R	34	48
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	HTR1A	17	42
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	DRD2	21	42
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	ACHE	31	42
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	SIGMAR1	28	46
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	SSTR5	26	40
COc1ccccc1COC1CCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872159737	FH	On-Demand	Anodyne	MBTPS1	43	35
C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1Cc1cc(C(=O)O)cs1	ZINC000872159763	FI	On-Demand	Anodyne	MDM2	66	33
C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1Cc1cc(C(=O)O)cs1	ZINC000872159764	FI	On-Demand	Anodyne	MDM2	66	33
COc1ccccc1-c1nc(CN2CCC3(CC2)C[C@H]3C(=O)O)co1	ZINC000872159783	EG	On-Demand	Anodyne	DRD2	15	52
COc1ccccc1-c1nc(CN2CCC3(CC2)C[C@H]3C(=O)O)co1	ZINC000872159783	EG	On-Demand	Anodyne	DRD3	17	52
COc1ccccc1-c1nc(CN2CCC3(CC2)C[C@@H]3C(=O)O)co1	ZINC000872159784	EG	On-Demand	Anodyne	DRD2	15	52
COc1ccccc1-c1nc(CN2CCC3(CC2)C[C@@H]3C(=O)O)co1	ZINC000872159784	EG	On-Demand	Anodyne	DRD3	17	52
O=C(O)CN(Cc1cc(C(F)(F)F)co1)C1CCCCC1	ZINC000872159802	DH	On-Demand	Anodyne	ACE	48	33
CC1(C)CC[C@@H](CN2Cc3ccccc3C[C@H]2C(=O)O)OC1	ZINC000872159810	DF	On-Demand	Anodyne	ACE	22	41
CC1(C)CC[C@@H](CN2Cc3ccccc3C[C@H]2C(=O)O)OC1	ZINC000872159810	DF	On-Demand	Anodyne	ADAM9	54	35
CC1(C)CC[C@@H](CN2Cc3ccccc3C[C@@H]2C(=O)O)OC1	ZINC000872159812	DF	On-Demand	Anodyne	ACE	22	41
CC1(C)CC[C@@H](CN2Cc3ccccc3C[C@@H]2C(=O)O)OC1	ZINC000872159812	DF	On-Demand	Anodyne	ADAM9	54	35
COc1ccccc1-c1nc(CN2CCC(CC(=O)O)CC2)co1	ZINC000872159821	EG	On-Demand	Anodyne	DRD2	21	53
COc1ccccc1-c1nc(CN2CCC(CC(=O)O)CC2)co1	ZINC000872159821	EG	On-Demand	Anodyne	DRD4	31	53
COc1ccccc1-c1nc(CN2CCC(CC(=O)O)CC2)co1	ZINC000872159821	EG	On-Demand	Anodyne	ACHE	29	43
COc1ccccc1-c1nc(CN2CCC(CC(=O)O)CC2)co1	ZINC000872159821	EG	On-Demand	Anodyne	DRD3	17	52
COc1ccccc1-c1nc(CN2CCC(CC(=O)O)CC2)co1	ZINC000872159821	EG	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)ccc1F	ZINC000872159835	FG	On-Demand	Anodyne	DRD2	42	43
COc1cc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)ccc1F	ZINC000872159835	FG	On-Demand	Anodyne	DRD4	61	47
COc1cc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)ccc1F	ZINC000872159835	FG	On-Demand	Anodyne	HTR2A	16	48
COc1cc(N2CCN(Cc3ccc(C)c(C(=O)O)c3)CC2)ccc1F	ZINC000872159835	FG	On-Demand	Anodyne	DRD3	45	43
O=C(O)CN(CCCC1CC1)Cc1ccc(C(F)(F)F)cc1	ZINC000872159840	DH	On-Demand	Anodyne	ERG7	23	44
O=C(O)CN(CCCC1CC1)Cc1ccc(C(F)(F)F)cc1	ZINC000872159840	DH	On-Demand	Anodyne	CAS1	28	46
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	DRD2	24	50
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	DRD4	27	50
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	SLC6A1	178	50
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	DRD3	24	50
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	S1PR1	38	40
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	S1PR5	40	38
COc1ccccc1-c1nc(CN2CCC[C@@H](C(=O)O)C2)co1	ZINC000872159863	DF	On-Demand	Anodyne	PDE8B	40	31
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	DRD2	24	50
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	DRD4	27	50
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	SLC6A1	178	50
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	DRD3	24	50
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	S1PR1	38	40
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	S1PR5	40	38
COc1ccccc1-c1nc(CN2CCC[C@H](C(=O)O)C2)co1	ZINC000872159864	DF	On-Demand	Anodyne	PDE8B	40	31
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)CC(C)(C)C)CC2	ZINC000872159871	FI	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)CC(C)(C)C)CC2	ZINC000872159871	FI	On-Demand	Anodyne	HCRTR1	15	46
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@H](C)CC(C)(C)C)CC2	ZINC000872159871	FI	On-Demand	Anodyne	MTNR1B	16	48
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)CC(C)(C)C)CC2	ZINC000872159872	FI	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)CC(C)(C)C)CC2	ZINC000872159872	FI	On-Demand	Anodyne	HCRTR1	15	46
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H](C)CC(C)(C)C)CC2	ZINC000872159872	FI	On-Demand	Anodyne	MTNR1B	16	48
O=C(O)CN(CCCC1CC1)C1CCCCC1	ZINC000872159914	BF	On-Demand	Anodyne	ACE	48	35
COc1cc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)ccc1F	ZINC000872159930	FF	On-Demand	Anodyne	HTR1A	28	43
COc1cc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)ccc1F	ZINC000872159930	FF	On-Demand	Anodyne	DRD2	23	43
COc1cc(N2CCN(Cc3cc(C(=O)O)cs3)CC2)ccc1F	ZINC000872159930	FF	On-Demand	Anodyne	DRD3	25	40
CCC1(CC)CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872159937	DI	On-Demand	Anodyne	MCHR2	60	34
O=C(O)CN(Cc1coc(C2CC2)n1)C1CCCCC1	ZINC000872159940	CF	On-Demand	Anodyne	ACE	46	33
O=C(O)[C@@H]1CCCN(Cc2cc(C(F)(F)F)co2)C1	ZINC000872159952	CF	On-Demand	Anodyne	SLC6A1	169	44
O=C(O)[C@H]1CCCN(Cc2cc(C(F)(F)F)co2)C1	ZINC000872159953	CF	On-Demand	Anodyne	SLC6A1	169	44
Cc1conc1CN(C)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872159976	CE	On-Demand	Anodyne	CPA1	46	33
Cc1conc1CN(C)[C@H](Cc1ccccc1)C(=O)O	ZINC000872159977	CE	On-Demand	Anodyne	CPA1	46	33
CC1(C)CC[C@@H](CN2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)OC1	ZINC000872159987	GD	On-Demand	Anodyne	RARG	40	30
CC1(C)CC[C@@H](CN2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)OC1	ZINC000872159987	GD	On-Demand	Anodyne	RXRB	40	34
CC1(C)CC[C@@H](CN2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)OC1	ZINC000872159987	GD	On-Demand	Anodyne	TGM2	64	36
CC1(C)CC[C@@H](CN2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)OC1	ZINC000872159987	GD	On-Demand	Anodyne	F13A1	54	34
COc1ccccc1-c1nc(CN2CCCC[C@H]2CC(=O)O)co1	ZINC000872160006	EG	On-Demand	Anodyne	ACKR3	42	31
COc1ccccc1-c1nc(CN2CCCC[C@@H]2CC(=O)O)co1	ZINC000872160007	EG	On-Demand	Anodyne	ACKR3	42	31
CN(Cc1coc(C2CC2)n1)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872160008	DF	On-Demand	Anodyne	CPA1	40	35
CN(Cc1coc(C2CC2)n1)[C@H](Cc1ccccc1)C(=O)O	ZINC000872160009	DF	On-Demand	Anodyne	CPA1	40	35
CN(CCCC1CC1)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872160015	CF	On-Demand	Anodyne	MME	63	42
CN(CCCC1CC1)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872160015	CF	On-Demand	Anodyne	ANPEP	17	42
CN(CCCC1CC1)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872160015	CF	On-Demand	Anodyne	CPA1	46	38
CN(CCCC1CC1)[C@@H](Cc1ccccc1)C(=O)O	ZINC000872160015	CF	On-Demand	Anodyne	AMY2	47	34
CN(CCCC1CC1)[C@H](Cc1ccccc1)C(=O)O	ZINC000872160016	CF	On-Demand	Anodyne	MME	63	42
CN(CCCC1CC1)[C@H](Cc1ccccc1)C(=O)O	ZINC000872160016	CF	On-Demand	Anodyne	ANPEP	17	42
CN(CCCC1CC1)[C@H](Cc1ccccc1)C(=O)O	ZINC000872160016	CF	On-Demand	Anodyne	CPA1	46	38
CN(CCCC1CC1)[C@H](Cc1ccccc1)C(=O)O	ZINC000872160016	CF	On-Demand	Anodyne	AMY2	47	34
CC1(C)CC[C@@H](CN(CC(=O)O)Cc2ccc(Cl)cc2)OC1	ZINC000872160032	EG	On-Demand	Anodyne	FFAR2	40	41
O=C(O)CN(Cc1cnc(-c2ccccc2)nc1)C1CCCCC1	ZINC000872160045	EG	On-Demand	Anodyne	ACE	54	41
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H]1C[C@H](OC)C1)CC2	ZINC000872160084	EF	On-Demand	Anodyne	SLC18A2	54	40
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H]1C[C@H](OC)C1)CC2	ZINC000872160084	EF	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C[C@@H]1C[C@H](OC)C1)CC2	ZINC000872160084	EF	On-Demand	Anodyne	MTNR1B	15	46
COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(Cc1coc(C3CC3)n1)CC2	ZINC000872160093	FG	On-Demand	Anodyne	SLC18A2	40	33
Cc1conc1CN(CC(=O)O)C1CCCCC1	ZINC000872160105	CE	On-Demand	Anodyne	ACE	49	37
O=C(O)[C@@H]1CN(Cc2cc(C(F)(F)F)co2)C[C@@H]1c1ccccc1	ZINC000872160120	EH	On-Demand	Anodyne	TACR1	22	43
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160121	EF	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160121	EF	On-Demand	Anodyne	DRD4	32	51
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160121	EF	On-Demand	Anodyne	DRD3	27	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160122	EF	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160122	EF	On-Demand	Anodyne	DRD4	32	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)co1	ZINC000872160122	EF	On-Demand	Anodyne	DRD3	27	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160123	EF	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160123	EF	On-Demand	Anodyne	DRD4	32	51
COc1ccccc1-c1nc(CN2CC[C@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160123	EF	On-Demand	Anodyne	DRD3	27	51
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160124	EF	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160124	EF	On-Demand	Anodyne	DRD4	32	51
COc1ccccc1-c1nc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)co1	ZINC000872160124	EF	On-Demand	Anodyne	DRD3	27	51
C#CC[C@H]1CCCN([C@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160136	CF	On-Demand	Mild	DRD4	40	31
C#CC[C@H]1CCCN([C@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160136	CF	On-Demand	Mild	CCR3	15	48
C#CC[C@@H]1CCCN([C@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160137	CF	On-Demand	Mild	DRD4	40	31
C#CC[C@@H]1CCCN([C@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160137	CF	On-Demand	Mild	CCR3	15	48
C#CC[C@@H]1CCCN([C@@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160138	CF	On-Demand	Mild	DRD4	40	31
C#CC[C@@H]1CCCN([C@@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160138	CF	On-Demand	Mild	CCR3	15	48
C#CC[C@H]1CCCN([C@@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160139	CF	On-Demand	Mild	DRD4	40	31
C#CC[C@H]1CCCN([C@@H](C(=O)O)c2cccc(OC)c2)C1	ZINC000872160139	CF	On-Demand	Mild	CCR3	15	48
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H](C(=O)O)O1	ZINC000872160144	DD	On-Demand	Anodyne	S1PR4	20	43
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H](C(=O)O)O1	ZINC000872160144	DD	On-Demand	Anodyne	S1PR1	29	43
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H](C(=O)O)O1	ZINC000872160144	DD	On-Demand	Anodyne	S1PR5	42	43
C[C@H]1CN(Cc2cc(C(F)(F)F)co2)CC[C@H]1C(=O)O	ZINC000872160157	CF	On-Demand	Anodyne	LIPG	42	32
C[C@@H]1CN(Cc2cc(C(F)(F)F)co2)CC[C@@H]1C(=O)O	ZINC000872160158	CF	On-Demand	Anodyne	LIPG	42	32
C[C@H]1CN(Cc2cc(C(F)(F)F)co2)CC[C@@H]1C(=O)O	ZINC000872160159	CF	On-Demand	Anodyne	LIPG	42	32
C[C@@H]1CN(Cc2cc(C(F)(F)F)co2)CC[C@H]1C(=O)O	ZINC000872160160	CF	On-Demand	Anodyne	LIPG	42	32
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@@H]1c1ccccc1	ZINC000872160167	CF	On-Demand	Anodyne	SLC6A3	22	42
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@@H]1c1ccccc1	ZINC000872160167	CF	On-Demand	Anodyne	CCR5	30	44
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@@H]1c1ccccc1	ZINC000872160167	CF	On-Demand	Anodyne	CYP2J2	45	31
O=C(O)c1csc(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1	ZINC000872160173	FI	On-Demand	Anodyne	HTR1A	16	44
O=C(O)c1csc(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1	ZINC000872160173	FI	On-Demand	Anodyne	DRD4	36	60
O=C(O)c1csc(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1	ZINC000872160173	FI	On-Demand	Anodyne	DRD3	16	60
O=C(O)c1csc(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1	ZINC000872160173	FI	On-Demand	Anodyne	BCL2A1	48	39
O=C(O)c1csc(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1	ZINC000872160173	FI	On-Demand	Anodyne	RPA1	48	37
CO[C@@H]1CC[C@@H](C)N(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872160236	DD	On-Demand	Anodyne	ABCB1	33	41
CO[C@@H]1CC[C@@H](C)N(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872160238	DD	On-Demand	Anodyne	ABCB1	33	41
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@@H](C(=O)O)O1	ZINC000872160240	DD	On-Demand	Anodyne	S1PR4	20	43
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@@H](C(=O)O)O1	ZINC000872160240	DD	On-Demand	Anodyne	S1PR1	29	43
C[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@@H](C(=O)O)O1	ZINC000872160240	DD	On-Demand	Anodyne	S1PR5	42	43
COc1ccccc1-c1nc(CN2CCC(n3ncc(C(=O)O)c3C)CC2)co1	ZINC000872160247	GG	On-Demand	Anodyne	DRD2	15	49
COc1ccccc1-c1nc(CN2CCC(n3ncc(C(=O)O)c3C)CC2)co1	ZINC000872160247	GG	On-Demand	Anodyne	DRD4	29	49
COc1ccccc1-c1nc(CN2CCC(n3ncc(C(=O)O)c3C)CC2)co1	ZINC000872160247	GG	On-Demand	Anodyne	DRD3	19	47
C[C@@H]1CN(CCCCOc2ccccc2)C[C@@]1(C)C(=O)O	ZINC000872160251	CF	On-Demand	Anodyne	LTA4H	46	39
C[C@@H]1CN(CCCCOc2ccccc2)C[C@@]1(C)C(=O)O	ZINC000872160251	CF	On-Demand	Anodyne	CYSLTR2	65	35
C[C@@H]1CN(CCCCOc2ccccc2)C[C@@]1(C)C(=O)O	ZINC000872160251	CF	On-Demand	Anodyne	HRH3	47	47
C[C@@H]1CN(CCCCOc2ccccc2)C[C@@]1(C)C(=O)O	ZINC000872160251	CF	On-Demand	Anodyne	PLA2G4B	58	33
C[C@@H]1CN(CCCCOc2ccccc2)C[C@@]1(C)C(=O)O	ZINC000872160251	CF	On-Demand	Anodyne	EPHX2	21	40
CCOC[C@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872160283	CD	On-Demand	Anodyne	DRD4	23	49
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	HRH1	32	46
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	SIGMAR1	18	40
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	CCR3	53	46
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	CCR5	51	34
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	MLNR	16	45
O=C(O)c1csc(CN2CCC(Oc3cccc(F)c3)CC2)c1	ZINC000872160295	EH	On-Demand	Anodyne	SCD1	15	41
C[C@@H]1CN(Cc2cc3ccccc3s2)C[C@@]1(C)C(=O)O	ZINC000872160297	CG	On-Demand	Anodyne	AROQ	29	43
C[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@@]1(C)C(=O)O	ZINC000872160315	CE	On-Demand	Anodyne	MCHR2	45	31
C/C(=C\CN(C)Cc1ccccc1OCc1ccccc1)C(=O)O	ZINC000872160318	EH	On-Demand	Anodyne	PTGER2	17	43
C/C(=C\CN(C)Cc1ccccc1OCc1ccccc1)C(=O)O	ZINC000872160318	EH	On-Demand	Anodyne	PTGER1	42	43
C/C(=C/CN(C)Cc1ccccc1OCc1ccccc1)C(=O)O	ZINC000872160330	EH	On-Demand	Anodyne	PTGER2	17	43
C/C(=C/CN(C)Cc1ccccc1OCc1ccccc1)C(=O)O	ZINC000872160330	EH	On-Demand	Anodyne	PTGER1	42	43
CO[C@@H]1CC[C@@H](C)N(CCc2ccccc2C(=O)O)C1	ZINC000872160349	CE	On-Demand	Anodyne	SLC6A1	64	34
CO[C@@H]1CC[C@@H](C)N(CCc2ccccc2C(=O)O)C1	ZINC000872160349	CE	On-Demand	Anodyne	HRH3	15	45
CO[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C(=O)O)C1	ZINC000872160362	CE	On-Demand	Anodyne	SLC6A1	50	34
CO[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C(=O)O)C1	ZINC000872160362	CE	On-Demand	Anodyne	HRH1	16	45
CO[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C(=O)O)C1	ZINC000872160362	CE	On-Demand	Anodyne	HCN1	53	32
CO[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C(=O)O)C1	ZINC000872160362	CE	On-Demand	Anodyne	HCN4	41	32
CC1(C)CC[C@@H](CN(CCCC(=O)O)Cc2ccccc2)OC1	ZINC000872160371	DH	On-Demand	Anodyne	FFAR2	54	33
Cc1conc1CN1C[C@@H](C(=O)O)[C@@H](c2ccccc2)C1	ZINC000872160375	CE	On-Demand	Anodyne	PDE8B	54	32
CN(Cc1ccc(OCC(=O)O)cc1)Cc1cc(C(F)(F)F)co1	ZINC000872160408	EG	On-Demand	Anodyne	PPARA	16	40
CN(Cc1ccc(OCC(=O)O)cc1)Cc1cc(C(F)(F)F)co1	ZINC000872160408	EG	On-Demand	Anodyne	PPARD	66	46
C[C@@H]1CN(C[C@H](O)c2cccc(Cl)c2)C[C@@]1(C)C(=O)O	ZINC000872160469	CE	On-Demand	Anodyne	ADRB3	35	40
C[C@@H]1CN(C[C@@H](O)c2cccc(Cl)c2)C[C@@]1(C)C(=O)O	ZINC000872160471	CE	On-Demand	Anodyne	ADRB3	35	40
COc1ccccc1-c1nc(CN2CCN(C(C)(C)C(=O)O)CC2)co1	ZINC000872160479	FE	On-Demand	Anodyne	DRD2	22	56
COc1ccccc1-c1nc(CN2CCN(C(C)(C)C(=O)O)CC2)co1	ZINC000872160479	FE	On-Demand	Anodyne	DRD4	21	56
COc1ccccc1-c1nc(CN2CCN(C(C)(C)C(=O)O)CC2)co1	ZINC000872160479	FE	On-Demand	Anodyne	DRD3	26	55
CO[C@@H]1CC[C@@H](C)N(Cc2ccc3oc(C(=O)O)cc3c2)C1	ZINC000872160488	DG	On-Demand	Anodyne	HRH3	28	41
O=C(O)Cc1ccccc1CN1CCC2(CCSCC2)CC1	ZINC000872160492	DG	On-Demand	Anodyne	CCR8	43	44
COC[C@]1(C(=O)O)CCCN(CCCC2CC2)C1	ZINC000872160508	CD	On-Demand	Anodyne	EBP	24	49
Cc1ccc(CN2CC[C@@](C(=O)O)(c3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000872160532	EG	On-Demand	Bother	ADRA1B	17	42
Cc1ccc(CN2CC[C@@](C(=O)O)(c3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000872160532	EG	On-Demand	Bother	MCHR2	50	33
Cc1ccc(CN2CC[C@@](C(=O)O)(c3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000872160532	EG	On-Demand	Bother	CCR8	20	42
COc1ccccc1-c1nc(CN2CCC[C@@H](CCC(=O)O)C2)co1	ZINC000872160563	EG	On-Demand	Anodyne	DRD4	19	49
COc1ccccc1-c1nc(CN2CCC[C@H](CCC(=O)O)C2)co1	ZINC000872160564	EG	On-Demand	Anodyne	DRD4	19	49
O=C(O)C[C@@H]1CCCN1Cc1cnc(-c2ccccc2)nc1	ZINC000872160565	CF	On-Demand	Anodyne	PREP	48	35
O=C(O)C[C@H]1CCCN1Cc1cnc(-c2ccccc2)nc1	ZINC000872160566	CF	On-Demand	Anodyne	PREP	48	35
CC(C)c1ccc(CN2CCC(n3nnc(C(=O)O)c3C(F)F)CC2)cc1	ZINC000872160581	GH	On-Demand	Anodyne	DRD4	18	43
CO[C@@H]1CC[C@@H](C)N(CCOc2cccc(C(=O)O)c2)C1	ZINC000872160588	CE	On-Demand	Anodyne	DRD4	43	33
CO[C@@H]1CC[C@@H](C)N(CCOc2cccc(C(=O)O)c2)C1	ZINC000872160588	CE	On-Demand	Anodyne	HRH2	20	44
CO[C@@H]1CC[C@@H](C)N(CCOc2cccc(C(=O)O)c2)C1	ZINC000872160588	CE	On-Demand	Anodyne	LTA4H	15	41
CO[C@@H]1CC[C@@H](C)N(CCOc2cccc(C(=O)O)c2)C1	ZINC000872160588	CE	On-Demand	Anodyne	PLA2G4B	49	45
Cc1ccc(CN2CC[C@@H](c3cccc(F)c3)C2(C)C)cc1C(=O)O	ZINC000872160620	EJ	On-Demand	Anodyne	FABP4	24	42
Cc1ccc(CN2CC[C@@H](c3cccc(F)c3)C2(C)C)cc1C(=O)O	ZINC000872160620	EJ	On-Demand	Anodyne	CCR5	60	32
C[C@H](CN1CCc2ccc(C(=O)O)cc2C1)CC(C)(C)C	ZINC000872160636	CH	On-Demand	Anodyne	AKR1C3	40	37
C[C@H](CN1C[C@@H](C)O[C@@H](C(=O)O)C1)CC(C)(C)C	ZINC000872160653	CE	On-Demand	Anodyne	ERG2	18	43
C[C@H](CN1C[C@@H](C)O[C@@H](C(=O)O)C1)CC(C)(C)C	ZINC000872160653	CE	On-Demand	Anodyne	Q2TU57_MAIZE	20	43
O=C(O)[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H]1C1CC1	ZINC000872160687	DF	On-Demand	Anodyne	S1PR4	18	42
O=C(O)[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H]1C1CC1	ZINC000872160687	DF	On-Demand	Anodyne	S1PR1	20	42
O=C(O)[C@@H]1CN(Cc2cnc(-c3ccccc3)nc2)C[C@H]1C1CC1	ZINC000872160687	DF	On-Demand	Anodyne	S1PR5	37	42
COc1ccccc1-c1nc(CN2CCC[C@@H]2CC(=O)O)co1	ZINC000872160703	DF	On-Demand	Anodyne	ACKR3	63	33
COc1ccccc1-c1nc(CN2CCC[C@H]2CC(=O)O)co1	ZINC000872160704	DF	On-Demand	Anodyne	ACKR3	63	33
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	DRD4	33	47
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	ACHE	33	41
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	SIGMAR1	34	45
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	PIK3CA	21	47
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	FAAH	17	41
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	MTOR	31	47
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	CXCR3	22	40
O=C(O)c1cnn(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)c1	ZINC000872160715	FF	On-Demand	Anodyne	MCHR1	17	40
C#CC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872160720	CF	On-Demand	Mild	SLC6A1	99	39
C#CC[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872160721	CF	On-Demand	Mild	SLC6A1	99	39
O=C(O)c1nnn(C2CCN(CCOc3cccc(F)c3)CC2)c1C(F)F	ZINC000872160756	GF	On-Demand	Anodyne	CCR5	57	33
O=C(O)c1nnn(C2CCN(CCOc3cccc(F)c3)CC2)c1C(F)F	ZINC000872160756	GF	On-Demand	Anodyne	CHRNA10	30	40
C[C@@H]1CN(Cc2cnc(-c3ccccc3)s2)C[C@@]1(C)C(=O)O	ZINC000872160785	DG	On-Demand	Anodyne	S1PR1	18	41
C[C@@H]1CN(Cc2cnc(-c3ccccc3)s2)C[C@@]1(C)C(=O)O	ZINC000872160785	DG	On-Demand	Anodyne	MGEA5	34	40
O=C(O)c1csc(CN2CCC[C@@H](c3ccc(F)c(F)c3)C2)c1	ZINC000872160791	EI	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)c1csc(CN2CCC[C@H](c3ccc(F)c(F)c3)C2)c1	ZINC000872160792	EI	On-Demand	Anodyne	SLC6A1	47	34
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	OPRM1	20	50
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	OPRK1	19	50
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	SIGMAR1	24	42
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	FAAH	32	48
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	S1PR1	15	40
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	CCR8	29	48
C[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@@]1(C)C(=O)O	ZINC000872160794	EI	On-Demand	Anodyne	CRTM	67	38
O=C(O)c1nnn(C2CCN(CCCCOc3ccccc3)CC2)c1C(F)F	ZINC000872160799	GG	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1nnn(C2CCN(CCCCOc3ccccc3)CC2)c1C(F)F	ZINC000872160799	GG	On-Demand	Anodyne	LTA4H	32	41
O=C(O)c1nnn(C2CCN(CCCCOc3ccccc3)CC2)c1C(F)F	ZINC000872160799	GG	On-Demand	Anodyne	HRH3	53	45
O=C(O)c1nnn(C2CCN(CCCCOc3ccccc3)CC2)c1C(F)F	ZINC000872160799	GG	On-Demand	Anodyne	EPHX2	19	41
O=C(O)c1nnn(C2CCN(CCCCOc3ccccc3)CC2)c1C(F)F	ZINC000872160799	GG	On-Demand	Anodyne	MEN1	45	35
C[C@H](CN1C[C@@H](C(=O)O)O[C@H](C)C1)CC(C)(C)C	ZINC000872160800	CE	On-Demand	Anodyne	ERG2	18	43
C[C@H](CN1C[C@@H](C(=O)O)O[C@H](C)C1)CC(C)(C)C	ZINC000872160800	CE	On-Demand	Anodyne	Q2TU57_MAIZE	20	43
C[C@H](CN1C[C@@H](C(=O)O)[C@@H](c2ccccc2)C1)C(C)(C)C	ZINC000872160819	CG	On-Demand	Anodyne	CCR5	15	41
COc1ccccc1-c1nc(CN2CCC(c3ncc(C(=O)O)s3)CC2)co1	ZINC000872160835	GH	On-Demand	Anodyne	MGEA5	32	40
CN(CCCC1CC1)Cc1ccc(OCC(=O)O)cc1	ZINC000872160836	CF	On-Demand	Anodyne	LTA4H	45	46
CN(CCCC1CC1)Cc1ccc(OCC(=O)O)cc1	ZINC000872160836	CF	On-Demand	Anodyne	PLA2G4B	82	37
CN(CCCC1CC1)Cc1ccc(OCC(=O)O)cc1	ZINC000872160836	CF	On-Demand	Anodyne	LSS	30	41
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	HTR1A	15	45
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	DRD2	19	45
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	CNR1	52	32
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	DRD4	36	43
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	ADRA1D	16	43
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	DRD3	23	45
O=C(O)c1csc(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1	ZINC000872160895	FI	On-Demand	Anodyne	NPY2R	30	44
Cc1ccc(CN2CC[C@H](Cn3ccnn3)C2)cc1C(=O)O	ZINC000872160975	DD	On-Demand	Anodyne	ACHE	20	40
Cc1ccc(CN2CC[C@@H](Cn3ccnn3)C2)cc1C(=O)O	ZINC000872160977	DD	On-Demand	Anodyne	ACHE	20	40
Cc1conc1CN(CC(=O)O)Cc1cccc(Br)c1	ZINC000872160995	EF	On-Demand	Anodyne	PPARA	16	41
CC1(C)CC[C@@H](CN2CCc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161039	DF	On-Demand	Anodyne	RARG	40	31
CC1(C)CC[C@@H](CN2CCc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161039	DF	On-Demand	Anodyne	RXRG	44	37
CC1(C)CC[C@@H](CN2CCc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161039	DF	On-Demand	Anodyne	RXRA	40	37
CC1(C)CC[C@@H](CN2CCc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161039	DF	On-Demand	Anodyne	RXRB	44	37
COc1ccccc1-c1nc(CN(CC(=O)O)C2CCCCC2)co1	ZINC000872161050	EH	On-Demand	Anodyne	ACE	40	36
C=CC[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161096	CG	On-Demand	Mild	SLC6A1	93	39
C=CC[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161097	CG	On-Demand	Mild	SLC6A1	93	39
O=C(O)CCCN(CCCC1CC1)Cc1ccccc1	ZINC000872161118	CH	On-Demand	Anodyne	ACHE	17	42
O=C(O)CCCN(CCCC1CC1)Cc1ccccc1	ZINC000872161118	CH	On-Demand	Anodyne	AMY2	44	32
COc1ccccc1-c1nc(CN2CC[C@](C(=O)O)(c3ccccc3)C2)co1	ZINC000872161122	GH	On-Demand	Anodyne	TACR2	20	40
COc1ccccc1-c1nc(CN2CC[C@@](C(=O)O)(c3ccccc3)C2)co1	ZINC000872161123	GH	On-Demand	Anodyne	TACR2	20	40
CO[C@@H]1CC[C@@H](C)N(Cc2oc(-c3ccccc3)nc2C(=O)O)C1	ZINC000872161131	EG	On-Demand	Anodyne	PDE8B	60	36
CC(C)(C(=O)O)N1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872161171	EE	On-Demand	Anodyne	DRD4	40	38
CC(C)(C(=O)O)N1CCN(Cc2cnc(-c3ccccc3)nc2)CC1	ZINC000872161171	EE	On-Demand	Anodyne	FAAH	26	41
O=C(O)c1cnn(C2CCN(CCCC3CC3)CC2)c1	ZINC000872161233	CE	On-Demand	Anodyne	CYP2J2	46	34
C=CC[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161236	CG	On-Demand	Mild	DRD4	28	40
C=CC[C@@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161236	CG	On-Demand	Mild	ACHE	28	43
C=CC[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161238	CG	On-Demand	Mild	DRD4	28	40
C=CC[C@H]1CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161238	CG	On-Demand	Mild	ACHE	28	43
O=C(O)/C=C\c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161267	FH	On-Demand	Anodyne	LTA4H	46	38
O=C(O)/C=C\c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161267	FH	On-Demand	Anodyne	HRH3	16	47
O=C(O)/C=C\c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161267	FH	On-Demand	Anodyne	PSMB2	40	38
O=C(O)/C=C\c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161267	FH	On-Demand	Anodyne	PSMB1	42	38
O=C(O)/C=C/c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161270	FH	On-Demand	Anodyne	LTA4H	46	38
O=C(O)/C=C/c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161270	FH	On-Demand	Anodyne	HRH3	16	47
O=C(O)/C=C/c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161270	FH	On-Demand	Anodyne	PSMB2	40	38
O=C(O)/C=C/c1ccc(OCCN2CCC3(CCSCC3)CC2)cc1	ZINC000872161270	FH	On-Demand	Anodyne	PSMB1	42	38
C[C@H]1CC(C(=O)O)C[C@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161277	EG	On-Demand	Anodyne	S1PR4	15	40
C[C@H]1CC(C(=O)O)C[C@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161277	EG	On-Demand	Anodyne	S1PR1	15	40
C[C@H]1CC(C(=O)O)C[C@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161277	EG	On-Demand	Anodyne	S1PR5	34	40
C[C@@H]1CC(C(=O)O)C[C@@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161279	EG	On-Demand	Anodyne	S1PR4	15	40
C[C@@H]1CC(C(=O)O)C[C@@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161279	EG	On-Demand	Anodyne	S1PR1	15	40
C[C@@H]1CC(C(=O)O)C[C@@H](C)N1Cc1cnc(-c2ccccc2)nc1	ZINC000872161279	EG	On-Demand	Anodyne	S1PR5	34	40
C/C(=C/CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161281	CF	On-Demand	Anodyne	SLC6A1	82	40
C/C(=C/CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161281	CF	On-Demand	Anodyne	CHRNA10	19	41
C/C(=C/CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161281	CF	On-Demand	Anodyne	SCD1	57	46
C/C(=C\CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161283	CF	On-Demand	Anodyne	SLC6A1	82	40
C/C(=C\CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161283	CF	On-Demand	Anodyne	CHRNA10	19	41
C/C(=C\CN1CCC(Oc2ccccc2F)CC1)C(=O)O	ZINC000872161283	CF	On-Demand	Anodyne	SCD1	57	46
O=C(O)c1ccc2c(c1)CN(Cc1nc3c(o1)CCCC3)CC2	ZINC000872161390	DF	On-Demand	Anodyne	NOD2	41	36
O=C(O)[C@@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161437	CF	On-Demand	Anodyne	ADRA1B	24	40
O=C(O)[C@@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161437	CF	On-Demand	Anodyne	SIGMAR1	40	42
O=C(O)[C@@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161437	CF	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)[C@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161438	CF	On-Demand	Anodyne	ADRA1B	24	40
O=C(O)[C@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161438	CF	On-Demand	Anodyne	SIGMAR1	40	42
O=C(O)[C@]1(c2ccccc2)CCN(CCCC2CC2)C1	ZINC000872161438	CF	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1cccc2c1CN(CCCC1CC1)CC2	ZINC000872161439	CF	On-Demand	Anodyne	HTR7	24	41
O=C(O)c1cccc2c1CN(CCCC1CC1)CC2	ZINC000872161439	CF	On-Demand	Anodyne	CYP2J2	45	32
C/C=C\C[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161447	CH	On-Demand	Anodyne	SLC6A1	83	38
C/C=C/C[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161449	CH	On-Demand	Anodyne	SLC6A1	83	38
C/C=C\C[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161450	CH	On-Demand	Anodyne	SLC6A1	83	38
C/C=C/C[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872161452	CH	On-Demand	Anodyne	SLC6A1	83	38
C[C@@H]1CN(Cc2cccc3c2OC(C)(C)C3)C[C@@]1(C)C(=O)O	ZINC000872161454	DF	On-Demand	Anodyne	CCR8	16	45
O=C(O)c1nnn(C2CCN(Cc3ccc(CF)cc3)CC2)c1C(F)F	ZINC000872161456	FG	On-Demand	Anodyne	DRD4	15	43
C[C@]1(C(=O)O)CCCN(Cc2cnc(-c3ccccc3)nc2)C1	ZINC000872161458	DF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1cnc(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)s1	ZINC000872161477	GH	On-Demand	Anodyne	DRD4	31	40
O=C(O)c1cnc(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)s1	ZINC000872161477	GH	On-Demand	Anodyne	SIGMAR1	40	38
O=C(O)c1cnc(C2CCN(Cc3cnc(-c4ccccc4)nc3)CC2)s1	ZINC000872161477	GH	On-Demand	Anodyne	MGEA5	33	41
O=C(O)/C=C\c1ccc(OCCN2CCc3ccc(C(F)(F)F)cc3C2)cc1	ZINC000872161484	GI	On-Demand	Anodyne	LTA4H	23	42
O=C(O)/C=C\c1ccc(OCCN2CCc3ccc(C(F)(F)F)cc3C2)cc1	ZINC000872161484	GI	On-Demand	Anodyne	LIPG	48	35
O=C(O)/C=C/c1ccc(OCCN2CCc3ccc(C(F)(F)F)cc3C2)cc1	ZINC000872161485	GI	On-Demand	Anodyne	LTA4H	23	42
O=C(O)/C=C/c1ccc(OCCN2CCc3ccc(C(F)(F)F)cc3C2)cc1	ZINC000872161485	GI	On-Demand	Anodyne	LIPG	48	35
O=C(O)[C@@H]1CN(Cc2cc(C(F)(F)F)co2)C[C@H]1c1ccccc1	ZINC000872161508	EH	On-Demand	Anodyne	TACR1	22	43
C[C@@H]1CN(Cc2ccc(-n3ccnc3)nc2)C[C@@]1(C)C(=O)O	ZINC000872161528	DD	On-Demand	Anodyne	NOS2	75	33
Cc1ccc(CN2CC[C@@]3(CCc4ccccc4O3)C2)cc1C(=O)O	ZINC000872161570	EH	On-Demand	Anodyne	SIGMAR1	25	56
Cc1ccc(CN2CC[C@@]3(CCc4ccccc4O3)C2)cc1C(=O)O	ZINC000872161570	EH	On-Demand	Anodyne	MCHR2	55	33
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccccc1	ZINC000872161577	CF	On-Demand	Anodyne	SLC6A3	22	42
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccccc1	ZINC000872161577	CF	On-Demand	Anodyne	CCR5	30	44
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccccc1	ZINC000872161577	CF	On-Demand	Anodyne	CYP2J2	45	31
C[C@H](CN1[C@H](C(=O)O)CC[C@H]1c1ccccc1)C(C)(C)C	ZINC000872161588	CH	On-Demand	Anodyne	ACE	57	44
C[C@H](CN1[C@H](C(=O)O)CC[C@H]1c1ccccc1)C(C)(C)C	ZINC000872161588	CH	On-Demand	Anodyne	MME	19	44
C[C@H](CN1[C@H](C(=O)O)CC[C@H]1c1ccccc1)C(C)(C)C	ZINC000872161588	CH	On-Demand	Anodyne	AMY2	44	31
C[C@H](CN1[C@H](c2ccccc2)CC[C@@H]1C(=O)O)C(C)(C)C	ZINC000872161589	CH	On-Demand	Anodyne	ACE	57	44
C[C@H](CN1[C@H](c2ccccc2)CC[C@@H]1C(=O)O)C(C)(C)C	ZINC000872161589	CH	On-Demand	Anodyne	MME	19	44
C[C@H](CN1[C@H](c2ccccc2)CC[C@@H]1C(=O)O)C(C)(C)C	ZINC000872161589	CH	On-Demand	Anodyne	AMY2	44	31
Cc1ccc(CN2CC[C@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161592	DI	On-Demand	Anodyne	ACHE	16	40
Cc1ccc(CN2CC[C@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161592	DI	On-Demand	Anodyne	SLC6A1	43	35
Cc1ccc(CN2CC[C@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161592	DI	On-Demand	Anodyne	CCR3	27	41
Cc1ccc(CN2CC[C@@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161593	DI	On-Demand	Anodyne	ACHE	16	40
Cc1ccc(CN2CC[C@@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161593	DI	On-Demand	Anodyne	SLC6A1	43	35
Cc1ccc(CN2CC[C@@H](C3CCCCC3)C2)cc1C(=O)O	ZINC000872161593	DI	On-Demand	Anodyne	CCR3	27	41
C[C@@H]1CN(Cc2ncc(-c3ccccc3)s2)C[C@@]1(C)C(=O)O	ZINC000872161621	DG	On-Demand	Anodyne	S1PR1	15	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	DRD2	21	40
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	DRD4	40	42
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	HRH1	18	47
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	SIGMAR1	15	40
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	SSTR5	52	34
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	CCR3	30	43
COc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1F	ZINC000872161699	EH	On-Demand	Anodyne	MCHR1	26	44
COC1(C(F)(F)F)CCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872161838	EG	On-Demand	Anodyne	MCHR2	55	33
CC1(C)CC[C@@H](CN2C[C@H](c3ccc(Cl)cc3)[C@@H](C(=O)O)C2)OC1	ZINC000872161846	FH	On-Demand	Anodyne	SLC6A3	21	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	CHRM2	24	47
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	DRD2	20	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	DRD4	57	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	ACHE	35	43
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	SLC6A1	60	36
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	HRH1	38	42
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	DRD3	16	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	CHRM3	32	47
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	LTA4H	24	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	HRH3	16	44
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	SIGMAR1	46	40
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	SSTR5	42	36
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	CCR3	69	46
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	UTS2R	20	46
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	MLNR	39	41
Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1C(=O)O	ZINC000872161861	DG	On-Demand	Anodyne	MCHR1	33	44
Cc1conc1CN1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1	ZINC000872161863	CE	On-Demand	Anodyne	PDE8B	54	32
O=C(O)[C@@H]1C[C@@H](C2CCCCC2)CN1Cc1cc(C(F)(F)F)co1	ZINC000872161872	EI	On-Demand	Anodyne	LIPG	46	32
O=C(O)[C@H]1C[C@@H](C2CCCCC2)CN1Cc1cc(C(F)(F)F)co1	ZINC000872161873	EI	On-Demand	Anodyne	LIPG	46	32
O=C(O)[C@H]1C[C@H](C2CCCCC2)CN1Cc1cc(C(F)(F)F)co1	ZINC000872161874	EI	On-Demand	Anodyne	LIPG	46	32
O=C(O)[C@@H]1C[C@H](C2CCCCC2)CN1Cc1cc(C(F)(F)F)co1	ZINC000872161875	EI	On-Demand	Anodyne	LIPG	46	32
Cc1ccc(CN2CCO[C@H](c3cccc(OC(F)(F)F)c3)C2)cc1C(=O)O	ZINC000872161898	GI	On-Demand	Anodyne	DRD4	17	46
COc1cccc([C@]2(C)CCN(Cc3ccc(C)c(C(=O)O)c3)C2)c1	ZINC000872161919	EH	On-Demand	Anodyne	DRD4	41	33
COc1cccc([C@]2(C)CCN(Cc3ccc(C)c(C(=O)O)c3)C2)c1	ZINC000872161919	EH	On-Demand	Anodyne	SIGMAR1	22	43
COc1cccc([C@]2(C)CCN(Cc3ccc(C)c(C(=O)O)c3)C2)c1	ZINC000872161919	EH	On-Demand	Anodyne	MCHR2	60	32
COc1cccc([C@]2(C)CCN(Cc3ccc(C)c(C(=O)O)c3)C2)c1	ZINC000872161919	EH	On-Demand	Anodyne	CCR8	26	43
C[C@H](CN1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)O)C1)C(C)(C)C	ZINC000872161941	DI	On-Demand	Anodyne	SLC6A3	27	41
C[C@H](CN1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)O)C1)C(C)(C)C	ZINC000872161941	DI	On-Demand	Anodyne	MC4R	52	46
O=C(O)c1csc(CN2CCC(Cc3c(F)cccc3F)CC2)c1	ZINC000872161950	FI	On-Demand	Anodyne	ACHE	30	41
O=C(O)c1csc(CN2CCC(Cc3c(F)cccc3F)CC2)c1	ZINC000872161950	FI	On-Demand	Anodyne	SIGMAR1	29	42
C[C@H](CN1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)O)C1)CC(C)(C)C	ZINC000872161983	EJ	On-Demand	Anodyne	SLC6A3	25	40
C[C@H](CN1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)O)C1)CC(C)(C)C	ZINC000872161983	EJ	On-Demand	Anodyne	MC4R	48	43
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RARA	41	32
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RARG	50	35
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RXRG	51	36
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RARB	50	35
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RXRA	46	36
CC1(C)CC[C@@H](CN2Cc3ccc(C(=O)O)cc3C2)OC1	ZINC000872161995	CF	On-Demand	Anodyne	RXRB	51	36
COc1cccc([C@@H](C(=O)O)N2CCn3ncc(Br)c3C2)c1	ZINC000872162008	FE	On-Demand	Anodyne	ALS	54	39
COc1cccc([C@H](C(=O)O)N2CCn3ncc(Br)c3C2)c1	ZINC000872162009	FE	On-Demand	Anodyne	ALS	54	39
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	DRD4	15	49
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	OPRM1	27	52
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	OPRK1	21	49
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	OPRL1	26	49
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	KCNH2	37	44
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162023	EG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(O)[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162026	FJ	On-Demand	Anodyne	HRH1	15	42
O=C(O)[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162026	FJ	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162027	FJ	On-Demand	Anodyne	HRH1	15	42
O=C(O)[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162027	FJ	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162028	FJ	On-Demand	Anodyne	HRH1	15	42
O=C(O)[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162028	FJ	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162029	FJ	On-Demand	Anodyne	HRH1	15	42
O=C(O)[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162029	FJ	On-Demand	Anodyne	CCR3	17	42
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	CHRM2	17	41
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	DRD2	17	45
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	DRD4	42	42
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	ACHE	48	45
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	SLC6A1	41	36
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	HRH1	22	54
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	CHRM3	24	41
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	LTA4H	45	52
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	HRH3	35	47
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	SIGMAR1	55	48
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	SSTR5	43	38
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	CCR3	32	54
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	SLC6A5	23	40
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162030	DG	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	CHRM2	17	41
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	DRD2	17	45
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	DRD4	42	42
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	ACHE	48	45
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	SLC6A1	41	36
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	HRH1	22	54
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	CHRM3	24	41
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	LTA4H	45	52
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	HRH3	35	47
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	SIGMAR1	55	48
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	SSTR5	43	38
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	CCR3	32	54
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	SLC6A5	23	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162031	DG	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)CCCCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162034	DG	On-Demand	Anodyne	OPRL1	18	53
O=C(O)CCCCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162034	DG	On-Demand	Anodyne	PTGER4	21	41
O=C(O)c1ccc(OCCN2C[C@H]3CC=CC[C@H]3C2)c(Cl)c1	ZINC000872162050	DG	On-Demand	Anodyne	UTS2R	20	42
O=C(O)[C@H](c1ccsc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162051	EG	On-Demand	Anodyne	OPRL1	20	56
O=C(O)[C@@H](c1ccsc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162052	EG	On-Demand	Anodyne	OPRL1	20	56
O=C(O)c1cnoc1CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162053	GI	On-Demand	Anodyne	LTA4H	23	40
O=C(O)c1cnoc1CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162053	GI	On-Demand	Anodyne	PREP	48	33
O=C(O)c1cnoc1CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162053	GI	On-Demand	Anodyne	FAAH	24	40
O=C(O)c1cnoc1CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162054	GI	On-Demand	Anodyne	LTA4H	23	40
O=C(O)c1cnoc1CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162054	GI	On-Demand	Anodyne	PREP	48	33
O=C(O)c1cnoc1CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162054	GI	On-Demand	Anodyne	FAAH	24	40
O=C(O)c1cccc(-c2nc(CN3C[C@H]4CC=CC[C@H]4C3)cs2)c1	ZINC000872162061	EH	On-Demand	Anodyne	S1PR1	21	40
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1cccc(F)c1	ZINC000872162073	CD	On-Demand	Anodyne	Q8WSF8_APLCA	19	40
O=C(O)C12CCC(CC1)N2C[C@H](O)c1cccc(F)c1	ZINC000872162074	CD	On-Demand	Anodyne	Q8WSF8_APLCA	19	40
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162080	FH	On-Demand	Anodyne	PDE8B	58	34
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162081	FH	On-Demand	Anodyne	PDE8B	58	34
COC1([C@H](C(=O)O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CCC1	ZINC000872162082	EF	On-Demand	Anodyne	OPRL1	33	51
COC1([C@@H](C(=O)O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CCC1	ZINC000872162083	EF	On-Demand	Anodyne	OPRL1	33	51
O=C(O)CCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162088	CE	On-Demand	Anodyne	OPRL1	20	55
O=C(O)c1ccccc1OCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162095	FG	On-Demand	Anodyne	HRH1	15	54
O=C(O)c1ccccc1OCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162095	FG	On-Demand	Anodyne	OPRL1	18	48
O=C(O)c1ccccc1OCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162095	FG	On-Demand	Anodyne	ABCB1	18	42
O=C(O)c1ccccc1OCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162095	FG	On-Demand	Anodyne	HCN1	40	35
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	DRD4	21	40
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	ACHE	19	40
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	SLC6A1	106	39
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	HRH1	19	54
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	CHRM3	17	41
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	FABP4	41	39
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	SIGMAR1	39	41
O=C(O)c1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162096	DG	On-Demand	Anodyne	CCR3	24	54
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	DRD4	21	40
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	ACHE	19	40
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	SLC6A1	106	39
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	HRH1	19	54
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	CHRM3	17	41
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	FABP4	41	39
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	SIGMAR1	39	41
O=C(O)c1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162097	DG	On-Demand	Anodyne	CCR3	24	54
CCn1c(CN2CCC[C@H](C(F)(F)F)C2)nc2cc(C(=O)O)ccc21	ZINC000872162098	FH	On-Demand	Anodyne	HPGD	15	41
O=C(O)c1oc2ccc(Br)cc2c1CN1C[C@H]2CC=CC[C@H]2C1	ZINC000872162099	GI	On-Demand	Anodyne	PIM3	17	42
O=C(O)c1cccnc1CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162106	GJ	On-Demand	Anodyne	LTA4H	28	40
O=C(O)c1cccnc1CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162106	GJ	On-Demand	Anodyne	FAAH	28	42
O=C(O)c1cccnc1CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162107	GJ	On-Demand	Anodyne	LTA4H	28	40
O=C(O)c1cccnc1CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162107	GJ	On-Demand	Anodyne	FAAH	28	42
O=C(O)c1ccccc1CCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162135	FG	On-Demand	Anodyne	OPRM1	15	50
O=C(O)c1ccccc1CCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162135	FG	On-Demand	Anodyne	OPRL1	25	50
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	SLC6A1	76	39
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	HRH1	33	41
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	HTR4	40	36
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	UTS2R	23	48
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162138	FH	On-Demand	Anodyne	PSMB1	41	36
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	SLC6A1	76	39
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	HRH1	33	41
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	HTR4	40	36
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	UTS2R	23	48
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872162139	FH	On-Demand	Anodyne	PSMB1	41	36
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2CCOc1ccc(/C=C/C(=O)O)cc1	ZINC000872162149	EE	On-Demand	Anodyne	SLC6A3	19	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2CCOc1ccc(/C=C\C(=O)O)cc1	ZINC000872162151	EE	On-Demand	Anodyne	SLC6A3	19	41
O=C(O)[C@@H]1C[C@H](C2CCCCC2)CN1Cc1cnc(-c2ccccc2)nc1	ZINC000872162172	FH	On-Demand	Anodyne	ACE	29	43
O=C(O)[C@@H]1C[C@@H](C2CCCCC2)CN1Cc1cnc(-c2ccccc2)nc1	ZINC000872162173	FH	On-Demand	Anodyne	ACE	29	43
O=C(O)[C@H]1C[C@H](C2CCCCC2)CN1Cc1cnc(-c2ccccc2)nc1	ZINC000872162174	FH	On-Demand	Anodyne	ACE	29	43
O=C(O)[C@H]1C[C@@H](C2CCCCC2)CN1Cc1cnc(-c2ccccc2)nc1	ZINC000872162175	FH	On-Demand	Anodyne	ACE	29	43
COc1cccc([C@]2(C)CCN(Cc3cc(C(=O)O)cs3)C2)c1	ZINC000872162191	EH	On-Demand	Anodyne	DRD4	41	32
Cc1conc1CN1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)O)C1	ZINC000872162211	DF	On-Demand	Anodyne	MC4R	24	40
C[C@H](CN1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1)C(C)(C)C	ZINC000872162224	CG	On-Demand	Anodyne	CCR5	15	41
O=C(O)c1csc(CN2CCC(c3ccon3)CC2)c1	ZINC000872162227	CF	On-Demand	Anodyne	ETHR	50	31
O=C(O)c1csc(CN2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000872162229	EG	On-Demand	Anodyne	SIGMAR1	16	52
O=C(O)c1csc(CN2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000872162230	EG	On-Demand	Anodyne	SIGMAR1	16	52
COc1ccccc1-c1nc(CN(CC(=O)O)C2CCCC2)co1	ZINC000872162255	EG	On-Demand	Anodyne	ACE	41	37
O=C(O)c1nc(-c2ccccc2)oc1CN1C[C@H]2CC=CC[C@H]2C1	ZINC000872162273	DG	On-Demand	Anodyne	PDE8B	65	37
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)s1	ZINC000872162279	EG	On-Demand	Anodyne	OPRL1	15	49
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1ccc(Br)cc1	ZINC000872162280	EF	On-Demand	Anodyne	SLC18A3	15	50
O=C(O)C12CCC(CC1)N2C[C@H](O)c1ccc(Br)cc1	ZINC000872162281	EF	On-Demand	Anodyne	SLC18A3	15	50
O=C(O)[C@H](c1cccc(Cl)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162282	FH	On-Demand	Anodyne	OPRL1	46	58
O=C(O)[C@@H](c1cccc(Cl)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162283	FH	On-Demand	Anodyne	OPRL1	46	58
O=C(O)c1cccc(Cl)c1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162284	FI	On-Demand	Anodyne	OPRL1	39	51
O=C(O)CCCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162291	DF	On-Demand	Anodyne	OPRL1	20	55
C[C@@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162299	CD	On-Demand	Anodyne	OPRL1	45	63
C[C@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162300	CD	On-Demand	Anodyne	OPRL1	45	63
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	DRD4	19	40
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	SLC6A1	66	36
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	HRH1	29	46
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	CHRM3	19	46
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	CCR3	73	46
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	CCR5	75	34
O=C(O)Cc1ccccc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872162323	EG	On-Demand	Anodyne	MLNR	29	51
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	DRD4	19	40
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	SLC6A1	66	36
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	HRH1	29	46
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	CHRM3	19	46
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	CCR3	73	46
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	CCR5	75	34
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872162324	EG	On-Demand	Anodyne	MLNR	29	51
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162330	EH	On-Demand	Anodyne	RBP4	71	38
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162331	EH	On-Demand	Anodyne	RBP4	71	38
O=C(O)C12CCC(CC1)N2CCOc1cccc(F)c1	ZINC000872162332	CE	On-Demand	Anodyne	CHRNA10	43	43
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	FKBP1A	34	42
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	LTA4H	40	57
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	PTGER4	26	48
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	CYSLTR2	51	32
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	HRH3	18	41
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	PREP	60	37
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	FAAH	19	43
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	CHRNA10	47	36
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	CCR8	20	40
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	CRTM	54	40
O=C(O)CCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162335	EI	On-Demand	Anodyne	ACKR3	52	32
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	FKBP1A	34	42
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	LTA4H	40	57
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	PTGER4	26	48
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	CYSLTR2	51	32
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	HRH3	18	41
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	PREP	60	37
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	FAAH	19	43
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	CHRNA10	47	36
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	CCR8	20	40
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	CRTM	54	40
O=C(O)CCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162336	EI	On-Demand	Anodyne	ACKR3	52	32
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c(F)c1	ZINC000872162340	FH	On-Demand	Anodyne	OPRL1	19	47
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1Cl	ZINC000872162343	EH	On-Demand	Anodyne	SLC6A1	74	36
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1Cl	ZINC000872162343	EH	On-Demand	Anodyne	CCR3	24	48
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1Cl	ZINC000872162344	EH	On-Demand	Anodyne	SLC6A1	74	36
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1Cl	ZINC000872162344	EH	On-Demand	Anodyne	CCR3	24	48
O=C(O)Cc1ccccc1CN1CCC[C@H](C2CCC2)CC1	ZINC000872162349	DH	On-Demand	Anodyne	DRD4	25	40
O=C(O)Cc1ccccc1CN1CCC[C@H](C2CCC2)CC1	ZINC000872162349	DH	On-Demand	Anodyne	ACHE	24	42
O=C(O)Cc1ccccc1CN1CCC[C@H](C2CCC2)CC1	ZINC000872162349	DH	On-Demand	Anodyne	SLC6A1	123	40
O=C(O)Cc1ccccc1CN1CCC[C@H](C2CCC2)CC1	ZINC000872162349	DH	On-Demand	Anodyne	SIGMAR1	51	43
O=C(O)Cc1ccccc1CN1CCC[C@H](C2CCC2)CC1	ZINC000872162349	DH	On-Demand	Anodyne	CCR3	24	44
O=C(O)Cc1ccccc1CN1CCC[C@@H](C2CCC2)CC1	ZINC000872162350	DH	On-Demand	Anodyne	DRD4	25	40
O=C(O)Cc1ccccc1CN1CCC[C@@H](C2CCC2)CC1	ZINC000872162350	DH	On-Demand	Anodyne	ACHE	24	42
O=C(O)Cc1ccccc1CN1CCC[C@@H](C2CCC2)CC1	ZINC000872162350	DH	On-Demand	Anodyne	SLC6A1	123	40
O=C(O)Cc1ccccc1CN1CCC[C@@H](C2CCC2)CC1	ZINC000872162350	DH	On-Demand	Anodyne	SIGMAR1	51	43
O=C(O)Cc1ccccc1CN1CCC[C@@H](C2CCC2)CC1	ZINC000872162350	DH	On-Demand	Anodyne	CCR3	24	44
O=C(O)C1(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000872162352	DE	On-Demand	Anodyne	OPRL1	29	56
O=C(O)[C@@H](c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162358	CE	On-Demand	Anodyne	PTAFR	17	42
O=C(O)[C@@H](c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162358	CE	On-Demand	Anodyne	KCNA5	21	40
O=C(O)[C@H](c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162359	CE	On-Demand	Anodyne	PTAFR	17	42
O=C(O)[C@H](c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000872162359	CE	On-Demand	Anodyne	KCNA5	21	40
Cc1ccccc1[C@@H](C(=O)O)N1CCC[C@H](C(F)(F)F)C1	ZINC000872162360	DG	On-Demand	Anodyne	SLC6A1	37	42
Cc1ccccc1[C@H](C(=O)O)N1CCC[C@H](C(F)(F)F)C1	ZINC000872162361	DG	On-Demand	Anodyne	SLC6A1	37	42
C/C(=C/CN1CCC[C@]1(C)Cc1cccc(C)c1)C(=O)O	ZINC000872162362	CG	On-Demand	Anodyne	SLC12A5	60	36
C/C(=C\CN1CCC[C@@]1(C)Cc1cccc(C)c1)C(=O)O	ZINC000872162363	CG	On-Demand	Anodyne	SLC12A5	60	36
CCC[C@]1(CO)CCN(Cc2ccc(C)c(C(=O)O)c2)C1	ZINC000872162364	CF	On-Demand	Anodyne	MCHR2	41	32
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	DRD4	20	41
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	HRH1	25	40
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	KCNH2	40	38
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	CHRM3	21	50
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	CCR3	29	41
O=C(O)c1csc(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000872162382	DG	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1csc(CN2CCC3(CCc4ccccc4O3)CC2)c1	ZINC000872162392	EH	On-Demand	Anodyne	SIGMAR1	32	60
O=C(O)c1csc(CN2CCC3(CCc4ccccc4O3)CC2)c1	ZINC000872162392	EH	On-Demand	Anodyne	SCD1	16	40
O=C(O)c1csc(CN2CCC3(CCc4ccccc4O3)CC2)c1	ZINC000872162392	EH	On-Demand	Anodyne	SCD	21	40
C[C@H](C(=O)O)N(Cc1cnc(-c2ccccc2)nc1)C1CCC1	ZINC000872162393	DF	On-Demand	Anodyne	SCARB1	23	42
C[C@@H](C(=O)O)N(Cc1cnc(-c2ccccc2)nc1)C1CCC1	ZINC000872162394	DF	On-Demand	Anodyne	SCARB1	23	42
O=C(O)c1csc(CN2CCC(Cc3cccc(F)c3F)CC2)c1	ZINC000872162395	FI	On-Demand	Anodyne	ACHE	29	40
O=C(O)CN(CCCC1CC1)C1CCC1	ZINC000872162398	BE	On-Demand	Anodyne	ACE	40	33
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccc(Cl)cc1	ZINC000872162461	DH	On-Demand	Anodyne	SLC6A4	18	45
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccc(Cl)cc1	ZINC000872162461	DH	On-Demand	Anodyne	SLC6A3	34	49
O=C(O)[C@@H]1CN(CCCC2CC2)C[C@H]1c1ccc(Cl)cc1	ZINC000872162461	DH	On-Demand	Anodyne	PRCP	16	41
C/C(=C/CN1CCC[C@@]1(C)Cc1cccc(C)c1)C(=O)O	ZINC000872162464	CG	On-Demand	Anodyne	SLC12A5	60	36
C/C(=C\CN1CCC[C@]1(C)Cc1cccc(C)c1)C(=O)O	ZINC000872162465	CG	On-Demand	Anodyne	SLC12A5	60	36
O=C(O)c1cnc(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162470	GI	On-Demand	Anodyne	LTA4H	26	40
O=C(O)c1cnc(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162470	GI	On-Demand	Anodyne	PREP	51	35
O=C(O)c1cnc(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162470	GI	On-Demand	Anodyne	FAAH	28	41
O=C(O)c1cnc(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162471	GI	On-Demand	Anodyne	LTA4H	26	40
O=C(O)c1cnc(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162471	GI	On-Demand	Anodyne	PREP	51	35
O=C(O)c1cnc(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)cn1	ZINC000872162471	GI	On-Demand	Anodyne	FAAH	28	41
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	CHRM2	16	42
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	DRD4	17	55
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	ACHE	17	40
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	OPRM1	21	52
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	OPRD1	15	40
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	OPRL1	36	52
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	CHRM3	15	42
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	LTA4H	28	53
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	SIGMAR1	26	48
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162482	EG	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872162483	DF	On-Demand	Anodyne	SSTR5	41	37
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872162483	DF	On-Demand	Anodyne	SCN5A	47	37
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872162484	DF	On-Demand	Anodyne	SSTR5	41	37
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872162484	DF	On-Demand	Anodyne	SCN5A	47	37
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	ADRB2	19	41
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	ADRB1	31	41
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	HRH1	23	45
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	HRH3	17	40
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	ACOX1	63	34
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	CCR3	24	43
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162486	FF	On-Demand	Anodyne	ABCB1	72	53
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	ADRB2	19	41
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	ADRB1	31	41
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	HRH1	23	45
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	HRH3	17	40
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	ACOX1	63	34
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	CCR3	24	43
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872162487	FF	On-Demand	Anodyne	ABCB1	72	53
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	ADRB2	19	41
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	ADRB1	31	41
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	HRH1	23	45
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	HRH3	17	40
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	ACOX1	63	34
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	CCR3	24	43
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162488	FF	On-Demand	Anodyne	ABCB1	72	53
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	ADRB2	19	41
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	ADRB1	31	41
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	HRH1	23	45
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	HRH3	17	40
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	ACOX1	63	34
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	CCR3	24	43
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872162489	FF	On-Demand	Anodyne	ABCB1	72	53
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162510	FI	On-Demand	Anodyne	RBP4	66	39
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162510	FI	On-Demand	Anodyne	SFRP1	86	32
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162510	FI	On-Demand	Anodyne	WNT3	60	31
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162511	FI	On-Demand	Anodyne	RBP4	66	39
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162511	FI	On-Demand	Anodyne	SFRP1	86	32
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162511	FI	On-Demand	Anodyne	WNT3	60	31
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162512	FI	On-Demand	Anodyne	RBP4	66	39
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162512	FI	On-Demand	Anodyne	SFRP1	86	32
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162512	FI	On-Demand	Anodyne	WNT3	60	31
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162513	FI	On-Demand	Anodyne	RBP4	66	39
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162513	FI	On-Demand	Anodyne	SFRP1	86	32
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162513	FI	On-Demand	Anodyne	WNT3	60	31
O=C(O)c1ccc(CN2C[C@H]3CC=CC[C@H]3C2)cc1Cl	ZINC000872162519	CG	On-Demand	Anodyne	SIGMAR1	29	42
O=C(O)c1cccc(Br)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162528	GI	On-Demand	Anodyne	SLC6A1	57	37
O=C(O)c1cccc(Br)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162529	GI	On-Demand	Anodyne	SLC6A1	57	37
O=C(O)[C@H](c1ccc(F)cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162530	FG	On-Demand	Anodyne	OPRL1	37	58
O=C(O)[C@@H](c1ccc(F)cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162531	FG	On-Demand	Anodyne	OPRL1	37	58
O=C(O)c1cccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1Cl	ZINC000872162539	FI	On-Demand	Anodyne	OPRL1	24	47
C[C@@](O)(CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162540	FG	On-Demand	Anodyne	FKBP1A	43	46
C[C@@](O)(CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162540	FG	On-Demand	Anodyne	LTA4H	34	42
C[C@@](O)(CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162540	FG	On-Demand	Anodyne	PREP	52	34
C[C@@](O)(CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162540	FG	On-Demand	Anodyne	AMP1_PLAFQ	21	41
C[C@@](O)(CN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162540	FG	On-Demand	Anodyne	CRTM	58	39
C[C@@](O)(CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162541	FG	On-Demand	Anodyne	FKBP1A	43	46
C[C@@](O)(CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162541	FG	On-Demand	Anodyne	LTA4H	34	42
C[C@@](O)(CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162541	FG	On-Demand	Anodyne	PREP	52	34
C[C@@](O)(CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162541	FG	On-Demand	Anodyne	AMP1_PLAFQ	21	41
C[C@@](O)(CN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1)C(=O)O	ZINC000872162541	FG	On-Demand	Anodyne	CRTM	58	39
O=C(O)c1ccccc1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872162546	DG	On-Demand	Anodyne	SLC6A1	122	41
O=C(O)c1ccccc1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872162546	DG	On-Demand	Anodyne	HRH1	25	43
O=C(O)c1ccccc1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872162546	DG	On-Demand	Anodyne	SIGMAR1	39	42
O=C(O)c1ccccc1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872162546	DG	On-Demand	Anodyne	CCR3	17	43
O=C(O)c1ccccc1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162547	DG	On-Demand	Anodyne	SLC6A1	122	41
O=C(O)c1ccccc1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162547	DG	On-Demand	Anodyne	HRH1	25	43
O=C(O)c1ccccc1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162547	DG	On-Demand	Anodyne	SIGMAR1	39	42
O=C(O)c1ccccc1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162547	DG	On-Demand	Anodyne	CCR3	17	43
COc1cccc([C@@H](C(=O)O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162548	FG	On-Demand	Anodyne	OPRL1	32	54
COc1cccc([C@H](C(=O)O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872162549	FG	On-Demand	Anodyne	OPRL1	32	54
O=C(O)Cc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162552	DG	On-Demand	Anodyne	SLC6A1	127	41
O=C(O)Cc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162552	DG	On-Demand	Anodyne	CHRM3	19	40
O=C(O)Cc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162552	DG	On-Demand	Anodyne	SIGMAR1	41	41
O=C(O)Cc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162552	DG	On-Demand	Anodyne	CCR3	21	43
O=C(O)Cc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162553	DG	On-Demand	Anodyne	SLC6A1	127	41
O=C(O)Cc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162553	DG	On-Demand	Anodyne	CHRM3	19	40
O=C(O)Cc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162553	DG	On-Demand	Anodyne	SIGMAR1	41	41
O=C(O)Cc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162553	DG	On-Demand	Anodyne	CCR3	21	43
C=C[C@@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162557	CE	On-Demand	Mild	OPRL1	34	62
C=C[C@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162558	CE	On-Demand	Mild	OPRL1	34	62
Cc1ccc(CN2CC[C@@]3(O)C[C@H]3C2)cc1C(=O)O	ZINC000872162586	CD	On-Demand	Anodyne	MCHR2	52	32
O=C(O)CN(Cc1cc(C(F)(F)F)co1)C1CCC1	ZINC000872162609	CF	On-Demand	Anodyne	ACE	47	32
O=C(O)CN(Cc1cc(C(F)(F)F)co1)C1CCCC1	ZINC000872162619	CG	On-Demand	Anodyne	ACE	49	34
Cc1ccc(CN2CC[C@@H](O)[C@H](C3CCCC3)C2)cc1C(=O)O	ZINC000872162626	DG	On-Demand	Anodyne	SLC6A1	41	34
O=C(O)[C@@H]1CCN(Cc2cc(C(F)(F)F)co2)c2ccccc21	ZINC000872162641	EH	On-Demand	Anodyne	LIPG	49	34
O=C(O)[C@H]1CCN(Cc2cc(C(F)(F)F)co2)c2ccccc21	ZINC000872162642	EH	On-Demand	Anodyne	LIPG	49	34
C/C(=C/CN1CCC[C@]1(C)Cc1ccc(F)c(F)c1)C(=O)O	ZINC000872162669	DG	On-Demand	Anodyne	SLC12A5	42	38
C/C(=C\CN1CCC[C@@]1(C)Cc1ccc(F)c(F)c1)C(=O)O	ZINC000872162670	DG	On-Demand	Anodyne	SLC12A5	42	38
C/C(=C/CN1CCC[C@@]1(C)Cc1ccc(F)c(F)c1)C(=O)O	ZINC000872162671	DG	On-Demand	Anodyne	SLC12A5	42	38
C/C(=C\CN1CCC[C@]1(C)Cc1ccc(F)c(F)c1)C(=O)O	ZINC000872162672	DG	On-Demand	Anodyne	SLC12A5	42	38
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	CHRM2	22	43
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	DRD2	25	47
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	DRD4	45	43
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	ACHE	56	47
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	HRH2	30	44
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	SLC6A1	71	35
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	HRH1	25	57
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	CHRM3	39	43
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	LTA4H	24	41
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	HRH3	19	40
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	SIGMAR1	57	46
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	SSTR5	53	40
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	CCR3	46	57
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	BDKRB1	27	45
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	MCHR1	29	45
O=C(O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162678	DG	On-Demand	Anodyne	CACNA1I	15	41
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	CHRM2	22	43
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	DRD2	25	47
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	DRD4	45	43
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	ACHE	56	47
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	HRH2	30	44
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	SLC6A1	71	35
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	HRH1	25	57
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	CHRM3	39	43
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	LTA4H	24	41
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	HRH3	19	40
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	SIGMAR1	57	46
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	SSTR5	53	40
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	CCR3	46	57
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	BDKRB1	27	45
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	MCHR1	29	45
O=C(O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162679	DG	On-Demand	Anodyne	CACNA1I	15	41
O=C(O)c1sccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162680	DG	On-Demand	Anodyne	SLC6A1	40	42
O=C(O)c1sccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162681	DG	On-Demand	Anodyne	SLC6A1	40	42
O=C(O)[C@H](c1ccccc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162699	EG	On-Demand	Anodyne	OPRL1	43	70
O=C(O)[C@@H](c1ccccc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162700	EG	On-Demand	Anodyne	OPRL1	43	70
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	DRD4	34	41
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	SLC6A1	43	38
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	HRH1	31	44
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	SIGMAR1	23	43
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	CCR3	86	46
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	CCR5	81	37
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	UTS2R	15	41
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	MLNR	69	54
Cc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1C(=O)O	ZINC000872162710	EG	On-Demand	Anodyne	MCHR1	30	42
O=C(O)[C@H](c1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162713	EF	On-Demand	Anodyne	OPRL1	32	59
O=C(O)[C@@H](c1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162714	EF	On-Demand	Anodyne	OPRL1	32	59
O=C(O)c1ccc(Cl)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162728	EH	On-Demand	Anodyne	HRH1	27	46
O=C(O)c1ccc(Cl)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162728	EH	On-Demand	Anodyne	OPRK1	16	40
O=C(O)c1ccc(Cl)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162728	EH	On-Demand	Anodyne	CCR3	39	48
O=C(O)c1ccc(Cl)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162728	EH	On-Demand	Anodyne	UTS2R	22	40
O=C(O)c1ccc(Cl)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162729	EH	On-Demand	Anodyne	HRH1	27	46
O=C(O)c1ccc(Cl)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162729	EH	On-Demand	Anodyne	OPRK1	16	40
O=C(O)c1ccc(Cl)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162729	EH	On-Demand	Anodyne	CCR3	39	48
O=C(O)c1ccc(Cl)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162729	EH	On-Demand	Anodyne	UTS2R	22	40
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872162741	EF	On-Demand	Anodyne	CCR2	68	40
O=C(O)C12CCC(CC1)N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872162742	EF	On-Demand	Anodyne	CCR2	68	40
O=C(O)[C@@H](C1CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162747	DE	On-Demand	Anodyne	OPRL1	35	62
O=C(O)[C@H](C1CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162748	DE	On-Demand	Anodyne	OPRL1	35	62
O=C(O)[C@H](c1ccccc1F)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162749	FG	On-Demand	Anodyne	OPRL1	45	55
COc1cccc([C@@H](C(=O)O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162751	EG	On-Demand	Anodyne	KCNQ2	26	43
COc1cccc([C@@H](C(=O)O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162751	EG	On-Demand	Anodyne	CCR3	20	45
COc1cccc([C@H](C(=O)O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162752	EG	On-Demand	Anodyne	KCNQ2	26	43
COc1cccc([C@H](C(=O)O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162752	EG	On-Demand	Anodyne	CCR3	20	45
COc1cccc([C@H](C(=O)O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162753	EG	On-Demand	Anodyne	KCNQ2	26	43
COc1cccc([C@H](C(=O)O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162753	EG	On-Demand	Anodyne	CCR3	20	45
COc1cccc([C@@H](C(=O)O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162754	EG	On-Demand	Anodyne	KCNQ2	26	43
COc1cccc([C@@H](C(=O)O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162754	EG	On-Demand	Anodyne	CCR3	20	45
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1F	ZINC000872162755	FH	On-Demand	Anodyne	OPRL1	27	50
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1F	ZINC000872162755	FH	On-Demand	Anodyne	CCR3	23	42
O=C(O)CC1(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000872162756	DF	On-Demand	Anodyne	OPRL1	23	52
COc1cccc([C@H](C(=O)O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000872162759	CF	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C(=O)O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000872162759	CF	On-Demand	Anodyne	MTNR1B	29	41
O=C(O)c1csc(CN2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)c1	ZINC000872162766	GF	On-Demand	Anodyne	SLC6A1	53	34
O=C(O)c1csc(CN2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)c1	ZINC000872162767	GF	On-Demand	Anodyne	SLC6A1	53	34
COc1cccc([C@@H](C(=O)O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000872162769	CF	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@@H](C(=O)O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000872162769	CF	On-Demand	Anodyne	MTNR1B	29	41
O=C(O)[C@@H]1CN(Cc2cc(C(F)(F)F)co2)C[C@H]1c1ccc(Cl)cc1	ZINC000872162837	FI	On-Demand	Anodyne	MC4R	20	46
Cc1ccc(CN2CCSC3(CCC3)CC2)cc1C(=O)O	ZINC000872162855	DH	On-Demand	Anodyne	MCHR2	53	33
CCc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872162867	DI	On-Demand	Anodyne	DRD4	44	41
CCc1ccc([C@@H]2CCN(Cc3ccc(C)c(C(=O)O)c3)C2)cc1	ZINC000872162867	DI	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)CN(Cc1coc(C2CC2)n1)C1CCCC1	ZINC000872162882	CE	On-Demand	Anodyne	ACE	47	34
O=C(O)/C=C/c1ccc(OCCN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162890	DG	On-Demand	Anodyne	PSMB1	40	36
O=C(O)/C=C\c1ccc(OCCN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162891	DG	On-Demand	Anodyne	PSMB1	40	36
O=C(O)c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2o1	ZINC000872162899	EI	On-Demand	Anodyne	ACHE	15	42
O=C(O)c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2o1	ZINC000872162899	EI	On-Demand	Anodyne	HRH1	15	40
O=C(O)c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2o1	ZINC000872162899	EI	On-Demand	Anodyne	SIGMAR1	29	40
O=C(O)c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2o1	ZINC000872162899	EI	On-Demand	Anodyne	SSTR5	56	37
O=C(O)c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2o1	ZINC000872162899	EI	On-Demand	Anodyne	CCR3	33	40
O=C(O)c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2o1	ZINC000872162900	EI	On-Demand	Anodyne	ACHE	15	42
O=C(O)c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2o1	ZINC000872162900	EI	On-Demand	Anodyne	HRH1	15	40
O=C(O)c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2o1	ZINC000872162900	EI	On-Demand	Anodyne	SIGMAR1	29	40
O=C(O)c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2o1	ZINC000872162900	EI	On-Demand	Anodyne	SSTR5	56	37
O=C(O)c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2o1	ZINC000872162900	EI	On-Demand	Anodyne	CCR3	33	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	ESR1	71	38
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	HTR1A	16	41
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	DRD2	19	41
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	DRD4	42	32
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	ACHE	23	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	HRH2	50	50
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	SLC6A1	108	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	HRH1	40	50
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	KCNH2	37	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	ESR2	50	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	LTA4H	65	49
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	HRH3	66	46
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	SIGMAR1	26	40
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	CCR3	26	42
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	PLA2G4B	47	44
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	CHRNA10	48	36
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	PSMB2	44	41
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	PSMB1	48	45
O=C(O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872162901	EG	On-Demand	Anodyne	MEN1	45	36
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	ESR1	71	38
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	HTR1A	16	41
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	DRD2	19	41
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	DRD4	42	32
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	ACHE	23	40
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	HRH2	50	50
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	SLC6A1	108	40
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	HRH1	40	50
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	KCNH2	37	40
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	ESR2	50	40
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	LTA4H	65	49
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	HRH3	66	46
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	SIGMAR1	26	40
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	CCR3	26	42
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	PLA2G4B	47	44
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	CHRNA10	48	36
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	PSMB2	44	41
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	PSMB1	48	45
O=C(O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872162902	EG	On-Demand	Anodyne	MEN1	45	36
O=C(O)COCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162903	FH	On-Demand	Anodyne	PTGIR	17	40
O=C(O)COCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162903	FH	On-Demand	Anodyne	LTA4H	35	42
O=C(O)COCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162903	FH	On-Demand	Anodyne	FAAH	15	41
O=C(O)COCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162903	FH	On-Demand	Anodyne	AMP1_PLAFQ	20	41
O=C(O)COCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162904	FH	On-Demand	Anodyne	PTGIR	17	40
O=C(O)COCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162904	FH	On-Demand	Anodyne	LTA4H	35	42
O=C(O)COCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162904	FH	On-Demand	Anodyne	FAAH	15	41
O=C(O)COCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162904	FH	On-Demand	Anodyne	AMP1_PLAFQ	20	41
CCCC[C@@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162911	DG	On-Demand	Anodyne	OPRL1	31	53
CCCC[C@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162912	DG	On-Demand	Anodyne	OPRL1	31	53
O=C(O)c1sccc1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162917	EG	On-Demand	Anodyne	OPRL1	23	49
O=C(O)c1cc(F)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162918	DG	On-Demand	Anodyne	SLC6A1	57	40
O=C(O)c1cc(F)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162918	DG	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)c1cc(F)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162918	DG	On-Demand	Anodyne	CCR3	37	42
O=C(O)c1cc(F)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872162918	DG	On-Demand	Anodyne	LIPG	41	36
O=C(O)c1cc(F)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162919	DG	On-Demand	Anodyne	SLC6A1	57	40
O=C(O)c1cc(F)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162919	DG	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)c1cc(F)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162919	DG	On-Demand	Anodyne	CCR3	37	42
O=C(O)c1cc(F)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872162919	DG	On-Demand	Anodyne	LIPG	41	36
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162925	FJ	On-Demand	Anodyne	HRH1	30	55
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162925	FJ	On-Demand	Anodyne	CCR3	32	55
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162926	FJ	On-Demand	Anodyne	HRH1	30	55
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872162926	FJ	On-Demand	Anodyne	CCR3	32	55
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162927	FJ	On-Demand	Anodyne	HRH1	30	55
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162927	FJ	On-Demand	Anodyne	CCR3	32	55
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162928	FJ	On-Demand	Anodyne	HRH1	30	55
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872162928	FJ	On-Demand	Anodyne	CCR3	32	55
O=C(O)c1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162929	GF	On-Demand	Anodyne	OPRL1	16	46
O=C(O)c1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162929	GF	On-Demand	Anodyne	LTA4H	18	41
O=C(O)c1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162929	GF	On-Demand	Anodyne	ABCB1	56	45
O=C(O)c1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162929	GF	On-Demand	Anodyne	Q8WSF8_APLCA	31	41
O=C(O)c1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162930	GF	On-Demand	Anodyne	OPRL1	16	46
O=C(O)c1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162930	GF	On-Demand	Anodyne	LTA4H	18	41
O=C(O)c1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162930	GF	On-Demand	Anodyne	ABCB1	56	45
O=C(O)c1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000872162930	GF	On-Demand	Anodyne	Q8WSF8_APLCA	31	41
C/C(=C\CN1CCC[C@@]1(C)Cc1ccc(C)cc1)C(=O)O	ZINC000872162931	CG	On-Demand	Anodyne	SLC12A5	49	41
C/C(=C/CN1CCC[C@]1(C)Cc1ccc(C)cc1)C(=O)O	ZINC000872162932	CG	On-Demand	Anodyne	SLC12A5	49	41
C/C(=C\CN1CCC[C@]1(C)Cc1ccc(C)cc1)C(=O)O	ZINC000872162933	CG	On-Demand	Anodyne	SLC12A5	49	41
C/C(=C/CN1CCC[C@@]1(C)Cc1ccc(C)cc1)C(=O)O	ZINC000872162934	CG	On-Demand	Anodyne	SLC12A5	49	41
O=C(O)c1cccnc1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162937	EF	On-Demand	Anodyne	OPRL1	17	47
Cc1ccccc1[C@@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162945	FH	On-Demand	Anodyne	OPRL1	49	74
Cc1ccccc1[C@H](C(=O)O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162946	FH	On-Demand	Anodyne	OPRL1	49	74
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1ccccc1	ZINC000872162949	CD	On-Demand	Anodyne	SLC18A3	15	47
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1ccccc1	ZINC000872162949	CD	On-Demand	Anodyne	ACHP_LYMST	15	46
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1ccccc1	ZINC000872162949	CD	On-Demand	Anodyne	Q8WSF8_APLCA	34	46
O=C(O)C12CCC(CC1)N2C[C@H](O)c1ccccc1	ZINC000872162950	CD	On-Demand	Anodyne	SLC18A3	15	47
O=C(O)C12CCC(CC1)N2C[C@H](O)c1ccccc1	ZINC000872162950	CD	On-Demand	Anodyne	ACHP_LYMST	15	46
O=C(O)C12CCC(CC1)N2C[C@H](O)c1ccccc1	ZINC000872162950	CD	On-Demand	Anodyne	Q8WSF8_APLCA	34	46
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	FKBP1A	35	42
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	LTA4H	40	54
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	PTGER4	28	50
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	HRH3	18	41
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	PREP	60	37
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	FAAH	19	43
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	CHRNA10	47	36
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	CCR8	20	40
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	CRTM	54	40
O=C(O)CCCCN1CCC[C@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162953	FJ	On-Demand	Anodyne	ACKR3	52	32
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	FKBP1A	35	42
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	LTA4H	40	54
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	PTGER4	28	50
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	HRH3	18	41
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	PREP	60	37
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	FAAH	19	43
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	CHRNA10	47	36
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	CCR8	20	40
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	CRTM	54	40
O=C(O)CCCCN1CCC[C@@H]1Cc1cccc(Oc2ccccc2)c1	ZINC000872162954	FJ	On-Demand	Anodyne	ACKR3	52	32
O=C(O)[C@H](c1c(F)cccc1Cl)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162967	GI	On-Demand	Anodyne	OPRL1	49	57
O=C(O)[C@@H](c1c(F)cccc1Cl)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872162968	GI	On-Demand	Anodyne	OPRL1	49	57
CCn1c(CN2CCC[C@H](OC3CCC3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872162971	FH	On-Demand	Anodyne	CNR2	18	43
CCn1c(CN2CCC[C@@H](OC3CCC3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872162972	FH	On-Demand	Anodyne	CNR2	18	43
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872162981	CE	On-Demand	Anodyne	ADRB3	36	42
O=C(O)C12CCC(CC1)N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872162981	CE	On-Demand	Anodyne	Q8WSF8_APLCA	19	40
O=C(O)C12CCC(CC1)N2C[C@H](O)c1cccc(Cl)c1	ZINC000872162982	CE	On-Demand	Anodyne	ADRB3	36	42
O=C(O)C12CCC(CC1)N2C[C@H](O)c1cccc(Cl)c1	ZINC000872162982	CE	On-Demand	Anodyne	Q8WSF8_APLCA	19	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162988	FG	On-Demand	Anodyne	HRH1	25	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162988	FG	On-Demand	Anodyne	LTA4H	29	41
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162988	FG	On-Demand	Anodyne	HRH3	18	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162988	FG	On-Demand	Anodyne	CCR3	27	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162988	FG	On-Demand	Anodyne	CCR5	52	34
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162989	FG	On-Demand	Anodyne	HRH1	25	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162989	FG	On-Demand	Anodyne	LTA4H	29	41
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162989	FG	On-Demand	Anodyne	HRH3	18	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162989	FG	On-Demand	Anodyne	CCR3	27	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162989	FG	On-Demand	Anodyne	CCR5	52	34
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162990	FG	On-Demand	Anodyne	HRH1	25	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162990	FG	On-Demand	Anodyne	LTA4H	29	41
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162990	FG	On-Demand	Anodyne	HRH3	18	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162990	FG	On-Demand	Anodyne	CCR3	27	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162990	FG	On-Demand	Anodyne	CCR5	52	34
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162991	FG	On-Demand	Anodyne	HRH1	25	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162991	FG	On-Demand	Anodyne	LTA4H	29	41
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162991	FG	On-Demand	Anodyne	HRH3	18	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162991	FG	On-Demand	Anodyne	CCR3	27	40
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000872162991	FG	On-Demand	Anodyne	CCR5	52	34
O=C(O)c1ccc(OC[C@H](O)CN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162996	DE	On-Demand	Anodyne	ACOX1	66	34
O=C(O)c1ccc(OC[C@H](O)CN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162996	DE	On-Demand	Anodyne	ABCB1	73	50
O=C(O)c1ccc(OC[C@@H](O)CN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162997	DE	On-Demand	Anodyne	ACOX1	66	34
O=C(O)c1ccc(OC[C@@H](O)CN2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000872162997	DE	On-Demand	Anodyne	ABCB1	73	50
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	ESR1	83	37
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	ESR2	57	37
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	LTA4H	71	48
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	HRH3	63	53
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	PSMB2	46	44
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163000	EI	On-Demand	Anodyne	PSMB1	50	44
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	ESR1	83	37
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	ESR2	57	37
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	LTA4H	71	48
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	HRH3	63	53
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	PSMB2	46	44
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](C3CCC3)CC2)cc1	ZINC000872163001	EI	On-Demand	Anodyne	PSMB1	50	44
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	ESR1	83	37
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	ESR2	57	37
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	LTA4H	71	48
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	HRH3	63	53
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	PSMB2	46	44
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163002	EI	On-Demand	Anodyne	PSMB1	50	44
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	ESR1	83	37
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	ESR2	57	37
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	LTA4H	71	48
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	HRH3	63	53
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	PSMB2	46	44
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000872163003	EI	On-Demand	Anodyne	PSMB1	50	44
O=C(O)c1ccc(Cl)c(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163004	FI	On-Demand	Anodyne	OPRL1	35	50
O=C(O)c1cccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)cs2)c1	ZINC000872163005	GI	On-Demand	Anodyne	CPT1A	19	47
O=C(O)c1cccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)cs2)c1	ZINC000872163005	GI	On-Demand	Anodyne	SCN5A	46	35
O=C(O)c1cccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)cs2)c1	ZINC000872163006	GI	On-Demand	Anodyne	CPT1A	19	47
O=C(O)c1cccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)cs2)c1	ZINC000872163006	GI	On-Demand	Anodyne	SCN5A	46	35
O=C(O)c1c(CN2C[C@H]3CC=CC[C@H]3C2)nc2ccccc2c1-c1ccccc1	ZINC000872163007	GJ	On-Demand	Anodyne	TSPO	16	41
O=C(O)COCCN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163008	DD	On-Demand	Anodyne	OPRL1	17	52
O=C(O)c1ccccc1CCN1C[C@H]2CC=CC[C@H]2C1	ZINC000872163012	CF	On-Demand	Anodyne	SLC6A1	55	34
O=C(O)c1cccc(Cl)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872163019	EH	On-Demand	Anodyne	SLC6A1	106	40
O=C(O)c1cccc(Cl)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872163019	EH	On-Demand	Anodyne	HRH1	24	44
O=C(O)c1cccc(Cl)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872163019	EH	On-Demand	Anodyne	SIGMAR1	24	45
O=C(O)c1cccc(Cl)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872163019	EH	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1cccc(Cl)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163020	EH	On-Demand	Anodyne	SLC6A1	106	40
O=C(O)c1cccc(Cl)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163020	EH	On-Demand	Anodyne	HRH1	24	44
O=C(O)c1cccc(Cl)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163020	EH	On-Demand	Anodyne	SIGMAR1	24	45
O=C(O)c1cccc(Cl)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163020	EH	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)o1	ZINC000872163025	EF	On-Demand	Anodyne	OPRL1	16	49
O=C(O)C12CCC(CC1)N2CC[C@H](O)c1ccccc1	ZINC000872163032	CE	On-Demand	Anodyne	SLC6A3	26	42
O=C(O)C12CCC(CC1)N2CC[C@H](O)c1ccccc1	ZINC000872163032	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
O=C(O)C12CCC(CC1)N2CC[C@@H](O)c1ccccc1	ZINC000872163033	CE	On-Demand	Anodyne	SLC6A3	26	42
O=C(O)C12CCC(CC1)N2CC[C@@H](O)c1ccccc1	ZINC000872163033	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163046	FG	On-Demand	Anodyne	OPRL1	21	55
O=C(O)c1ccc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1Cl	ZINC000872163048	FI	On-Demand	Anodyne	OPRL1	30	47
O=C(O)[C@@H](c1cccc(Cl)c1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872163049	FJ	On-Demand	Anodyne	CCR3	16	42
O=C(O)[C@H](c1cccc(Cl)c1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872163050	FJ	On-Demand	Anodyne	CCR3	16	42
O=C(O)[C@H](c1cccc(Cl)c1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872163051	FJ	On-Demand	Anodyne	CCR3	16	42
O=C(O)[C@@H](c1cccc(Cl)c1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872163052	FJ	On-Demand	Anodyne	CCR3	16	42
O=C(O)c1cccnc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872163056	DF	On-Demand	Anodyne	SLC6A1	60	34
O=C(O)c1cccnc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163057	DF	On-Demand	Anodyne	SLC6A1	60	34
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HTR1A	23	42
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	DRD2	18	42
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HRH2	15	47
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	SLC6A1	142	40
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HRH1	33	52
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HTR4	25	41
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	LTA4H	55	45
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HTR7	27	48
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	ABCB1	30	49
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	PSMB1	42	39
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HCN1	46	34
O=C(O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163063	EG	On-Demand	Anodyne	HCN4	43	34
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HTR1A	23	42
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	DRD2	18	42
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HRH2	15	47
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	SLC6A1	142	40
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HRH1	33	52
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HTR4	25	41
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	LTA4H	55	45
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HTR7	27	48
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	ABCB1	30	49
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	PSMB1	42	39
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HCN1	46	34
O=C(O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163064	EG	On-Demand	Anodyne	HCN4	43	34
O=C(O)c1csc(CN2CC[C@H](Oc3cccc(F)c3)C2)c1	ZINC000872163078	DG	On-Demand	Anodyne	HRH1	22	41
O=C(O)c1csc(CN2CC[C@H](Oc3cccc(F)c3)C2)c1	ZINC000872163078	DG	On-Demand	Anodyne	CCR3	44	41
O=C(O)c1csc(CN2CC[C@H](Oc3cccc(F)c3)C2)c1	ZINC000872163078	DG	On-Demand	Anodyne	CCR5	40	34
O=C(O)c1csc(CN2CC[C@@H](Oc3cccc(F)c3)C2)c1	ZINC000872163079	DG	On-Demand	Anodyne	HRH1	22	41
O=C(O)c1csc(CN2CC[C@@H](Oc3cccc(F)c3)C2)c1	ZINC000872163079	DG	On-Demand	Anodyne	CCR3	44	41
O=C(O)c1csc(CN2CC[C@@H](Oc3cccc(F)c3)C2)c1	ZINC000872163079	DG	On-Demand	Anodyne	CCR5	40	34
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	FKBP1A	18	44
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	LTA4H	25	41
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	FAAH	20	44
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	AMP1_PLAFQ	20	41
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	CCR8	25	42
O=C(O)C1(CN2CCC[C@@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163080	FI	On-Demand	Anodyne	CRTM	47	38
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	FKBP1A	18	44
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	LTA4H	25	41
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	FAAH	20	44
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	AMP1_PLAFQ	20	41
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	CCR8	25	42
O=C(O)C1(CN2CCC[C@H]2Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000872163081	FI	On-Demand	Anodyne	CRTM	47	38
C[C@@H](c1ccc(C(=O)O)o1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163097	EH	On-Demand	Anodyne	OPRL1	30	52
C[C@H](c1ccc(C(=O)O)o1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163098	EH	On-Demand	Anodyne	OPRL1	30	52
O=C(O)CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872163116	CE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872163117	CE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	HRH1	31	47
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	OPRK1	20	43
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	HRH3	22	41
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	SIGMAR1	45	46
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	SSTR5	42	41
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	CCR3	47	47
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	UTS2R	18	40
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872163119	EH	On-Demand	Anodyne	MCHR1	33	42
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	HRH1	31	47
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	OPRK1	20	43
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	HRH3	22	41
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	SIGMAR1	45	46
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	SSTR5	42	41
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	CCR3	47	47
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	UTS2R	18	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872163120	EH	On-Demand	Anodyne	MCHR1	33	42
O=C(O)c1sc2ccccc2c1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163127	GJ	On-Demand	Anodyne	OPRL1	21	48
O=C(O)c1cc(F)ccc1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000872163130	FH	On-Demand	Anodyne	OPRL1	21	46
C/C(=C/CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)O	ZINC000872163131	DF	On-Demand	Anodyne	OPRL1	19	52
C/C(=C\CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)O	ZINC000872163132	DF	On-Demand	Anodyne	OPRL1	19	52
O=C(O)c1cccc(OCCN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163155	FG	On-Demand	Anodyne	OPRM1	15	45
O=C(O)c1cccc(OCCN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163155	FG	On-Demand	Anodyne	OPRL1	15	45
O=C(O)c1cccc(OCCN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163155	FG	On-Demand	Anodyne	KCNH2	41	42
O=C(O)c1cccc(OCCN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163155	FG	On-Demand	Anodyne	PLA2G4B	26	41
O=C(O)c1csc(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000872163156	EG	On-Demand	Anodyne	OPRL1	15	48
O=C(O)C1CCC(O)(CN2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000872163157	FF	On-Demand	Anodyne	OPRL1	25	51
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	SLC6A1	53	38
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	HRH1	17	40
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	HRH3	16	40
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	SIGMAR1	34	46
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	SSTR5	43	39
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	CCR3	49	40
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872163158	DG	On-Demand	Anodyne	MCHR1	31	41
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	SLC6A1	53	38
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	HRH1	17	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	HRH3	16	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	SIGMAR1	34	46
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	SSTR5	43	39
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	CCR3	49	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872163159	DG	On-Demand	Anodyne	MCHR1	31	41
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872163180	GH	On-Demand	Anodyne	HRH1	24	45
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872163180	GH	On-Demand	Anodyne	CCR3	48	45
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872163180	GH	On-Demand	Anodyne	MLNR	25	47
O=C(O)c1ccc(Br)cc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872163181	GH	On-Demand	Anodyne	HRH1	24	45
O=C(O)c1ccc(Br)cc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872163181	GH	On-Demand	Anodyne	CCR3	48	45
O=C(O)c1ccc(Br)cc1CN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872163181	GH	On-Demand	Anodyne	MLNR	25	47
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	ESR1	71	35
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	SLC6A1	54	34
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	ESR2	50	36
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	LTA4H	67	47
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	HRH3	53	51
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	PSMB2	44	42
O=C(O)/C=C\c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163182	FH	On-Demand	Anodyne	PSMB1	48	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	ESR1	71	35
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	SLC6A1	54	34
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	ESR2	50	36
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	LTA4H	67	47
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	HRH3	53	51
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	PSMB2	44	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872163183	FH	On-Demand	Anodyne	PSMB1	48	42
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	ESR1	71	35
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	SLC6A1	54	34
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	ESR2	50	36
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	LTA4H	67	47
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	HRH3	53	51
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	PSMB2	44	42
O=C(O)/C=C\c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163184	FH	On-Demand	Anodyne	PSMB1	48	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	ESR1	71	35
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	SLC6A1	54	34
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	ESR2	50	36
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	LTA4H	67	47
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	HRH3	53	51
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	PSMB2	44	42
O=C(O)/C=C/c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872163185	FH	On-Demand	Anodyne	PSMB1	48	42
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000872163186	EE	On-Demand	Anodyne	ACOX1	60	32
O=C(O)c1ccc(OC[C@H](O)CN2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000872163186	EE	On-Demand	Anodyne	ABCB1	62	50
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000872163187	EE	On-Demand	Anodyne	ACOX1	60	32
O=C(O)c1ccc(OC[C@@H](O)CN2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000872163187	EE	On-Demand	Anodyne	ABCB1	62	50
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)c(F)c1	ZINC000872163188	DG	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)c(F)c1	ZINC000872163188	DG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)c(F)c1	ZINC000872163189	DG	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)c(F)c1	ZINC000872163189	DG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	DRD4	25	41
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	SLC6A1	54	34
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	GRIN2B	58	44
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	FDFT1	20	41
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	SIGMAR1	34	44
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	CCR3	32	47
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	CCR5	15	44
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163202	GF	On-Demand	Anodyne	MAPK1	23	44
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CHRM2	16	41
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	DRD2	15	44
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	DRD4	44	44
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	ACHE	40	49
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	HRH1	18	43
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	GRIN2B	56	43
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	LTA4H	20	40
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	HRH3	23	47
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	SIGMAR1	44	44
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CHEK2	15	40
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CCR3	62	43
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CCR5	15	44
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	FAAH	16	48
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CXCR3	34	41
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	MCHR1	34	46
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CACNA1I	53	42
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000872163203	EH	On-Demand	Anodyne	CYP2J2	46	33
O=C(O)c1cccc(Cl)c1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163204	GI	On-Demand	Anodyne	CPT1A	39	43
O=C(O)c1cccc(Cl)c1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163204	GI	On-Demand	Anodyne	ETHR	56	43
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HTR1A	42	50
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	DRD2	50	44
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	DRD4	43	42
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	ACHE	37	42
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HTR2A	44	49
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HTR2C	24	44
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	SLC6A1	86	39
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	SLC6A4	15	41
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	ADRA1A	15	44
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HRH1	36	52
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	ADRA1B	15	44
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	DRD3	44	38
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HTR4	76	51
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	GRIN2B	52	40
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HTR7	65	40
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	HRH3	26	43
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	SIGMAR1	74	50
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	PRCP	20	42
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	CCR3	50	46
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	CCR5	26	45
O=C(O)CCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163205	CG	On-Demand	Anodyne	CYP2J2	56	40
O=C(O)CCCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163206	DF	On-Demand	Anodyne	ETHR	59	53
O=C(O)c1cnoc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163215	DF	On-Demand	Anodyne	DRD2	18	45
O=C(O)c1cnoc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163215	DF	On-Demand	Anodyne	SLC18A3	22	40
O=C(O)c1cnoc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163215	DF	On-Demand	Anodyne	MGEA5	26	41
COc1ccccc1[C@@H]1CN(Cc2occc2C(=O)O)CCO1	ZINC000872163247	DF	On-Demand	Anodyne	DRD4	21	43
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	DRD2	20	47
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	DRD4	37	47
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	ACHE	43	43
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	SLC6A1	40	35
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	HRH1	19	45
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	SIGMAR1	56	50
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	CCR3	43	45
O=C(O)c1sccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163259	EJ	On-Demand	Anodyne	CCR5	15	40
O=C(O)c1ccc(Cl)c(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163261	GI	On-Demand	Anodyne	PRCP	25	40
O=C(O)c1ccc(Cl)c(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163261	GI	On-Demand	Anodyne	ETHR	63	45
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CHRM2	37	53
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	HTR1A	20	52
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	DRD2	42	52
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	DRD4	95	51
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	ACHE	68	57
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	HRH2	19	43
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	HTR2A	18	52
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	HRH1	37	56
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	DRD3	26	51
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	SLC6A3	22	47
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	GRIN1	15	41
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	KCNH2	19	49
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CHRM3	36	46
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	GRIN2B	77	47
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	LTA4H	22	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	PTGER1	30	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	HRH3	21	50
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	SIGMAR1	88	53
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	SSTR5	39	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	BCHE	18	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CCR3	108	56
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CCR5	34	44
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	BDKRB1	24	42
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	FAAH	31	45
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CCR2	21	51
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	ST14	49	39
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CXCR3	45	44
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	GRIN2C	24	45
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	MCHR1	65	51
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CACNA1G	43	39
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CACNA1I	70	49
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CCR8	22	43
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	AKR1C3	25	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	CYP2J2	44	32
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	ARG1	22	43
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	PA	22	40
O=C(O)c1cccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163262	EI	On-Demand	Anodyne	ARG2	22	43
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	DRD2	21	44
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	DRD4	26	50
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	KCNH2	22	41
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	SIGMAR1	44	46
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	CCR3	69	48
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	SLC18A3	28	46
O=C(O)c1cc2cc(CN3CCC(c4ccc(F)cc4)CC3)ccc2o1	ZINC000872163263	FJ	On-Demand	Anodyne	MCHR1	49	47
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	DRD2	26	44
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	DRD4	50	53
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	ACHE	21	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	HRH1	19	43
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	DRD3	23	44
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	HTR4	30	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	SIGMAR1	26	42
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	CCR3	29	42
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CCO1	ZINC000872163269	FH	On-Demand	Anodyne	MCHR1	15	40
COc1ccccc1[C@@H]1CN(C/C=C(\C)C(=O)O)CCO1	ZINC000872163274	CE	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@@H]1CN(C/C=C(/C)C(=O)O)CCO1	ZINC000872163277	CE	On-Demand	Anodyne	DRD4	15	43
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	DRD2	19	42
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	DRD4	36	42
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	ACHE	50	45
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	HRH1	22	42
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	DRD3	15	41
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	GRIN2B	38	40
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	HRH3	20	45
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	SIGMAR1	50	46
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	CCR3	45	40
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)nc1	ZINC000872163280	EH	On-Demand	Anodyne	CYP2J2	47	33
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1Cl	ZINC000872163281	GI	On-Demand	Anodyne	CPT1A	20	41
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1Cl	ZINC000872163281	GI	On-Demand	Anodyne	ETHR	57	43
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	DRD2	17	46
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	DRD4	22	42
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	SIGMAR1	43	44
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	CCR3	43	41
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	SLC18A3	26	46
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	MCHR1	33	43
O=C(O)c1cc(CN2CCC(c3ccc(F)cc3)CC2)cs1	ZINC000872163282	DH	On-Demand	Anodyne	CACNA1G	40	40
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	DRD4	15	42
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	HRH1	15	47
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	SLC6A3	26	40
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	GRIN2B	57	44
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	SIGMAR1	21	42
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	CCR3	63	47
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	CCR5	17	43
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	EBP	17	40
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	GRIN2C	22	44
CC[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163297	CG	On-Demand	Anodyne	CACNA1I	50	35
CCCC[C@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163301	DF	On-Demand	Anodyne	EDNRB	52	38
CCCC[C@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163301	DF	On-Demand	Anodyne	EDNRA	49	39
CCCC[C@@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163302	DF	On-Demand	Anodyne	EDNRB	52	38
CCCC[C@@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163302	DF	On-Demand	Anodyne	EDNRA	49	39
CCCC[C@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163303	DF	On-Demand	Anodyne	EDNRB	52	38
CCCC[C@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163303	DF	On-Demand	Anodyne	EDNRA	49	39
CCCC[C@@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163304	DF	On-Demand	Anodyne	EDNRB	52	38
CCCC[C@@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163304	DF	On-Demand	Anodyne	EDNRA	49	39
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	HTR1A	19	51
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	DRD2	28	47
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	DRD4	47	46
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	ACHE	23	42
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	HTR2A	21	53
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	SLC6A4	16	42
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	HRH1	30	50
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	DRD3	22	41
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	SLC6A3	21	42
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	HTR4	44	42
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	GRIN2B	69	52
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	LTA4H	17	42
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	TBXA2R	29	40
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	HRH3	26	53
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	SIGMAR1	60	53
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	PRCP	23	40
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CCR1	43	35
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CCR3	68	50
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CCR5	23	46
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	GRIN2C	26	52
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	MCHR1	22	43
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CACNA1G	21	46
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CACNA1I	55	36
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	CYP2J2	51	37
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	ARG1	29	41
O=C(O)CCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163305	DH	On-Demand	Anodyne	ARG2	25	41
O=C(O)[C@@H](C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163308	DE	On-Demand	Anodyne	ETHR	45	48
O=C(O)[C@H](C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163309	DE	On-Demand	Anodyne	ETHR	45	48
O=C(O)c1ccccc1CCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163310	CF	On-Demand	Anodyne	SLC6A1	78	35
O=C(O)c1ccccc1CCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163310	CF	On-Demand	Anodyne	BIRC2	42	38
O=C(O)c1ccccc1CCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163311	CF	On-Demand	Anodyne	SLC6A1	78	35
O=C(O)c1ccccc1CCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163311	CF	On-Demand	Anodyne	BIRC2	42	38
O=C(O)c1ccccc1CCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163312	CF	On-Demand	Anodyne	SLC6A1	78	35
O=C(O)c1ccccc1CCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163312	CF	On-Demand	Anodyne	BIRC2	42	38
O=C(O)c1ccccc1CCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163313	CF	On-Demand	Anodyne	SLC6A1	78	35
O=C(O)c1ccccc1CCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163313	CF	On-Demand	Anodyne	BIRC2	42	38
O=C(O)[C@H](c1ccsc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163316	EI	On-Demand	Anodyne	GRIN2B	38	42
O=C(O)[C@H](c1ccsc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163316	EI	On-Demand	Anodyne	GRIN2C	19	42
O=C(O)[C@@H](c1ccsc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163317	EI	On-Demand	Anodyne	GRIN2B	38	42
O=C(O)[C@@H](c1ccsc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163317	EI	On-Demand	Anodyne	GRIN2C	19	42
CC[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163318	CG	On-Demand	Anodyne	HRH1	18	50
CC[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163318	CG	On-Demand	Anodyne	GRIN2B	41	40
CC[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163318	CG	On-Demand	Anodyne	SIGMAR1	22	41
CC[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163318	CG	On-Demand	Anodyne	CCR3	37	50
O=C(O)[C@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163324	EG	On-Demand	Anodyne	CPT1A	17	45
O=C(O)[C@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163324	EG	On-Demand	Anodyne	SMO	36	41
O=C(O)[C@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163324	EG	On-Demand	Anodyne	ETHR	64	45
O=C(O)[C@@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163325	EG	On-Demand	Anodyne	CPT1A	17	45
O=C(O)[C@@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163325	EG	On-Demand	Anodyne	SMO	36	41
O=C(O)[C@@H](c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163325	EG	On-Demand	Anodyne	ETHR	64	45
O=C(O)c1ccccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163339	EG	On-Demand	Anodyne	CPT1A	37	46
O=C(O)c1ccccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163339	EG	On-Demand	Anodyne	ETHR	59	46
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	CHRM2	21	40
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	DRD2	19	41
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	DRD4	52	45
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	ACHE	39	43
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	HRH1	28	47
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	GRIN2B	75	42
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	HRH3	19	47
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	SIGMAR1	49	45
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	CCR3	71	44
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	CCR5	18	42
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	FAAH	18	46
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	GRIN2C	22	42
O=C(O)c1cccnc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163350	EH	On-Demand	Anodyne	MCHR1	23	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	DRD2	26	51
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	DRD4	24	42
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	ACHE	16	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	HTR2A	29	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	HTR2C	17	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	ADRA1A	18	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	HRH1	20	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	ADRA1B	15	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	SIGMAR1	37	48
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	CCR1	20	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	CCR3	32	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	CCR5	17	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	SLC18A3	36	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	MCHR1	35	48
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1	ZINC000872163351	EI	On-Demand	Anodyne	CACNA1G	34	41
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	DRD4	26	44
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	ACHE	27	42
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	HRH1	20	43
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	GRIN2B	64	46
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	HRH3	15	45
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	SIGMAR1	38	46
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	CCR3	60	44
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	CCR5	17	43
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	GRIN2C	22	46
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	MCHR1	15	43
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	CACNA1I	70	38
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	CYP2J2	49	35
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	ARG1	31	42
C[C@@](O)(CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872163353	DE	On-Demand	Anodyne	ARG2	28	42
O=C(O)Cn1cc(CCN2CCC(c3ccc(F)cc3)CC2)nn1	ZINC000872163354	ED	On-Demand	Anodyne	DRD2	15	46
O=C(O)Cn1cc(CCN2CCC(c3ccc(F)cc3)CC2)nn1	ZINC000872163354	ED	On-Demand	Anodyne	HTR2A	16	40
O=C(O)Cn1cc(CCN2CCC(c3ccc(F)cc3)CC2)nn1	ZINC000872163354	ED	On-Demand	Anodyne	SIGMAR1	18	43
O=C(O)Cn1cc(CCN2CCC(c3ccc(F)cc3)CC2)nn1	ZINC000872163354	ED	On-Demand	Anodyne	PRCP	24	41
COC1([C@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)CCC1	ZINC000872163359	DG	On-Demand	Anodyne	CCR1	19	40
COC1([C@@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)CCC1	ZINC000872163360	DG	On-Demand	Anodyne	CCR1	19	40
CC[C@@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163367	CD	On-Demand	Anodyne	EDNRB	53	35
CC[C@@H](C(=O)O)N1CCO[C@H](c2ccc(OC)cc2)C1	ZINC000872163367	CD	On-Demand	Anodyne	EDNRA	48	36
CC[C@@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163369	CD	On-Demand	Anodyne	EDNRB	53	35
CC[C@@H](C(=O)O)N1CCO[C@@H](c2ccc(OC)cc2)C1	ZINC000872163369	CD	On-Demand	Anodyne	EDNRA	48	36
C[C@H](c1ccc(C(=O)O)o1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163373	DI	On-Demand	Anodyne	CCR1	26	45
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163374	DI	On-Demand	Anodyne	CCR1	26	45
COc1ccccc1[C@@H]1CN(CC2(C(=O)O)CC2)CCO1	ZINC000872163379	CD	On-Demand	Anodyne	DRD4	15	40
O=C(O)[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163387	FI	On-Demand	Anodyne	CNR1	48	29
O=C(O)[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163388	FI	On-Demand	Anodyne	CNR1	48	29
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	HRH1	18	45
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	GRIN2B	52	42
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	CCR3	34	45
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	CHRNA7	37	40
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	C3AR1	38	41
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163389	EH	On-Demand	Anodyne	GRIN2C	19	42
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	HRH1	18	45
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	GRIN2B	52	42
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	CCR3	34	45
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	CHRNA7	37	40
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	C3AR1	38	41
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163390	EH	On-Demand	Anodyne	GRIN2C	19	42
O=C(O)c1cccc(Cl)c1CN1CCC[C@H](C(F)(F)F)C1	ZINC000872163391	DH	On-Demand	Anodyne	SLC6A1	128	42
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	DRD2	30	54
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	DRD4	35	49
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	ACHE	15	43
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	HTR2A	24	51
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	SLC6A1	51	33
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	SLC6A3	27	40
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	HTR7	15	48
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	SIGMAR1	60	51
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	PRCP	26	45
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	CCR1	22	45
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	CCR3	51	48
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	CCR5	34	49
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	SLC18A3	76	49
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	CCR2	17	44
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	MCHR1	32	42
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	CACNA1G	41	43
O=C(O)Cc1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163392	EH	On-Demand	Anodyne	MGEA5	26	42
O=C(O)Cc1ccccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163393	FG	On-Demand	Anodyne	CPT1A	35	47
O=C(O)Cc1ccccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163393	FG	On-Demand	Anodyne	ETHR	64	47
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	DRD4	33	43
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	ACHE	27	42
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	GRIN2B	60	46
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	HRH3	17	47
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	SIGMAR1	40	45
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	CCR3	53	40
O=C(O)c1cnc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cn1	ZINC000872163396	EG	On-Demand	Anodyne	MCHR1	21	42
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	DRD2	26	41
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	HTR2A	22	40
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	SLC6A1	43	35
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	HRH1	25	43
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	HTR7	18	43
COc1ccccc1[C@@H]1CN(CCOc2ccc(C(=O)O)cc2Cl)CCO1	ZINC000872163399	GG	On-Demand	Anodyne	MCL1	42	34
O=C(O)C1(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163401	DG	On-Demand	Anodyne	DRD4	15	43
O=C(O)C1(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163401	DG	On-Demand	Anodyne	HRH1	18	45
O=C(O)C1(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163401	DG	On-Demand	Anodyne	GRIN2B	41	38
O=C(O)C1(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872163401	DG	On-Demand	Anodyne	SIGMAR1	43	45
O=C(O)[C@@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163406	DH	On-Demand	Anodyne	SLC6A3	25	40
O=C(O)[C@@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163406	DH	On-Demand	Anodyne	PRCP	24	46
O=C(O)[C@@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163406	DH	On-Demand	Anodyne	CCR1	25	48
O=C(O)[C@@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163406	DH	On-Demand	Anodyne	CCR5	29	49
O=C(O)[C@@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163406	DH	On-Demand	Anodyne	SLC18A3	63	40
O=C(O)[C@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163407	DH	On-Demand	Anodyne	SLC6A3	25	40
O=C(O)[C@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163407	DH	On-Demand	Anodyne	PRCP	24	46
O=C(O)[C@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163407	DH	On-Demand	Anodyne	CCR1	25	48
O=C(O)[C@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163407	DH	On-Demand	Anodyne	CCR5	29	49
O=C(O)[C@H](c1ccccc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163407	DH	On-Demand	Anodyne	SLC18A3	63	40
COc1ccccc1[C@@H]1CN([C@H](C(=O)O)c2ccccc2C(F)(F)F)CCO1	ZINC000872163410	GH	On-Demand	Anodyne	RBP4	81	37
COc1ccccc1[C@@H]1CN([C@@H](C(=O)O)c2ccccc2C(F)(F)F)CCO1	ZINC000872163411	GH	On-Demand	Anodyne	RBP4	81	37
O=C(O)[C@H](C1CC1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163412	CF	On-Demand	Anodyne	CCR1	21	44
O=C(O)[C@H](C1CC1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163412	CF	On-Demand	Anodyne	CCR5	38	57
O=C(O)[C@@H](C1CC1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163413	CF	On-Demand	Anodyne	CCR1	21	44
O=C(O)[C@@H](C1CC1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163413	CF	On-Demand	Anodyne	CCR5	38	57
O=C(O)[C@H](c1ccsc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163414	EG	On-Demand	Anodyne	ETHR	57	42
O=C(O)[C@@H](c1ccsc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163415	EG	On-Demand	Anodyne	ETHR	57	42
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	HTR1A	62	46
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	DRD2	52	42
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	DRD4	39	41
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	ADRA1D	47	36
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	ADRA1A	45	37
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	ADRA1B	42	36
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	HTR7	47	46
COc1ccccc1[C@@H]1CN(CCCCC(=O)O)CCO1	ZINC000872163416	CE	On-Demand	Anodyne	SIGMAR1	26	41
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	DRD4	22	45
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	GRIN2B	63	47
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	SIGMAR1	38	47
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	CCR3	57	43
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	GRIN2C	23	47
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	CACNA1I	53	35
O=C(O)C1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163437	DG	On-Demand	Anodyne	PA	27	42
O=C(O)[C@H](c1cccnc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163440	CD	On-Demand	Anodyne	PTAFR	18	40
O=C(O)[C@H](c1cccnc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000872163441	CD	On-Demand	Anodyne	PTAFR	18	40
O=C(O)[C@H](c1cccnc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000872163442	CD	On-Demand	Anodyne	PTAFR	18	40
O=C(O)[C@H](c1cccnc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000872163443	CD	On-Demand	Anodyne	PTAFR	18	40
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CHRM2	26	49
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HTR1A	21	49
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	DRD2	50	50
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	DRD4	85	47
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	ACHE	73	57
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HRH2	23	47
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HTR2A	21	48
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HRH1	37	58
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	OPRM1	15	45
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	DRD3	38	47
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	OPRK1	23	47
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	SLC6A3	19	44
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	KCNH2	19	46
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HTR4	36	42
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CHRM3	33	45
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	GRIN2B	71	44
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	LTA4H	19	40
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	FABP4	44	40
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	HRH3	22	49
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	SIGMAR1	97	57
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	BCHE	19	42
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CCR3	89	58
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CCR5	30	41
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	BDKRB1	36	45
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	UTS2R	15	40
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	FAAH	23	44
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CCR2	17	41
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CXCR3	29	41
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	MCHR1	54	47
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CACNA1G	47	41
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CACNA1I	59	46
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CCR8	21	40
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	CYP2J2	45	31
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	ARG1	22	41
O=C(O)c1cccc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163444	EI	On-Demand	Anodyne	ARG2	25	41
O=C(O)C1CCC(O)(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163451	FH	On-Demand	Anodyne	GRIN2B	48	44
O=C(O)C1CCC(O)(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163451	FH	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)C1CCC(O)(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163451	FH	On-Demand	Anodyne	CCR3	36	40
O=C(O)C1CCC(O)(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163451	FH	On-Demand	Anodyne	CCR5	17	43
O=C(O)C1CCC(O)(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872163451	FH	On-Demand	Anodyne	GRIN2C	16	44
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)cc1	ZINC000872163452	GK	On-Demand	Anodyne	DRD2	15	45
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)cc1	ZINC000872163452	GK	On-Demand	Anodyne	DRD4	17	46
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)cc1	ZINC000872163452	GK	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)cc1	ZINC000872163452	GK	On-Demand	Anodyne	MCHR1	29	42
COc1ccccc1[C@@H]1CN(Cc2ccccc2C(=O)O)CCO1	ZINC000872163454	EF	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@@H]1CN(Cc2ccccc2C(=O)O)CCO1	ZINC000872163454	EF	On-Demand	Anodyne	DRD4	32	45
COc1ccccc1[C@@H]1CN(Cc2ccccc2C(=O)O)CCO1	ZINC000872163454	EF	On-Demand	Anodyne	FABP4	29	44
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC[C@H](C(F)(F)F)C1	ZINC000872163455	FH	On-Demand	Anodyne	SLC6A1	55	33
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC[C@H](C(F)(F)F)C1	ZINC000872163455	FH	On-Demand	Anodyne	PDE8B	59	35
CCCC[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163461	CH	On-Demand	Anodyne	CCR1	24	42
CCCC[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163461	CH	On-Demand	Anodyne	CCR5	98	35
CCCC[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163461	CH	On-Demand	Anodyne	CCR2	15	40
CCCC[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163462	CH	On-Demand	Anodyne	CCR1	24	42
CCCC[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163462	CH	On-Demand	Anodyne	CCR5	98	35
CCCC[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163462	CH	On-Demand	Anodyne	CCR2	15	40
COc1ccccc1[C@@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CCO1	ZINC000872163464	GH	On-Demand	Anodyne	DRD4	16	40
COc1ccccc1[C@@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CCO1	ZINC000872163464	GH	On-Demand	Anodyne	PDE8B	60	36
CCn1c(CN2CCO[C@H](c3ccc(OC)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872163465	GG	On-Demand	Anodyne	CNR2	15	45
CCn1c(CN2CCO[C@@H](c3ccc(OC)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872163466	GG	On-Demand	Anodyne	CNR2	15	45
O=C(O)c1cc(CN2CCC(c3nc(C4CCC4)no3)CC2)cs1	ZINC000872163468	EG	On-Demand	Anodyne	ETHR	61	44
O=C(O)C1(CN2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000872163469	DE	On-Demand	Anodyne	ETHR	54	49
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	DRD2	21	47
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	DRD4	16	43
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	HTR2A	18	44
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	SIGMAR1	42	44
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	PRCP	18	40
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	SLC18A3	47	43
O=C(O)c1oc2ccccc2c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163478	FJ	On-Demand	Anodyne	MGEA5	24	40
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	HRH2	39	47
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	HRH1	18	47
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	LTA4H	37	42
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	HRH3	23	40
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872163479	DE	On-Demand	Anodyne	PLA2G4B	25	41
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	HRH2	39	47
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	HRH1	18	47
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	LTA4H	37	42
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	HRH3	23	40
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872163480	DE	On-Demand	Anodyne	PLA2G4B	25	41
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	HRH2	39	47
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	HRH1	18	47
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	LTA4H	37	42
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	HRH3	23	40
O=C(O)c1cccc(OCCN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872163481	DE	On-Demand	Anodyne	PLA2G4B	25	41
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	HRH2	39	47
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	HRH1	18	47
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	LTA4H	37	42
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	HRH3	23	40
O=C(O)c1cccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872163482	DE	On-Demand	Anodyne	PLA2G4B	25	41
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163483	FI	On-Demand	Anodyne	RBP4	65	41
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163483	FI	On-Demand	Anodyne	SFRP1	58	31
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163484	FI	On-Demand	Anodyne	RBP4	65	41
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](C(F)(F)F)C1	ZINC000872163484	FI	On-Demand	Anodyne	SFRP1	58	31
O=C(O)c1cccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)c1	ZINC000872163486	GK	On-Demand	Anodyne	DRD2	19	44
O=C(O)c1cccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)c1	ZINC000872163486	GK	On-Demand	Anodyne	DRD4	22	46
O=C(O)c1cccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)c1	ZINC000872163486	GK	On-Demand	Anodyne	CCR3	23	40
O=C(O)c1cccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)cs2)c1	ZINC000872163486	GK	On-Demand	Anodyne	MCHR1	33	42
COc1ccccc1[C@@H]1CN([C@H](C(=O)O)c2cccc(Cl)c2)CCO1	ZINC000872163490	FH	On-Demand	Anodyne	FDFT1	42	35
COc1ccccc1[C@@H]1CN([C@@H](C(=O)O)c2cccc(Cl)c2)CCO1	ZINC000872163491	FH	On-Demand	Anodyne	FDFT1	42	35
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872163492	ED	On-Demand	Anodyne	ACOX1	63	35
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872163492	ED	On-Demand	Anodyne	ABCB1	61	46
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872163493	ED	On-Demand	Anodyne	ACOX1	63	35
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872163493	ED	On-Demand	Anodyne	ABCB1	61	46
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000872163494	ED	On-Demand	Anodyne	ACOX1	63	35
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000872163494	ED	On-Demand	Anodyne	ABCB1	61	46
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000872163495	ED	On-Demand	Anodyne	ACOX1	63	35
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000872163495	ED	On-Demand	Anodyne	ABCB1	61	46
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163500	EI	On-Demand	Anodyne	HRH1	15	53
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163500	EI	On-Demand	Anodyne	SLC6A3	16	43
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163500	EI	On-Demand	Anodyne	GRIN2B	42	39
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163500	EI	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163500	EI	On-Demand	Anodyne	CCR3	27	53
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163501	EI	On-Demand	Anodyne	HRH1	15	53
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163501	EI	On-Demand	Anodyne	SLC6A3	16	43
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163501	EI	On-Demand	Anodyne	GRIN2B	42	39
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163501	EI	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163501	EI	On-Demand	Anodyne	CCR3	27	53
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	HTR1A	60	43
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	DRD2	53	42
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	DRD4	39	41
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	HTR2A	26	40
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	HTR2C	15	40
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	SLC6A1	59	40
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	ADRA1A	47	37
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	ADRA1B	44	37
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	DRD3	52	39
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	HTR7	42	43
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	SIGMAR1	26	41
COc1ccccc1[C@@H]1CN(CCCC(=O)O)CCO1	ZINC000872163524	CD	On-Demand	Anodyne	CYP2J2	46	33
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	HTR1A	24	40
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	DRD2	32	42
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	DRD4	27	42
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	HTR2A	22	43
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	SLC6A1	88	41
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	HRH1	41	52
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	HTR4	89	41
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	GRIN2B	46	38
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	LTA4H	33	41
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	HRH3	27	45
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	SIGMAR1	63	44
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	CCR3	41	41
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	CCR5	17	40
O=C(O)COCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163527	DF	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1Cl	ZINC000872163534	GI	On-Demand	Anodyne	DRD4	18	40
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1Cl	ZINC000872163534	GI	On-Demand	Anodyne	SIGMAR1	19	42
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1Cl	ZINC000872163534	GI	On-Demand	Anodyne	ETHR	44	43
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1F	ZINC000872163538	FH	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1F	ZINC000872163538	FH	On-Demand	Anodyne	S1PR1	20	40
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)cc1F	ZINC000872163538	FH	On-Demand	Anodyne	ETHR	62	46
O=C(O)c1csc(CN2CCC(c3nc(C4CCC4)no3)CC2)n1	ZINC000872163539	EF	On-Demand	Anodyne	ETHR	60	45
O=C(O)c1ccoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163540	EI	On-Demand	Anodyne	DRD4	25	42
O=C(O)c1ccoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163540	EI	On-Demand	Anodyne	HRH1	19	45
O=C(O)c1ccoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163540	EI	On-Demand	Anodyne	SIGMAR1	43	47
O=C(O)c1ccoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163540	EI	On-Demand	Anodyne	CCR3	30	43
O=C(O)c1cccnc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163548	EF	On-Demand	Anodyne	PRCP	18	40
O=C(O)c1cccnc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163548	EF	On-Demand	Anodyne	CPT1A	25	44
O=C(O)c1cccnc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163548	EF	On-Demand	Anodyne	ETHR	64	46
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	DRD4	38	42
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	ACHE	29	43
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	HRH1	16	41
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	GRIN2B	63	47
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	SIGMAR1	49	45
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	CCR3	64	43
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	GRIN2C	18	47
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	MCHR1	22	46
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	ARG1	21	40
O=C(O)c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)s1	ZINC000872163560	EJ	On-Demand	Anodyne	ARG2	20	40
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	HTR1A	19	54
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	DRD2	42	56
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	DRD1	19	54
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	DRD4	23	54
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	ADRA1D	18	44
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	HTR2A	41	46
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	HTR2C	15	45
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	SLC6A1	45	38
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	SLC6A4	19	40
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	ADRA1A	26	44
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	HRH1	33	43
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	ADRA1B	23	44
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	DRD3	16	54
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	HTR7	22	47
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	SIGMAR1	36	48
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	PRCP	30	44
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	CCR3	34	41
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	CCR5	16	45
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	SLC18A3	46	40
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	MCHR1	20	46
O=C(O)COCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163575	CE	On-Demand	Anodyne	CACNA1G	40	40
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	DRD4	26	42
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	ACHE	22	42
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	HRH2	55	45
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	HRH1	18	44
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	PPARG	45	42
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	PPARA	43	39
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	SIGMAR1	32	46
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	SSTR5	52	35
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	FAAH	23	40
CCCOc1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872163596	FI	On-Demand	Anodyne	MCHR1	25	42
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	DRD2	15	42
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	DRD4	21	42
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	SLC6A1	92	38
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	HRH1	20	45
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	GRIN2B	40	38
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	SIGMAR1	47	50
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	CCR3	40	41
C/C(=C\CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163599	DH	On-Demand	Anodyne	CCR5	18	40
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	DRD2	15	42
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	DRD4	21	42
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	SLC6A1	92	38
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	HRH1	20	45
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	GRIN2B	40	38
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	SIGMAR1	47	50
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	CCR3	40	41
C/C(=C/CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872163600	DH	On-Demand	Anodyne	CCR5	18	40
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163601	DG	On-Demand	Anodyne	GRIN2B	49	45
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163601	DG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163601	DG	On-Demand	Anodyne	CCR3	36	43
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163601	DG	On-Demand	Anodyne	CCR5	19	40
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163601	DG	On-Demand	Anodyne	GRIN2C	19	45
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163602	DG	On-Demand	Anodyne	GRIN2B	49	45
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163602	DG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163602	DG	On-Demand	Anodyne	CCR3	36	43
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163602	DG	On-Demand	Anodyne	CCR5	19	40
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163602	DG	On-Demand	Anodyne	GRIN2C	19	45
CCCc1ccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872163605	FI	On-Demand	Anodyne	S1PR5	22	40
COc1ccccc1[C@@H]1CN(CCc2ccccc2C(=O)O)CCO1	ZINC000872163612	EG	On-Demand	Anodyne	DRD2	22	40
COc1ccccc1[C@@H]1CN(CCc2ccccc2C(=O)O)CCO1	ZINC000872163612	EG	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1[C@@H]1CN(CCc2ccccc2C(=O)O)CCO1	ZINC000872163612	EG	On-Demand	Anodyne	SLC6A1	53	40
COc1ccccc1[C@@H]1CN([C@H](C)C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000872163620	GE	On-Demand	Anodyne	FURIN	43	33
COc1ccccc1[C@@H]1CN([C@H](C)C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000872163620	GE	On-Demand	Anodyne	MBTPS1	49	32
COc1ccccc1[C@@H]1CN([C@@H](C)C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000872163625	GE	On-Demand	Anodyne	FURIN	43	33
COc1ccccc1[C@@H]1CN([C@@H](C)C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000872163625	GE	On-Demand	Anodyne	MBTPS1	49	32
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163627	DG	On-Demand	Anodyne	SIGMAR1	30	43
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163627	DG	On-Demand	Anodyne	ARG1	16	42
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163627	DG	On-Demand	Anodyne	ARG2	18	42
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163629	DG	On-Demand	Anodyne	SIGMAR1	30	43
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163629	DG	On-Demand	Anodyne	ARG1	16	42
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163629	DG	On-Demand	Anodyne	ARG2	18	42
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163630	DG	On-Demand	Anodyne	SIGMAR1	30	43
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163630	DG	On-Demand	Anodyne	ARG1	16	42
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1Cl	ZINC000872163630	DG	On-Demand	Anodyne	ARG2	18	42
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163631	DG	On-Demand	Anodyne	SIGMAR1	30	43
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163631	DG	On-Demand	Anodyne	ARG1	16	42
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1Cl	ZINC000872163631	DG	On-Demand	Anodyne	ARG2	18	42
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	CHRM2	15	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	DRD4	40	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	ACHE	44	47
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	GRIN2B	53	43
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	SIGMAR1	50	43
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	CCR3	61	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	GRIN2C	17	43
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	MCHR1	30	46
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	CACNA1I	55	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	ARG1	22	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1	ZINC000872163634	EJ	On-Demand	Anodyne	ARG2	21	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	DRD4	29	40
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	ACHE	27	41
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	GRIN2B	60	42
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	PTGER1	23	42
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	SIGMAR1	38	43
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	CCR3	56	42
O=C(O)c1csc(CN2CCC(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872163645	FH	On-Demand	Anodyne	MCHR1	19	40
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	HTR1A	62	47
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	DRD4	38	40
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	ADRA1D	43	37
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	HTR2A	24	40
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	ADRA1A	42	38
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	HTR7	54	47
COc1ccccc1[C@@H]1CN(CCCCCC(=O)O)CCO1	ZINC000872163647	DF	On-Demand	Anodyne	SIGMAR1	24	40
O=C(O)Cn1cc(CCN2CCC(Cc3ccccc3Cl)CC2)nn1	ZINC000872163650	FF	On-Demand	Anodyne	SIGMAR1	26	41
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163679	EJ	On-Demand	Anodyne	HRH1	20	40
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163679	EJ	On-Demand	Anodyne	GRIN2B	47	44
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163679	EJ	On-Demand	Anodyne	CCR3	35	40
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163681	EJ	On-Demand	Anodyne	HRH1	20	40
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163681	EJ	On-Demand	Anodyne	GRIN2B	47	44
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163681	EJ	On-Demand	Anodyne	CCR3	35	40
COCCN(Cc1oc(-c2ccccc2)nc1C(=O)O)C1CCOCC1	ZINC000872163692	FF	On-Demand	Anodyne	DGAT1	20	42
O=C(O)c1cccc(Br)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163708	GJ	On-Demand	Anodyne	DRD2	15	46
O=C(O)c1cccc(Br)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163708	GJ	On-Demand	Anodyne	SIGMAR1	35	41
O=C(O)c1cccc(Br)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163708	GJ	On-Demand	Anodyne	CCR3	21	48
O=C(O)c1cccc(Br)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163708	GJ	On-Demand	Anodyne	SLC18A3	45	42
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)cs2)CCO1	ZINC000872163709	EG	On-Demand	Anodyne	DRD2	15	40
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)cs2)CCO1	ZINC000872163709	EG	On-Demand	Anodyne	DRD4	30	42
O=C(O)Cn1cc(CCN2CCC(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000872163711	FF	On-Demand	Anodyne	GRIN2B	42	40
O=C(O)Cn1cc(CCN2CCC(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000872163711	FF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)Cc1ccccc1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163716	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)Cc1ccccc1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163716	CE	On-Demand	Anodyne	SIGMAR1	28	40
O=C(O)Cc1ccccc1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163717	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)Cc1ccccc1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163717	CE	On-Demand	Anodyne	SIGMAR1	28	40
O=C(O)Cc1ccccc1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163718	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)Cc1ccccc1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163718	CE	On-Demand	Anodyne	SIGMAR1	28	40
O=C(O)Cc1ccccc1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872163719	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)Cc1ccccc1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872163719	CE	On-Demand	Anodyne	SIGMAR1	28	40
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	DRD2	24	49
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	DRD4	15	42
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	SIGMAR1	37	47
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	PRCP	19	40
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	CCR3	41	42
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	CCR5	20	43
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	SLC18A3	38	43
O=C(O)c1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163723	EI	On-Demand	Anodyne	MCHR1	31	41
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	ESR1	70	38
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	DRD2	22	57
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	HTR2A	17	57
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	HRH1	25	43
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	ESR2	46	38
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	LTA4H	50	46
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	HRH3	38	46
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	SIGMAR1	24	41
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	CCR2	17	43
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	CACNA1G	23	46
O=C(O)/C=C\c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163724	FI	On-Demand	Anodyne	PSMB1	42	38
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	ESR1	70	38
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	DRD2	22	57
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	HTR2A	17	57
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	HRH1	25	43
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	ESR2	46	38
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	LTA4H	50	46
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	HRH3	38	46
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	SIGMAR1	24	41
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	CCR2	17	43
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	CACNA1G	23	46
O=C(O)/C=C/c1ccc(OCCN2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000872163726	FI	On-Demand	Anodyne	PSMB1	42	38
CCCC[C@@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163728	DG	On-Demand	Anodyne	ETHR	50	46
CCCC[C@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163729	DG	On-Demand	Anodyne	ETHR	50	46
COc1ccccc1[C@@H]1CN(Cc2ccccc2CC(=O)O)CCO1	ZINC000872163730	EF	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@@H]1CN(Cc2ccccc2CC(=O)O)CCO1	ZINC000872163730	EF	On-Demand	Anodyne	DRD4	31	46
O=C(O)[C@H](c1ccccc1F)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163732	FG	On-Demand	Anodyne	ETHR	58	44
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163733	FG	On-Demand	Anodyne	ETHR	58	44
O=C(O)/C=C/c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163736	GH	On-Demand	Anodyne	LTA4H	52	43
O=C(O)/C=C/c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163736	GH	On-Demand	Anodyne	HRH3	24	42
O=C(O)/C=C/c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163736	GH	On-Demand	Anodyne	CPT1A	54	47
O=C(O)/C=C/c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163736	GH	On-Demand	Anodyne	PSMB1	40	37
O=C(O)/C=C/c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163736	GH	On-Demand	Anodyne	ETHR	63	45
O=C(O)/C=C\c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163738	GH	On-Demand	Anodyne	LTA4H	52	43
O=C(O)/C=C\c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163738	GH	On-Demand	Anodyne	HRH3	24	42
O=C(O)/C=C\c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163738	GH	On-Demand	Anodyne	CPT1A	54	47
O=C(O)/C=C\c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163738	GH	On-Demand	Anodyne	PSMB1	40	37
O=C(O)/C=C\c1ccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000872163738	GH	On-Demand	Anodyne	ETHR	63	45
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	DRD2	21	45
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	DRD4	39	46
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	ACHE	18	40
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	SLC6A1	33	41
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	SLC6A4	16	42
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	HRH1	34	56
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	SLC6A3	25	42
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	HTR4	40	35
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	GRIN2B	60	46
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	LTA4H	26	41
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	HRH3	26	49
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	SIGMAR1	50	47
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	CCR3	61	45
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	CCR5	17	41
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	EBP	15	42
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	GRIN2C	23	46
O=C(O)COCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163741	DF	On-Demand	Anodyne	CACNA1I	57	39
O=C(O)[C@@H](c1ccc(F)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163745	EH	On-Demand	Anodyne	PRCP	17	45
O=C(O)[C@@H](c1ccc(F)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163745	EH	On-Demand	Anodyne	CCR1	21	44
O=C(O)[C@H](c1ccc(F)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163748	EH	On-Demand	Anodyne	PRCP	17	45
O=C(O)[C@H](c1ccc(F)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163748	EH	On-Demand	Anodyne	CCR1	21	44
O=C(O)c1cc(F)ccc1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163750	CF	On-Demand	Anodyne	CCR3	27	40
O=C(O)c1cc(F)ccc1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872163752	CF	On-Demand	Anodyne	CCR3	27	40
O=C(O)c1cc(F)ccc1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163753	CF	On-Demand	Anodyne	CCR3	27	40
O=C(O)c1cc(F)ccc1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163754	CF	On-Demand	Anodyne	CCR3	27	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	DRD2	28	50
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	DRD4	52	51
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	ACHE	49	46
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	SLC6A1	53	35
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	HRH1	23	48
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	DRD3	24	42
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	OPRL1	22	43
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	CHRM3	18	45
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	GRIN2B	54	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	CXCL8	33	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	HRH3	15	46
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	SIGMAR1	69	54
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	CCR3	50	48
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	CCR5	18	41
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	FABP5	26	41
O=C(O)Cc1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872163755	FI	On-Demand	Anodyne	Q2TU57_MAIZE	19	40
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163756	EI	On-Demand	Anodyne	CCR1	31	41
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163756	EI	On-Demand	Anodyne	CCR5	22	48
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163757	EI	On-Demand	Anodyne	CCR1	31	41
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163757	EI	On-Demand	Anodyne	CCR5	22	48
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	CHRM2	23	40
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	DRD2	33	49
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	DRD4	58	48
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	ACHE	35	44
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	HTR2A	27	56
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	SLC6A4	17	46
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	HRH1	37	56
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	DRD3	19	41
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	SLC6A3	24	46
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	GRIN2B	72	45
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	HRH3	18	45
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	SIGMAR1	76	52
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	PRCP	25	40
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	CCR3	77	53
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	CCR5	36	46
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	C5AR1	24	42
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	GRIN2C	24	45
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	MCHR1	22	40
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	CACNA1I	43	35
O=C(O)c1ccccc1CCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163758	FJ	On-Demand	Anodyne	CYP2J2	46	33
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	DRD2	19	46
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	DRD4	27	43
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	FABP4	28	40
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	SIGMAR1	43	46
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	CCR3	40	45
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	CCR5	20	42
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	SLC18A3	45	45
O=C(O)c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1Cl	ZINC000872163760	EJ	On-Demand	Anodyne	MCHR1	31	40
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)ccc2Cl)CCO1	ZINC000872163777	FH	On-Demand	Anodyne	DRD4	41	46
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)ccc2Cl)CCO1	ZINC000872163777	FH	On-Demand	Anodyne	MBTPS1	41	34
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	HTR1A	22	50
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	DRD2	28	46
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	DRD4	44	45
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	ACHE	22	42
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	HTR2A	19	52
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	SLC6A4	15	41
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	HRH1	31	49
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	DRD3	20	41
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	SLC6A3	19	41
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	HTR4	47	35
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	GRIN2B	70	51
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	LTA4H	15	41
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	HRH3	26	52
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	SIGMAR1	57	52
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	PRCP	21	40
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	CCR3	69	49
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	CCR5	21	45
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	GRIN2C	33	51
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	MCHR1	20	42
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	CACNA1G	20	45
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	CACNA1I	51	36
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	CYP2J2	50	36
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	ARG1	28	41
O=C(O)CCCCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163778	DI	On-Demand	Anodyne	ARG2	25	41
C=C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163779	CG	On-Demand	Mild	SIGMAR1	15	40
C=C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163779	CG	On-Demand	Mild	CCR3	24	43
C=C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163780	CG	On-Demand	Mild	SIGMAR1	15	40
C=C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872163780	CG	On-Demand	Mild	CCR3	24	43
COc1ccccc1[C@@H]1CN(Cc2c(C(=O)O)oc3ccccc23)CCO1	ZINC000872163789	FH	On-Demand	Anodyne	DRD4	17	42
O=C(O)COCCN1CCC[C@H](C(F)(F)F)C1	ZINC000872163793	CD	On-Demand	Anodyne	SLC6A1	77	44
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872163795	FH	On-Demand	Bother	SIGMAR1	23	40
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872163795	FH	On-Demand	Bother	CCR3	18	42
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872163795	FH	On-Demand	Bother	MCHR1	24	41
O=C(O)c1cnc(CN2CCC(Cc3ccccc3Cl)CC2)cn1	ZINC000872163804	EG	On-Demand	Anodyne	DRD4	30	44
O=C(O)c1cnc(CN2CCC(Cc3ccccc3Cl)CC2)cn1	ZINC000872163804	EG	On-Demand	Anodyne	ACHE	38	40
O=C(O)c1cnc(CN2CCC(Cc3ccccc3Cl)CC2)cn1	ZINC000872163804	EG	On-Demand	Anodyne	SIGMAR1	42	49
O=C(O)c1cnc(CN2CCC(Cc3ccccc3Cl)CC2)cn1	ZINC000872163804	EG	On-Demand	Anodyne	CCR3	35	40
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	HTR1A	32	45
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	DRD2	38	45
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	DRD4	60	51
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	ACHE	38	42
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	SIGMAR1	42	42
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	MCHR1	19	41
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2)CCO1	ZINC000872163814	EF	On-Demand	Anodyne	CCR8	27	43
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CCO1	ZINC000872163816	EG	On-Demand	Anodyne	DRD4	45	46
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CCO1	ZINC000872163816	EG	On-Demand	Anodyne	HRH1	18	41
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CCO1	ZINC000872163816	EG	On-Demand	Anodyne	CCR1	15	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CCO1	ZINC000872163816	EG	On-Demand	Anodyne	CCR3	40	42
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CCO1	ZINC000872163816	EG	On-Demand	Anodyne	MCHR1	17	41
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	DRD2	20	51
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	HTR2A	18	44
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	ADRA1A	19	42
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	HRH1	16	40
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	ADRA1B	16	42
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	PRCP	20	40
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	CCR1	22	42
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	CCR5	21	46
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	SLC18A3	47	41
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	CCR2	17	44
C[C@@](O)(CN1CCC(c2ccc(F)cc2)CC1)C(=O)O	ZINC000872163818	CD	On-Demand	Anodyne	MCHR1	19	44
COc1ccccc1[C@@H]1CN(Cc2cc(C)c(C(=O)O)o2)CCO1	ZINC000872163821	EF	On-Demand	Anodyne	DRD4	28	44
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)cn2)CCO1	ZINC000872163823	EE	On-Demand	Anodyne	DRD4	32	44
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c(F)c1	ZINC000872163829	FH	On-Demand	Anodyne	ETHR	67	48
CSc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872163874	GI	On-Demand	Anodyne	LTA4H	56	44
CSc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872163874	GI	On-Demand	Anodyne	PSMB1	40	35
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163904	EJ	On-Demand	Anodyne	GRIN2B	58	46
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163904	EJ	On-Demand	Anodyne	CCR3	38	43
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163904	EJ	On-Demand	Anodyne	EBP	15	40
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163904	EJ	On-Demand	Anodyne	GRIN2C	19	42
C[C@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163904	EJ	On-Demand	Anodyne	CACNA1I	42	35
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163905	EJ	On-Demand	Anodyne	GRIN2B	58	46
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163905	EJ	On-Demand	Anodyne	CCR3	38	43
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163905	EJ	On-Demand	Anodyne	EBP	15	40
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163905	EJ	On-Demand	Anodyne	GRIN2C	19	42
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872163905	EJ	On-Demand	Anodyne	CACNA1I	42	35
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)s1	ZINC000872163906	EG	On-Demand	Anodyne	ETHR	63	46
C[C@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163907	CD	On-Demand	Anodyne	ETHR	56	49
C[C@@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163908	CD	On-Demand	Anodyne	ETHR	56	49
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163909	EI	On-Demand	Anodyne	PRCP	18	42
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163909	EI	On-Demand	Anodyne	CCR1	26	47
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163909	EI	On-Demand	Anodyne	SLC18A3	51	41
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163909	EI	On-Demand	Anodyne	CTSA	44	35
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163910	EI	On-Demand	Anodyne	PRCP	18	42
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163910	EI	On-Demand	Anodyne	CCR1	26	47
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163910	EI	On-Demand	Anodyne	SLC18A3	51	41
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163910	EI	On-Demand	Anodyne	CTSA	44	35
O=C(O)c1ccc(Br)cc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163913	GJ	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)c1ccc(Br)cc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163913	GJ	On-Demand	Anodyne	PRCP	17	40
O=C(O)c1ccc(Br)cc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163913	GJ	On-Demand	Anodyne	CCR3	19	46
O=C(O)c1ccc(Br)cc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163913	GJ	On-Demand	Anodyne	SLC18A3	21	40
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163918	GI	On-Demand	Anodyne	CDC7	15	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163918	GI	On-Demand	Anodyne	PIM3	16	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163920	GI	On-Demand	Anodyne	CDC7	15	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163920	GI	On-Demand	Anodyne	PIM3	16	42
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HTR1A	21	42
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	DRD2	15	40
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HRH2	15	46
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HTR1D	20	42
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HRH1	28	46
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HTR4	27	41
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	HTR7	25	45
CCOc1ccccc1OCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872163921	GH	On-Demand	Anodyne	NPY1R	40	35
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163922	GI	On-Demand	Anodyne	CDC7	15	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163922	GI	On-Demand	Anodyne	PIM3	16	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872163925	GI	On-Demand	Anodyne	CDC7	15	42
O=C(O)c1oc2ccc(Br)cc2c1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872163925	GI	On-Demand	Anodyne	PIM3	16	42
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	DRD2	27	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	DRD4	51	48
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	ACHE	18	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	DRD3	27	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	SIGMAR1	17	40
COc1ccccc1[C@@H]1CN(Cc2ccc(C)c(C(=O)O)c2)CCO1	ZINC000872163935	EG	On-Demand	Anodyne	CCR3	23	40
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163938	EH	On-Demand	Anodyne	PRCP	21	44
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163938	EH	On-Demand	Anodyne	CCR1	26	46
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163938	EH	On-Demand	Anodyne	SLC18A3	60	42
O=C(O)[C@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163939	EH	On-Demand	Anodyne	PRCP	21	44
O=C(O)[C@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163939	EH	On-Demand	Anodyne	CCR1	26	46
O=C(O)[C@H](c1ccccc1F)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163939	EH	On-Demand	Anodyne	SLC18A3	60	42
O=C(O)c1sccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163942	EG	On-Demand	Anodyne	ETHR	69	45
O=C(O)c1ccc(-c2nc(CN3CC[C@@H]4CSC[C@@H]4C3)co2)cc1	ZINC000872163943	EG	On-Demand	Anodyne	LTA4H	15	41
O=C(O)c1ccc(-c2nc(CN3CC[C@H]4CSC[C@@H]4C3)co2)cc1	ZINC000872163944	EG	On-Demand	Anodyne	LTA4H	15	41
O=C(O)c1ccc(-c2nc(CN3CC[C@@H]4CSC[C@H]4C3)co2)cc1	ZINC000872163945	EG	On-Demand	Anodyne	LTA4H	15	41
O=C(O)c1ccc(-c2nc(CN3CC[C@H]4CSC[C@H]4C3)co2)cc1	ZINC000872163946	EG	On-Demand	Anodyne	LTA4H	15	41
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	DRD2	16	45
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	HRH2	24	48
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	HTR2A	15	41
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	HRH1	24	48
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	LTA4H	48	42
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	HRH3	31	42
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	PRCP	22	40
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	NPY1R	43	40
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	CPT1A	76	48
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	MEN1	42	33
O=C(O)c1cccc(OCCN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872163949	FG	On-Demand	Anodyne	ETHR	66	43
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	HRH2	16	46
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	SLC6A1	113	38
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	HRH1	20	48
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	LTA4H	28	41
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	HTR7	20	49
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@H]2C1	ZINC000872163950	DE	On-Demand	Anodyne	HCN1	43	33
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	HRH2	16	46
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	SLC6A1	113	38
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	HRH1	20	48
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	LTA4H	28	41
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	HTR7	20	49
O=C(O)c1ccccc1OCCN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163951	DE	On-Demand	Anodyne	HCN1	43	33
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	HRH2	16	46
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	SLC6A1	113	38
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	HRH1	20	48
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	LTA4H	28	41
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	HTR7	20	49
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@H]2C1	ZINC000872163952	DE	On-Demand	Anodyne	HCN1	43	33
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	HRH2	16	46
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	SLC6A1	113	38
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	HRH1	20	48
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	LTA4H	28	41
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	HTR7	20	49
O=C(O)c1ccccc1OCCN1CC[C@H]2CSC[C@@H]2C1	ZINC000872163953	DE	On-Demand	Anodyne	HCN1	43	33
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CC[C@@H]2CSC[C@H]2C1	ZINC000872163954	EH	On-Demand	Anodyne	RBP4	69	37
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CC[C@H]2CSC[C@@H]2C1	ZINC000872163955	EH	On-Demand	Anodyne	RBP4	69	37
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000872163956	EH	On-Demand	Anodyne	RBP4	69	37
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CC[C@H]2CSC[C@H]2C1	ZINC000872163957	EH	On-Demand	Anodyne	RBP4	69	37
O=C(O)c1ccccc1CCN1CCC[C@H](C(F)(F)F)C1	ZINC000872163958	DG	On-Demand	Anodyne	SLC6A1	165	43
O=C(O)c1ccccc1CCN1CCC[C@H](C(F)(F)F)C1	ZINC000872163958	DG	On-Demand	Anodyne	SIGMAR1	19	42
O=C(O)c1ccccc1CCN1CCC[C@H](C(F)(F)F)C1	ZINC000872163958	DG	On-Demand	Anodyne	BIRC2	43	40
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR1A	37	54
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	DRD2	56	65
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	DRD1	23	53
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	DRD4	29	54
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	ADRA1D	27	48
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR2A	52	54
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR2C	21	49
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	SLC6A4	16	46
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	ADRA1A	39	48
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HRH1	31	46
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	ADRA1B	37	48
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	DRD3	21	54
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR4	15	42
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR1F	34	40
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	HTR7	68	52
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	SIGMAR1	45	54
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	PRCP	34	48
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	CCR1	18	40
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	CCR3	40	44
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	CCR5	20	44
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	SLC18A3	45	42
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	CCR2	18	44
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	MCHR1	28	53
O=C(O)CCCCCN1CCC(c2ccc(F)cc2)CC1	ZINC000872163961	CH	On-Demand	Anodyne	CYP2J2	47	33
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)co2)cc1	ZINC000872163966	GJ	On-Demand	Anodyne	S1PR4	25	41
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)co2)cc1	ZINC000872163966	GJ	On-Demand	Anodyne	S1PR1	16	42
O=C(O)c1ccc(-c2nc(CN3CCC(c4ccc(F)cc4)CC3)co2)cc1	ZINC000872163966	GJ	On-Demand	Anodyne	S1PR5	36	41
COc1ccccc1[C@@H]1CN(Cc2ccc(F)cc2C(=O)O)CCO1	ZINC000872163968	EG	On-Demand	Anodyne	DRD4	27	42
O=C(O)c1sc2ccccc2c1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163969	GJ	On-Demand	Anodyne	ETHR	61	41
O=C(O)[C@H](c1cccnc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163985	DG	On-Demand	Anodyne	KCNA5	18	40
O=C(O)[C@H](c1cccnc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163985	DG	On-Demand	Anodyne	PRCP	15	44
O=C(O)[C@@H](c1cccnc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163987	DG	On-Demand	Anodyne	KCNA5	18	40
O=C(O)[C@@H](c1cccnc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000872163987	DG	On-Demand	Anodyne	PRCP	15	44
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	DRD2	18	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	DRD4	35	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	ACHE	50	45
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	HRH1	22	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	SIGMAR1	53	46
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	CCR3	43	40
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	CACNA1I	47	35
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)c1	ZINC000872163992	EJ	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	DRD2	27	46
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	DRD4	31	43
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	HTR2A	21	43
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	SLC6A1	46	36
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	DRD3	15	43
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	FABP4	19	40
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	SIGMAR1	43	46
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	PRCP	31	42
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	CCR3	30	48
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	CCR5	20	45
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	SLC18A3	50	45
O=C(O)c1cccc(Cl)c1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163993	EJ	On-Demand	Anodyne	CACNA1G	41	40
O=C(O)c1oc2ccccc2c1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163994	GI	On-Demand	Anodyne	ETHR	55	42
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	DRD2	31	40
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	DRD4	25	41
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	ADRA1D	20	40
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	SLC6A1	78	40
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	ADRA1A	19	40
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	HRH1	20	49
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	HTR7	27	43
COc1ccccc1[C@@H]1CN(CCOc2ccccc2C(=O)O)CCO1	ZINC000872163995	FF	On-Demand	Anodyne	ABCB1	26	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	DRD2	27	49
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	DRD4	26	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	HTR2A	22	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	SIGMAR1	34	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	PRCP	28	46
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	CCR5	15	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	SLC18A3	45	42
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	MCHR1	23	40
O=C(O)c1cccnc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872163997	DG	On-Demand	Anodyne	MGEA5	26	41
O=C(O)c1cc(F)ccc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872163998	FH	On-Demand	Anodyne	ETHR	62	45
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)n1	ZINC000872164000	DG	On-Demand	Anodyne	DRD2	15	45
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)n1	ZINC000872164000	DG	On-Demand	Anodyne	SLC18A3	22	40
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)n1	ZINC000872164000	DG	On-Demand	Anodyne	MCHR1	20	42
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	DRD2	28	48
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	DRD4	40	46
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	ACHE	19	46
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	HTR2A	17	45
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	ADRA1A	18	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	HRH1	26	43
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	SIGMAR1	52	49
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	CCR1	38	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	CCR3	80	47
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	CCR5	22	42
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	SLC18A3	40	50
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	MLNR	43	38
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	CCR2	19	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	S1PR1	17	43
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	MCHR1	59	46
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F	ZINC000872164001	EI	On-Demand	Anodyne	CACNA1G	44	40
O=C(O)CCCc1nc(CN2CCC(Cc3ccc(Cl)cc3)CC2)no1	ZINC000872164004	GH	On-Demand	Anodyne	GRIN2B	31	40
O=C(O)CCCc1nc(CN2CCC(Cc3ccc(Cl)cc3)CC2)no1	ZINC000872164004	GH	On-Demand	Anodyne	SIGMAR1	22	40
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	DRD2	23	42
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	DRD4	55	42
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	ACHE	56	44
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	HRH1	25	44
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	DRD3	18	41
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	GRIN2B	43	37
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	SIGMAR1	67	52
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	CCR3	58	42
O=C(O)c1cc(CN2CCC(Cc3ccccc3Cl)CC2)cs1	ZINC000872164010	EJ	On-Demand	Anodyne	MCHR1	24	41
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1ccoc1C(=O)O	ZINC000872164012	FJ	On-Demand	Anodyne	CACNA1B	53	34
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164015	FH	On-Demand	Anodyne	ETHR	51	42
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164018	FH	On-Demand	Anodyne	ETHR	51	42
COc1ccccc1[C@@H]1CN(Cc2ncccc2C(=O)O)CCO1	ZINC000872164019	EE	On-Demand	Anodyne	DRD4	33	44
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	HRH1	24	50
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	LTA4H	33	41
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	HTR7	18	41
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	NPY1R	43	37
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	CPT1A	48	47
O=C(O)c1ccccc1OCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164022	FG	On-Demand	Anodyne	ETHR	61	42
O=C(O)CC1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872164026	DH	On-Demand	Anodyne	DRD4	17	43
O=C(O)CC1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872164026	DH	On-Demand	Anodyne	GRIN2B	52	45
O=C(O)CC1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872164026	DH	On-Demand	Anodyne	SIGMAR1	29	45
O=C(O)CC1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872164026	DH	On-Demand	Anodyne	CCR3	46	41
O=C(O)CC1(CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872164026	DH	On-Demand	Anodyne	GRIN2C	22	45
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	DRD2	26	53
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	DRD4	18	43
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	HTR2A	28	43
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	SIGMAR1	32	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	PRCP	23	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	CCR1	15	42
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	CCR3	24	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	CCR5	15	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	SLC18A3	39	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	MCHR1	33	49
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)nc1	ZINC000872164030	DG	On-Demand	Anodyne	MGEA5	26	42
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	ESR1	57	38
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	HRH2	20	40
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	HRH1	21	40
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	PPARG	27	43
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	ESR2	40	38
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	LTA4H	67	46
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	HRH3	55	41
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	SIGMAR1	20	43
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	EBP	23	42
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	PSMB1	43	38
COc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164066	GG	On-Demand	Anodyne	CARM1	51	30
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CC1(C(=O)O)CC1	ZINC000872164073	EI	On-Demand	Anodyne	CACNA1B	54	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CC1(C(=O)O)CC1	ZINC000872164073	EI	On-Demand	Anodyne	CCR2	62	38
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CC1(C(=O)O)CC1	ZINC000872164073	EI	On-Demand	Anodyne	LIPG	42	33
Cc1cc(-n2ccnc2)ccc1CN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164162	GI	On-Demand	Anodyne	NOS2	41	30
CCn1c(CN(CCOC)C2CCOCC2)nc2cc(C(=O)O)ccc21	ZINC000872164177	FE	On-Demand	Anodyne	CNR2	22	42
Cc1ccccc1CCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164197	FI	On-Demand	Anodyne	DRD4	15	40
Cc1ccccc1CCCN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164197	FI	On-Demand	Anodyne	HTR2A	19	40
O=C(O)CC1(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872164202	DH	On-Demand	Anodyne	SIGMAR1	34	44
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	HTR1A	17	54
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	DRD2	28	47
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	DRD4	47	46
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	ACHE	23	42
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	HTR2A	23	53
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	SLC6A4	16	42
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	HRH1	31	50
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	DRD3	23	44
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	SLC6A3	20	42
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	HTR4	44	44
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	GRIN2B	69	52
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	LTA4H	17	45
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	HRH3	26	53
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	SIGMAR1	60	53
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	PRCP	24	43
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CCR1	43	35
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CCR3	67	50
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CCR5	23	46
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	GRIN2C	26	52
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	MCHR1	22	45
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CACNA1G	21	49
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CACNA1I	55	36
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	CYP2J2	54	39
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	ARG1	29	41
O=C(O)CCCN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164203	CG	On-Demand	Anodyne	ARG2	25	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR1A	46	46
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	DRD2	47	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	DRD4	40	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	ACHE	36	42
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR1B	21	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR2A	39	48
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR2C	19	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	SLC6A1	52	37
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	SLC6A4	17	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HRH1	36	51
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	DRD3	40	37
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR4	81	50
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	GRIN2B	56	40
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HTR7	79	41
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	HRH3	25	43
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	SIGMAR1	72	49
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	CCR3	53	45
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	CCR5	24	44
O=C(O)CCCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164214	DI	On-Demand	Anodyne	CYP2J2	52	37
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	HTR1A	17	53
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	DRD2	41	57
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	DRD4	26	45
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	ADRA1D	23	42
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	HTR2A	52	52
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	HTR2C	24	52
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	SLC6A1	66	36
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	SLC6A4	17	40
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	ADRA1A	31	40
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	HRH1	35	41
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	ADRA1B	28	42
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	SLC6A3	26	40
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	HTR7	20	52
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	SIGMAR1	53	53
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	PRCP	31	48
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	CCR1	19	42
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	CCR3	56	50
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	CCR5	33	46
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	SLC18A3	57	44
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	CCR2	18	46
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	MCHR1	25	44
O=C(O)c1ccccc1CCN1CCC(c2ccc(F)cc2)CC1	ZINC000872164215	EH	On-Demand	Anodyne	CACNA1G	38	44
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	DRD4	37	42
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	ACHE	29	43
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	GRIN2B	54	45
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	SIGMAR1	49	47
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	CCR3	54	46
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	CCR5	19	40
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	GRIN2C	15	45
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	MCHR1	25	46
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	ARG1	25	43
O=C(O)c1sccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164222	EJ	On-Demand	Anodyne	ARG2	22	43
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872164223	EG	On-Demand	Anodyne	PDE8B	61	35
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872164224	EG	On-Demand	Anodyne	PDE8B	61	35
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872164225	EG	On-Demand	Anodyne	PDE8B	61	35
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872164226	EG	On-Demand	Anodyne	PDE8B	61	35
COc1ccccc1[C@@H]1CN(Cc2ccc3oc(C(=O)O)cc3c2)CCO1	ZINC000872164231	FH	On-Demand	Anodyne	DRD4	40	44
COc1ccccc1[C@@H]1CN(Cc2ccc3oc(C(=O)O)cc3c2)CCO1	ZINC000872164231	FH	On-Demand	Anodyne	ACHE	18	42
COc1ccccc1[C@@H]1CN(Cc2ccc3oc(C(=O)O)cc3c2)CCO1	ZINC000872164231	FH	On-Demand	Anodyne	DRD3	20	40
COc1ccccc1[C@@H]1CN(Cc2ccc3oc(C(=O)O)cc3c2)CCO1	ZINC000872164231	FH	On-Demand	Anodyne	SSTR5	49	38
COc1ccccc1[C@@H]1CN(Cc2ccc3oc(C(=O)O)cc3c2)CCO1	ZINC000872164231	FH	On-Demand	Anodyne	CCR3	26	41
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](C(F)(F)F)C1	ZINC000872164241	FI	On-Demand	Anodyne	TACR2	45	36
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](C(F)(F)F)C1	ZINC000872164242	FI	On-Demand	Anodyne	TACR2	45	36
O=C(O)CC1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164243	CG	On-Demand	Anodyne	ADRA1A	17	40
O=C(O)CC1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164243	CG	On-Demand	Anodyne	SIGMAR1	21	41
O=C(O)CC1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164243	CG	On-Demand	Anodyne	SLC18A3	35	40
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	DRD2	28	53
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	DRD4	38	48
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	ACHE	17	44
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	HTR2A	24	50
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	SLC6A1	48	35
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	HRH1	29	47
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	FABP4	40	43
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	SIGMAR1	57	50
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	PRCP	25	44
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	CCR1	21	44
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	CCR3	53	47
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	CCR5	26	47
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	SLC18A3	73	48
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	MCHR1	28	41
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	CACNA1G	40	42
O=C(O)c1ccccc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872164254	DH	On-Demand	Anodyne	MGEA5	25	41
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	DRD2	27	49
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	DRD4	54	56
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	ACHE	50	45
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	SLC6A1	46	37
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	HRH1	31	58
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	DRD3	25	41
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	HTR4	48	36
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	GRIN2B	51	40
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	FABP4	49	37
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	SIGMAR1	63	53
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	CCR3	53	58
O=C(O)c1ccccc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164255	EI	On-Demand	Anodyne	CCR5	17	40
COC1([C@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)CCC1	ZINC000872164260	EF	On-Demand	Anodyne	ETHR	43	44
COC1([C@@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)CCC1	ZINC000872164261	EF	On-Demand	Anodyne	ETHR	43	44
O=C(O)c1cccc(-c2nc(CN3CCC[C@H](C(F)(F)F)C3)cs2)c1	ZINC000872164262	FI	On-Demand	Anodyne	SLC6A1	47	33
COc1ccccc1[C@@H]1CN(Cc2coc(-c3ccc(C(=O)O)cc3)n2)CCO1	ZINC000872164277	GH	On-Demand	Anodyne	DRD4	19	41
COc1ccccc1[C@@H]1CN(Cc2coc(-c3ccc(C(=O)O)cc3)n2)CCO1	ZINC000872164277	GH	On-Demand	Anodyne	PDE8B	43	31
O=C(O)c1csc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164279	EG	On-Demand	Anodyne	ETHR	68	48
C[C@H](c1ccc(C(=O)O)o1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164285	EH	On-Demand	Anodyne	ETHR	45	43
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164286	EH	On-Demand	Anodyne	ETHR	45	43
O=C(O)c1cnc(CN2CCC(c3ccc(F)cc3)CC2)cn1	ZINC000872164287	DF	On-Demand	Anodyne	SIGMAR1	28	41
O=C(O)c1cnc(CN2CCC(c3ccc(F)cc3)CC2)cn1	ZINC000872164287	DF	On-Demand	Anodyne	PRCP	21	40
O=C(O)c1cnc(CN2CCC(c3ccc(F)cc3)CC2)cn1	ZINC000872164287	DF	On-Demand	Anodyne	SLC18A3	25	41
O=C(O)c1cnc(CN2CCC(c3ccc(F)cc3)CC2)cn1	ZINC000872164287	DF	On-Demand	Anodyne	MCHR1	18	43
O=C(O)c1cnc(CN2CCC(c3ccc(F)cc3)CC2)cn1	ZINC000872164287	DF	On-Demand	Anodyne	MGEA5	26	42
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	DRD4	33	42
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	ACHE	26	42
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	GRIN2B	50	44
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	SIGMAR1	42	44
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	CCR3	48	41
O=C(O)c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164295	EI	On-Demand	Anodyne	GRIN2C	15	44
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	DRD2	28	43
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	DRD4	35	46
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	HTR2A	25	53
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	SLC6A1	86	38
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	HRH1	34	55
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	HTR4	57	38
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	GRIN2B	50	40
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	SIGMAR1	62	46
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	CCR3	41	47
O=C(O)c1ccccc1CCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164296	FJ	On-Demand	Anodyne	CCR5	21	40
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	DRD4	32	40
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	ACHE	30	41
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	HRH1	15	42
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	GRIN2B	53	42
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	SIGMAR1	37	43
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	CCR3	50	40
O=C(O)c1cnoc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164297	EG	On-Demand	Anodyne	MCHR1	15	42
C=C[C@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164298	CE	On-Demand	Mild	ETHR	55	47
C=C[C@@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164299	CE	On-Demand	Mild	ETHR	55	47
Cc1ccc(OC[C@@H](O)CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164309	GG	On-Demand	Anodyne	ACOX1	101	42
Cc1ccc(OC[C@@H](O)CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164309	GG	On-Demand	Anodyne	ABCB1	69	42
Cc1ccc(OC[C@H](O)CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164310	GG	On-Demand	Anodyne	ACOX1	101	42
Cc1ccc(OC[C@H](O)CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164310	GG	On-Demand	Anodyne	ABCB1	69	42
Cc1ccccc1CN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164334	EH	On-Demand	Anodyne	DRD4	24	47
Cc1ccccc1CN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164334	EH	On-Demand	Anodyne	SIGMAR1	20	43
Cc1ccccc1CN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872164334	EH	On-Demand	Anodyne	MGEA5	32	40
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	HTR1A	22	45
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	DRD2	24	46
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	DRD4	16	41
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	HRH2	22	42
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	HTR2A	24	45
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	HRH1	28	43
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	DRD3	19	41
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	PPARG	25	44
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	AVPR1B	37	40
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	KCNH2	15	42
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	LTA4H	45	41
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	HRH3	106	43
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	SIGMAR1	34	46
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	PPARD	33	40
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	EBP	36	43
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	MCHR1	18	40
COc1ccc(OCCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872164362	GH	On-Demand	Anodyne	MEN1	47	38
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1nc(C(=O)O)cs1	ZINC000872164436	EH	On-Demand	Anodyne	PTGER1	43	39
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1nc(C(=O)O)cs1	ZINC000872164476	GJ	On-Demand	Anodyne	PTGER1	30	40
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1nc(C(=O)O)cs1	ZINC000872164476	GJ	On-Demand	Anodyne	LIPG	43	31
COCCN(Cc1csc(-c2ccc(C(=O)O)cc2)n1)C1CCOCC1	ZINC000872164479	GG	On-Demand	Anodyne	AVPR1B	19	54
COc1cccc([C@@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164506	EH	On-Demand	Anodyne	SLC6A3	18	42
COc1cccc([C@@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164506	EH	On-Demand	Anodyne	CCR1	15	41
COc1cccc([C@@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164506	EH	On-Demand	Anodyne	CCR5	79	37
COc1cccc([C@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164507	EH	On-Demand	Anodyne	SLC6A3	18	42
COc1cccc([C@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164507	EH	On-Demand	Anodyne	CCR1	15	41
COc1cccc([C@H](C(=O)O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164507	EH	On-Demand	Anodyne	CCR5	79	37
CC[C@@H](C(=O)O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164509	CE	On-Demand	Anodyne	ETHR	62	49
COc1ccccc1[C@@H]1CN(Cc2c(Cl)cccc2C(=O)O)CCO1	ZINC000872164511	FH	On-Demand	Anodyne	DRD4	43	44
COc1ccccc1[C@@H]1CN(Cc2c(Cl)cccc2C(=O)O)CCO1	ZINC000872164511	FH	On-Demand	Anodyne	SLC6A1	42	39
COc1ccccc1[C@@H]1CN(CC2(O)CCC(C(=O)O)CC2)CCO1	ZINC000872164512	EE	On-Demand	Anodyne	SLC6A1	81	40
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164514	GH	On-Demand	Anodyne	GRM5	20	44
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164514	GH	On-Demand	Anodyne	ETHR	50	40
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164515	GH	On-Demand	Anodyne	GRM5	20	44
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164515	GH	On-Demand	Anodyne	ETHR	50	40
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	DRD2	20	47
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	SIGMAR1	33	41
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	SLC18A3	27	41
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	CCR2	15	41
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	MCHR1	27	42
O=C(O)c1csc(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164518	DH	On-Demand	Anodyne	MGEA5	26	42
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	ESR1	64	39
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR1A	39	53
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	DRD2	60	53
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	DRD1	17	53
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	DRD4	41	31
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	ACHE	15	41
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HRH2	41	54
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR1D	21	40
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR1B	24	40
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR2A	59	43
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR2C	25	50
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	SLC6A1	58	37
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	SLC6A4	32	42
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HRH1	48	54
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	ADRA1B	25	40
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	DRD3	22	53
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	SLC6A3	33	42
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	KCNH2	28	40
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	ESR2	45	39
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	LTA4H	44	43
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HTR7	32	52
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	HRH3	47	44
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	SIGMAR1	43	50
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	PRCP	29	42
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CCR3	67	38
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CCR5	77	34
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	SLC18A3	47	38
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	PLA2G4B	25	41
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	ABCB1	17	42
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CCR2	27	43
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	EPHX2	24	44
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CHRNA10	52	36
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	MCHR1	40	43
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CACNA1G	38	51
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	PSMB1	41	39
O=C(O)c1cccc(OCCN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164523	EH	On-Demand	Anodyne	MEN1	45	38
C=C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164526	CG	On-Demand	Mild	GRIN2B	49	44
C=C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164526	CG	On-Demand	Mild	SIGMAR1	15	40
C=C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164526	CG	On-Demand	Mild	CCR3	38	42
C=C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164526	CG	On-Demand	Mild	GRIN2C	21	44
C=C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164527	CG	On-Demand	Mild	GRIN2B	49	44
C=C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164527	CG	On-Demand	Mild	SIGMAR1	15	40
C=C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164527	CG	On-Demand	Mild	CCR3	38	42
C=C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164527	CG	On-Demand	Mild	GRIN2C	21	44
O=C(O)c1cc2cc(CN3CCC(c4nc(C5CCC5)no4)CC3)ccc2o1	ZINC000872164532	GI	On-Demand	Anodyne	ETHR	44	43
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	DRD2	15	49
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	ADRA1A	18	40
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	SIGMAR1	26	43
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	PRCP	21	43
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	CCR1	15	40
O=C(O)C1(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164533	CF	On-Demand	Anodyne	SLC18A3	41	42
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CHRM2	30	46
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	DRD2	32	47
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	DRD4	83	49
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	ACHE	52	50
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	HTR2A	17	47
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	HRH1	35	54
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	DRD3	22	47
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	SLC6A3	24	46
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CHRM3	19	41
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	GRIN2B	73	46
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	FABP4	40	38
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	HRH3	19	49
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	SIGMAR1	80	55
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CCR3	82	54
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CCR5	39	44
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CXCR3	33	41
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	GRIN2C	24	46
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	MCHR1	34	45
O=C(O)c1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164538	EI	On-Demand	Anodyne	CACNA1I	41	39
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	DRD2	27	49
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	DRD4	30	46
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	ACHE	18	45
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	HTR2A	22	46
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	SIGMAR1	39	45
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	PRCP	32	42
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	CCR1	28	42
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	CCR3	44	45
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	CCR5	24	40
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	SLC18A3	32	42
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	CCR2	15	42
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	MCHR1	38	44
O=C(O)c1ccc(Cl)c(CN2CCC(c3ccc(F)cc3)CC2)c1	ZINC000872164542	EJ	On-Demand	Anodyne	CACNA1G	41	38
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)oc2C)CCO1	ZINC000872164547	EF	On-Demand	Anodyne	DRD4	32	44
C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164549	CG	On-Demand	Anodyne	HRH1	15	44
C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164549	CG	On-Demand	Anodyne	GRIN2B	42	50
C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164549	CG	On-Demand	Anodyne	SIGMAR1	23	42
C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164549	CG	On-Demand	Anodyne	CCR3	31	44
C[C@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164549	CG	On-Demand	Anodyne	GRIN2C	16	41
C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164550	CG	On-Demand	Anodyne	HRH1	15	44
C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164550	CG	On-Demand	Anodyne	GRIN2B	42	50
C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164550	CG	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164550	CG	On-Demand	Anodyne	CCR3	31	44
C[C@@H](C(=O)O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164550	CG	On-Demand	Anodyne	GRIN2C	16	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	DRD2	29	48
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	DRD4	49	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	ACHE	23	46
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	HRH1	31	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	SIGMAR1	55	49
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	P2RX7	15	41
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CCR1	46	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CCR3	78	45
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CCR5	20	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	SLC18A3	32	50
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	MLNR	52	38
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CCR2	23	44
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CXCR3	31	40
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	MCHR1	57	43
O=C(O)c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1Cl	ZINC000872164551	EJ	On-Demand	Anodyne	CACNA1G	43	41
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	CHRM2	15	43
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	DRD4	15	44
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	HRH1	15	44
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	GRIN2B	58	54
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	CCR3	57	46
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	EBP	19	44
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	GRIN2C	23	46
C[C@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164556	CG	On-Demand	Anodyne	CACNA1I	42	36
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	CHRM2	15	43
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	DRD4	15	44
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	HRH1	15	44
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	GRIN2B	58	54
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	CCR3	57	46
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	EBP	19	44
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	GRIN2C	23	46
C[C@@H](C(=O)O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164557	CG	On-Demand	Anodyne	CACNA1I	42	36
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	DRD4	26	44
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	ACHE	15	40
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	HRH1	19	43
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	GRIN2B	63	46
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	SIGMAR1	41	54
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	CCR3	67	44
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	CCR5	18	43
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	GRIN2C	22	46
C/C(=C\CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164562	DH	On-Demand	Anodyne	CACNA1I	51	37
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	DRD4	26	44
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	ACHE	15	40
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	HRH1	19	43
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	GRIN2B	63	46
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	SIGMAR1	41	54
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	CCR3	67	44
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	CCR5	18	43
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	GRIN2C	22	46
C/C(=C/CN1CCC(Cc2ccc(Cl)cc2)CC1)C(=O)O	ZINC000872164563	DH	On-Demand	Anodyne	CACNA1I	51	37
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HTR1A	46	47
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	DRD2	48	42
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	DRD4	42	42
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	ACHE	37	42
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HTR2A	41	49
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HTR2C	20	42
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	SLC6A1	58	37
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	ADRA1A	15	41
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HRH1	35	52
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	ADRA1B	15	41
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	DRD3	42	38
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HTR4	79	48
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	GRIN2B	52	40
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HTR7	77	40
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	HRH3	26	43
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	SIGMAR1	74	50
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	PRCP	18	40
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	CCR3	51	46
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	CCR5	26	45
O=C(O)CCCCN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164564	DH	On-Demand	Anodyne	CYP2J2	53	37
O=C(O)c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)c(Cl)c1	ZINC000872164565	EG	On-Demand	Anodyne	UTS2R	22	43
O=C(O)c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)c(Cl)c1	ZINC000872164566	EG	On-Demand	Anodyne	UTS2R	22	43
O=C(O)c1ccc(OCCN2CC[C@H]3CSC[C@H]3C2)c(Cl)c1	ZINC000872164567	EG	On-Demand	Anodyne	UTS2R	22	43
O=C(O)c1ccc(OCCN2CC[C@H]3CSC[C@@H]3C2)c(Cl)c1	ZINC000872164568	EG	On-Demand	Anodyne	UTS2R	22	43
O=C(O)c1ccc(Cl)c(CN2CCC[C@H](C(F)(F)F)C2)c1	ZINC000872164569	DH	On-Demand	Anodyne	SLC6A1	71	36
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1F	ZINC000872164574	CF	On-Demand	Anodyne	DRD4	22	40
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1F	ZINC000872164574	CF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@@H]3C2)cc1F	ZINC000872164574	CF	On-Demand	Anodyne	CCR3	27	41
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1F	ZINC000872164575	CF	On-Demand	Anodyne	DRD4	22	40
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1F	ZINC000872164575	CF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@H]3C2)cc1F	ZINC000872164575	CF	On-Demand	Anodyne	CCR3	27	41
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1F	ZINC000872164576	CF	On-Demand	Anodyne	DRD4	22	40
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1F	ZINC000872164576	CF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1ccc(CN2CC[C@H]3CSC[C@@H]3C2)cc1F	ZINC000872164576	CF	On-Demand	Anodyne	CCR3	27	41
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1F	ZINC000872164577	CF	On-Demand	Anodyne	DRD4	22	40
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1F	ZINC000872164577	CF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1ccc(CN2CC[C@@H]3CSC[C@H]3C2)cc1F	ZINC000872164577	CF	On-Demand	Anodyne	CCR3	27	41
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	DRD4	25	46
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	SLC6A4	15	44
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	HRH1	21	50
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	SLC6A3	33	44
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	GRIN2B	74	46
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	SIGMAR1	32	46
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	CCR3	54	50
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	CCR5	32	44
O=C(O)[C@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164582	EI	On-Demand	Anodyne	GRIN2C	30	46
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	DRD4	25	46
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	SLC6A4	15	44
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	HRH1	21	50
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	SLC6A3	33	44
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	GRIN2B	74	46
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	SIGMAR1	32	46
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	CCR3	54	50
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	CCR5	32	44
O=C(O)[C@@H](c1ccccc1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872164583	EI	On-Demand	Anodyne	GRIN2C	30	46
COc1ccccc1[C@@H]1CN(Cc2csc(C(=O)O)c2)CCO1	ZINC000872164584	EG	On-Demand	Anodyne	DRD4	34	46
O=C(O)CCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164586	CE	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)CCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164586	CE	On-Demand	Anodyne	ETHR	59	53
COc1cccc([C@@H](C(=O)O)N2CCO[C@@H](c3ccccc3OC)C2)c1	ZINC000872164591	FF	On-Demand	Anodyne	CASR	15	42
COc1cccc([C@@H](C(=O)O)N2CCO[C@H](c3ccccc3OC)C2)c1	ZINC000872164592	FF	On-Demand	Anodyne	CASR	15	42
COc1cccc([C@H](C(=O)O)N2CCO[C@H](c3ccccc3OC)C2)c1	ZINC000872164593	FF	On-Demand	Anodyne	CASR	15	42
COc1cccc([C@H](C(=O)O)N2CCO[C@@H](c3ccccc3OC)C2)c1	ZINC000872164594	FF	On-Demand	Anodyne	CASR	15	42
O=C(O)C1CCC(O)(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872164595	FH	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C1CCC(O)(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872164595	FH	On-Demand	Anodyne	HRH1	15	43
O=C(O)C1CCC(O)(CN2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000872164595	FH	On-Demand	Anodyne	SIGMAR1	32	43
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CC1(CC(=O)O)CC1	ZINC000872164621	FJ	On-Demand	Anodyne	CACNA1B	47	34
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CC1(CC(=O)O)CC1	ZINC000872164621	FJ	On-Demand	Anodyne	CCR2	49	37
CC(=O)c1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872164680	FH	On-Demand	Anodyne	DRD2	19	43
CC(=O)c1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872164680	FH	On-Demand	Anodyne	DRD4	40	40
CC(=O)c1cccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872164680	FH	On-Demand	Anodyne	ACHE	29	43
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	DRD4	26	44
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	ACHE	40	40
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	GRIN2B	44	36
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	PTGER1	46	42
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	SIGMAR1	41	46
O=C(O)c1csc(CN2CCC(Cc3ccccc3Cl)CC2)n1	ZINC000872164738	FH	On-Demand	Anodyne	CCR3	41	42
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)nc1	ZINC000872164739	EF	On-Demand	Anodyne	CPT1A	15	43
O=C(O)c1ccc(CN2CCC(c3nc(C4CCC4)no3)CC2)nc1	ZINC000872164739	EF	On-Demand	Anodyne	ETHR	65	47
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164740	EH	On-Demand	Anodyne	PTAFR	18	40
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164740	EH	On-Demand	Anodyne	KCNA5	20	43
O=C(O)[C@@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164740	EH	On-Demand	Anodyne	CCR3	19	50
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164742	EH	On-Demand	Anodyne	PTAFR	18	40
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164742	EH	On-Demand	Anodyne	KCNA5	20	43
O=C(O)[C@H](c1cccnc1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164742	EH	On-Demand	Anodyne	CCR3	19	50
COc1ccccc1[C@@H]1CN([C@H](C(=O)O)c2ccc(Cl)c(Cl)c2)CCO1	ZINC000872164747	GI	On-Demand	Anodyne	TACR2	48	37
COc1ccccc1[C@@H]1CN([C@@H](C(=O)O)c2ccc(Cl)c(Cl)c2)CCO1	ZINC000872164748	GI	On-Demand	Anodyne	TACR2	48	37
COCCN(Cc1csc(-c2cccc(C(=O)O)c2)n1)C1CCOCC1	ZINC000872164752	GG	On-Demand	Anodyne	AVPR1B	18	43
O=C(O)c1ccc(Br)cc1CN1CCC[C@H](C(F)(F)F)C1	ZINC000872164759	FH	On-Demand	Anodyne	SLC6A1	56	33
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	DRD4	29	40
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	ACHE	37	41
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	SIGMAR1	29	41
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	CCR3	17	46
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	BDKRB1	20	40
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	CPT1A	34	43
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	MCHR1	22	41
O=C(O)c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164760	EG	On-Demand	Anodyne	ETHR	68	47
O=C(O)c1ccccc1CCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164762	FG	On-Demand	Anodyne	CPT1A	29	45
O=C(O)c1ccccc1CCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164762	FG	On-Demand	Anodyne	ETHR	59	44
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)cc2F)CCO1	ZINC000872164775	EG	On-Demand	Anodyne	DRD4	35	43
COc1ccccc1[C@@H]1CN(Cc2cc(C(=O)O)sc2C)CCO1	ZINC000872164776	EG	On-Demand	Anodyne	DRD4	21	41
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1Cc1occc1C(=O)O	ZINC000872164779	FJ	On-Demand	Anodyne	LIPG	45	34
COc1ccccc1[C@@H]1CN(Cc2nc(C(=O)O)cs2)CCO1	ZINC000872164780	EE	On-Demand	Anodyne	DRD4	18	42
O=C(O)[C@H](c1ccc(F)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164787	FG	On-Demand	Anodyne	ETHR	57	45
O=C(O)[C@@H](c1ccc(F)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164789	FG	On-Demand	Anodyne	ETHR	57	45
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164801	DG	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164801	DG	On-Demand	Anodyne	CCR3	24	44
O=C(O)[C@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164801	DG	On-Demand	Anodyne	CCR5	24	42
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164803	DG	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164803	DG	On-Demand	Anodyne	CCR3	24	44
O=C(O)[C@@H](C1CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000872164803	DG	On-Demand	Anodyne	CCR5	24	42
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	DRD2	16	42
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	DRD4	37	47
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	ACHE	41	43
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	HRH1	26	47
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	HTR4	39	40
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	SIGMAR1	45	46
O=C(O)c1cccnc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164804	EH	On-Demand	Anodyne	CCR3	42	47
COc1cccc([C@@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164809	FG	On-Demand	Anodyne	CPT1A	43	43
COc1cccc([C@@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164809	FG	On-Demand	Anodyne	SMO	27	43
COc1cccc([C@@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164809	FG	On-Demand	Anodyne	ETHR	50	39
COc1cccc([C@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164810	FG	On-Demand	Anodyne	CPT1A	43	43
COc1cccc([C@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164810	FG	On-Demand	Anodyne	SMO	27	43
COc1cccc([C@H](C(=O)O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000872164810	FG	On-Demand	Anodyne	ETHR	50	39
COc1ccccc1[C@@H]1CN(Cc2oncc2C(=O)O)CCO1	ZINC000872164821	DD	On-Demand	Anodyne	DRD4	24	44
O=C(O)c1cnoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164823	EG	On-Demand	Anodyne	DRD4	24	44
O=C(O)c1cnoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164823	EG	On-Demand	Anodyne	HRH1	20	46
O=C(O)c1cnoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164823	EG	On-Demand	Anodyne	SIGMAR1	38	46
O=C(O)c1cnoc1CN1CCC(Cc2ccccc2Cl)CC1	ZINC000872164823	EG	On-Demand	Anodyne	CCR3	36	46
O=C(O)CCCc1nc(CN2CCC(Cc3ccccc3Cl)CC2)no1	ZINC000872164827	GH	On-Demand	Anodyne	SIGMAR1	25	43
COc1ccccc1[C@@H]1CN(Cc2cnc(C(=O)O)cn2)CCO1	ZINC000872164829	ED	On-Demand	Anodyne	DRD4	25	44
COc1ccccc1[C@@H]1CN(CCOCC(=O)O)CCO1	ZINC000872164834	CD	On-Demand	Anodyne	HTR1A	40	39
COc1ccccc1[C@@H]1CN(CCOCC(=O)O)CCO1	ZINC000872164834	CD	On-Demand	Anodyne	DRD2	36	40
COc1ccccc1[C@@H]1CN(CCOCC(=O)O)CCO1	ZINC000872164834	CD	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1[C@@H]1CN(CCOCC(=O)O)CCO1	ZINC000872164834	CD	On-Demand	Anodyne	SLC6A1	58	37
COc1ccccc1[C@@H]1CN([C@H](C(=O)O)c2ccc(Cl)cc2Cl)CCO1	ZINC000872164840	GI	On-Demand	Anodyne	FDFT1	42	34
COc1ccccc1[C@@H]1CN([C@@H](C(=O)O)c2ccc(Cl)cc2Cl)CCO1	ZINC000872164842	GI	On-Demand	Anodyne	FDFT1	42	34
C/C(=C\CN1CCC(c2nc(C3CCC3)no2)CC1)C(=O)O	ZINC000872164843	DF	On-Demand	Anodyne	ETHR	53	48
C/C(=C/CN1CCC(c2nc(C3CCC3)no2)CC1)C(=O)O	ZINC000872164844	DF	On-Demand	Anodyne	ETHR	53	48
O=C(O)C1CCC(O)(CN2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000872164845	EG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	DRD2	21	45
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	DRD4	34	45
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	ACHE	39	42
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	HRH1	18	43
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	GRIN2B	46	37
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	SIGMAR1	50	48
O=C(O)c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)s1	ZINC000872164858	EJ	On-Demand	Anodyne	CCR3	40	41
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)s2)CCO1	ZINC000872164862	EG	On-Demand	Anodyne	DRD2	22	41
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)s2)CCO1	ZINC000872164862	EG	On-Demand	Anodyne	DRD4	29	44
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)s2)CCO1	ZINC000872164862	EG	On-Demand	Anodyne	ADRA1D	45	36
COc1ccccc1[C@@H]1CN(Cc2ccc(C(=O)O)s2)CCO1	ZINC000872164862	EG	On-Demand	Anodyne	ADRA1B	45	36
O=C(O)c1ccccc1CN1CC[C@@H]2CSC[C@H]2C1	ZINC000872164867	CF	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)c1ccccc1CN1CC[C@@H]2CSC[C@@H]2C1	ZINC000872164869	CF	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)c1ccccc1CN1CC[C@H]2CSC[C@H]2C1	ZINC000872164870	CF	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)c1ccccc1CN1CC[C@H]2CSC[C@@H]2C1	ZINC000872164871	CF	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)CCCCCN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164876	DG	On-Demand	Anodyne	ETHR	59	52
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2Cl)CCO1	ZINC000872164877	FH	On-Demand	Anodyne	DRD4	34	45
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2Cl)CCO1	ZINC000872164877	FH	On-Demand	Anodyne	FABP4	26	41
COc1ccccc1[C@@H]1CN(Cc2cccc(C(=O)O)c2Cl)CCO1	ZINC000872164877	FH	On-Demand	Anodyne	MBTPS1	41	34
COCCN(CCOc1cccc(C(=O)O)c1)C1CCOCC1	ZINC000872164891	DD	On-Demand	Anodyne	PLA2G4B	46	42
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1CCOCC(=O)O	ZINC000872164954	EG	On-Demand	Anodyne	LIPG	43	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1occc1C(=O)O	ZINC000872164972	FJ	On-Demand	Anodyne	CACNA1B	54	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1occc1C(=O)O	ZINC000872164972	FJ	On-Demand	Anodyne	LIPG	49	34
COc1ccccc1[C@@H]1CN(Cc2ccsc2C(=O)O)CCO1	ZINC000872164978	EG	On-Demand	Anodyne	DRD4	21	40
O=C(O)CC1(CN2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000872164981	DF	On-Demand	Anodyne	ETHR	43	47
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	DRD2	32	42
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	DRD4	43	33
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	HRH2	30	47
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	SLC6A1	47	39
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	HRH1	25	47
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	DRD3	27	42
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	PPARG	16	40
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	HTR7	23	43
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	PLA2G4B	46	41
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	EPHX2	19	43
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	MCL1	43	35
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	ACKR3	49	32
COc1ccccc1[C@@H]1CN(CCOc2cccc(C(=O)O)c2)CCO1	ZINC000872164983	FF	On-Demand	Anodyne	CYSK1	40	33
O=C(O)c1ccoc1CN1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872164989	EG	On-Demand	Anodyne	ETHR	55	45
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	DRD2	20	49
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	DRD4	24	40
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	SIGMAR1	36	42
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	PRCP	24	41
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	CCR5	15	41
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	SLC18A3	33	41
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	PDE8B	60	36
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	DGAT1	35	46
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2ccc(F)cc2)CC1	ZINC000872165002	GJ	On-Demand	Anodyne	MGEA5	25	40
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	DRD2	17	50
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	DRD4	38	48
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	ACHE	38	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	SIGMAR1	45	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000872165011	CF	On-Demand	Anodyne	MCHR1	15	42
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	DRD2	17	50
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	DRD4	38	48
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	ACHE	38	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	SIGMAR1	45	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000872165013	CF	On-Demand	Anodyne	MCHR1	15	42
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	DRD2	17	50
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	DRD4	38	48
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	ACHE	38	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	SIGMAR1	45	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1cccc(CN2CC[C@H]3CSC[C@H]3C2)c1	ZINC000872165014	CF	On-Demand	Anodyne	MCHR1	15	42
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	DRD2	17	50
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	DRD4	38	48
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	ACHE	38	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	SIGMAR1	45	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	CCR3	29	44
O=C(O)c1cccc(CN2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000872165015	CF	On-Demand	Anodyne	MCHR1	15	42
CC1(C)[C@@H](c2ccccc2F)CCN1CCOc1ccccc1C(=O)O	ZINC000872165019	FI	On-Demand	Anodyne	HRH1	16	44
CC1(C)[C@@H](c2ccccc2F)CCN1CCOc1ccccc1C(=O)O	ZINC000872165019	FI	On-Demand	Anodyne	HCN1	44	33
COc1ccccc1[C@@H]1CN(Cc2c(C(=O)O)sc3ccccc23)CCO1	ZINC000872165033	GI	On-Demand	Anodyne	DRD4	16	41
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165034	EF	On-Demand	Anodyne	LTA4H	39	43
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165034	EF	On-Demand	Anodyne	HRH3	18	43
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165034	EF	On-Demand	Anodyne	PSMB1	40	36
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165036	EF	On-Demand	Anodyne	LTA4H	39	43
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165036	EF	On-Demand	Anodyne	HRH3	18	43
O=C(O)/C=C/c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165036	EF	On-Demand	Anodyne	PSMB1	40	36
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165038	EF	On-Demand	Anodyne	LTA4H	39	43
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165038	EF	On-Demand	Anodyne	HRH3	18	43
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000872165038	EF	On-Demand	Anodyne	PSMB1	40	36
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165040	EF	On-Demand	Anodyne	LTA4H	39	43
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165040	EF	On-Demand	Anodyne	HRH3	18	43
O=C(O)/C=C\c1ccc(OCCN2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000872165040	EF	On-Demand	Anodyne	PSMB1	40	36
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCC(=O)O	ZINC000872165078	EJ	On-Demand	Anodyne	PTGER4	19	46
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCC(=O)O	ZINC000872165078	EJ	On-Demand	Anodyne	CACNA1B	54	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCC(=O)O	ZINC000872165078	EJ	On-Demand	Anodyne	CCR2	68	39
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCC(=O)O	ZINC000872165078	EJ	On-Demand	Anodyne	LIPG	44	33
COc1ccccc1[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165085	GE	On-Demand	Anodyne	ADRB2	15	41
COc1ccccc1[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165085	GE	On-Demand	Anodyne	ADRB1	17	41
COc1ccccc1[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165085	GE	On-Demand	Anodyne	ACOX1	51	34
COc1ccccc1[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165085	GE	On-Demand	Anodyne	ABCB1	81	46
COc1ccccc1[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165091	GE	On-Demand	Anodyne	ADRB2	15	41
COc1ccccc1[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165091	GE	On-Demand	Anodyne	ADRB1	17	41
COc1ccccc1[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165091	GE	On-Demand	Anodyne	ACOX1	51	34
COc1ccccc1[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CCO1	ZINC000872165091	GE	On-Demand	Anodyne	ABCB1	81	46
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	DRD4	24	42
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	GRIN2B	68	47
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	FDFT1	21	40
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	SIGMAR1	27	44
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	CCR3	46	50
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	CCR5	18	47
O=C(O)C1CCN(C(=O)CN2CCC(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000872165102	GF	On-Demand	Anodyne	MAPK1	22	41
O=C(O)c1cccc(Br)c1CN1CCC[C@H](C(F)(F)F)C1	ZINC000872165108	FH	On-Demand	Anodyne	SLC6A1	88	41
C=C[C@@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872165122	CF	On-Demand	Mild	CCR1	19	44
C=C[C@H](C(=O)O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872165124	CF	On-Demand	Mild	CCR1	19	44
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCOCC(=O)O	ZINC000872165127	EG	On-Demand	Anodyne	CACNA1B	49	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCOCC(=O)O	ZINC000872165127	EG	On-Demand	Anodyne	CCR2	42	36
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCOCC(=O)O	ZINC000872165127	EG	On-Demand	Anodyne	LIPG	49	35
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	DRD2	18	42
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	DRD4	21	42
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	ACHE	41	40
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	HRH1	23	45
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	HTR4	55	35
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	GRIN2B	46	38
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	SIGMAR1	47	44
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	CCR3	39	41
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	CCR5	19	40
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	CACNA1I	55	37
C[C@@](O)(CN1CCC(Cc2ccccc2Cl)CC1)C(=O)O	ZINC000872165128	DE	On-Demand	Anodyne	CYP2J2	50	38
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	DRD2	15	42
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	DRD4	47	42
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	ACHE	42	45
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	HRH1	17	41
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	GRIN2B	56	44
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	SIGMAR1	53	47
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	CCR3	69	41
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	CXCR3	28	40
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	GRIN2C	18	44
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	MCHR1	30	45
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	CACNA1I	48	42
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	ARG1	19	42
O=C(O)c1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cs1	ZINC000872165134	EJ	On-Demand	Anodyne	ARG2	21	42
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCc1ccccc1C(=O)O	ZINC000872165144	GK	On-Demand	Anodyne	CACNA1B	54	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCc1ccccc1C(=O)O	ZINC000872165144	GK	On-Demand	Anodyne	CCR2	56	37
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCc1ccccc1C(=O)O	ZINC000872165144	GK	On-Demand	Anodyne	LIPG	50	35
CCn1c(CN2CCC(c3ccc(F)cc3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165151	GI	On-Demand	Anodyne	DRD2	19	53
CCn1c(CN2CCC(c3ccc(F)cc3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165151	GI	On-Demand	Anodyne	CCR5	51	31
CCn1c(CN2CCC(c3ccc(F)cc3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165151	GI	On-Demand	Anodyne	GRM2	15	53
CCn1c(CN2CCC(c3ccc(F)cc3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165151	GI	On-Demand	Anodyne	MCHR1	35	43
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CHRM2	29	47
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	DRD2	34	48
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	DRD4	83	50
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	ACHE	53	51
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	HTR2A	17	48
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	HRH1	30	49
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	DRD3	22	48
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	SLC6A3	25	47
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CHRM3	21	42
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	GRIN2B	77	47
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	TBXA2R	25	43
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	HRH3	22	50
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	SIGMAR1	85	56
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CCR3	82	55
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CCR5	41	45
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	APP	17	41
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	LNPEP	42	33
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CXCR3	37	44
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	GRIN2C	29	47
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	MCHR1	34	45
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	PTGDR2	23	46
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CACNA1I	48	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	ARG1	18	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	PA	27	40
O=C(O)Cc1ccccc1CN1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000872165156	FI	On-Demand	Anodyne	ARG2	21	40
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CHRM2	20	44
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	DRD2	28	48
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	DRD4	40	48
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	ACHE	34	45
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	HTR2A	21	47
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	HRH1	41	57
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	SLC6A3	24	40
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	KCNH2	47	41
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CHRM3	43	44
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	LTA4H	23	40
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	HRH3	18	41
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	SIGMAR1	51	47
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CCR1	15	46
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CCR3	102	57
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	UTS2R	18	46
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	SLC18A3	30	47
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	MLNR	74	48
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CCR2	27	47
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	MCHR1	33	48
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	CACNA1G	49	42
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165161	DG	On-Demand	Anodyne	LIPG	40	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	HTR1A	26	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	DRD2	56	52
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	DRD4	74	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	ACHE	50	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	SLC6A1	46	36
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	HRH1	42	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	DRD3	33	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	OPRK1	19	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	AVPR1B	41	34
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	KCNH2	15	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	HTR4	67	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	TACR1	17	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	HRH3	16	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	SIGMAR1	59	48
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	SSTR5	68	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	CCR3	53	49
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	MCHR1	41	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	CCR8	27	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165164	FJ	On-Demand	Anodyne	MBTPS1	45	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	HTR1A	26	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	DRD2	56	52
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	DRD4	74	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	ACHE	50	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	SLC6A1	46	36
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	HRH1	42	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	DRD3	33	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	OPRK1	19	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	AVPR1B	41	34
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	KCNH2	15	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	HTR4	67	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	TACR1	17	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	HRH3	16	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	SIGMAR1	59	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	SSTR5	68	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	CCR3	53	49
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	MCHR1	41	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	CCR8	27	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872165165	FJ	On-Demand	Anodyne	MBTPS1	45	40
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	DRD2	15	44
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	DRD4	15	47
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	PRCP	18	41
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	CCR5	103	38
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	MCHR1	34	40
O=C(O)c1coc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872165166	DF	On-Demand	Anodyne	MGEA5	26	40
C/C(=C/CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165167	CE	On-Demand	Anodyne	SLC6A1	54	33
C/C(=C/CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165167	CE	On-Demand	Anodyne	HRH1	22	42
C/C(=C/CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165167	CE	On-Demand	Anodyne	CCR3	53	48
C/C(=C/CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165167	CE	On-Demand	Anodyne	MLNR	28	45
C/C(=C/CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165167	CE	On-Demand	Anodyne	LIPG	17	44
C/C(=C\CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165168	CE	On-Demand	Anodyne	SLC6A1	54	33
C/C(=C\CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165168	CE	On-Demand	Anodyne	HRH1	22	42
C/C(=C\CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165168	CE	On-Demand	Anodyne	CCR3	53	48
C/C(=C\CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165168	CE	On-Demand	Anodyne	MLNR	28	45
C/C(=C\CN1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872165168	CE	On-Demand	Anodyne	LIPG	17	44
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165169	EI	On-Demand	Anodyne	CCR5	112	39
Cc1ccccc1[C@@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165169	EI	On-Demand	Anodyne	SLC18A3	38	41
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165170	EI	On-Demand	Anodyne	CCR5	112	39
Cc1ccccc1[C@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165170	EI	On-Demand	Anodyne	SLC18A3	38	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	DRD2	35	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	DRD4	30	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	ACHE	22	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	SLC6A1	46	37
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165171	EI	On-Demand	Anodyne	SIGMAR1	28	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	DRD2	35	50
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	DRD4	30	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	ACHE	22	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	SLC6A1	46	37
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C)c(C(=O)O)o2)CC1	ZINC000872165172	EI	On-Demand	Anodyne	SIGMAR1	28	40
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	DRD2	18	44
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	DRD4	42	32
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	HRH2	32	53
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	HRH1	26	53
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	LTA4H	38	41
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	HRH3	29	41
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	PLA2G4B	35	40
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	PSMB1	40	37
Cn1nnnc1C1CCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165177	ED	On-Demand	Anodyne	MEN1	41	32
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165178	FH	On-Demand	Bother	SIGMAR1	21	41
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165178	FH	On-Demand	Bother	CCR3	16	40
O=C(O)c1ccc([N+](=O)[O-])c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165178	FH	On-Demand	Bother	CCR5	95	38
CN(Cc1ccc2cc[nH]c2c1)CC1(CC(=O)O)CC1	ZINC000872165179	CF	On-Demand	Anodyne	FFAR2	25	42
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1F	ZINC000872165182	EH	On-Demand	Anodyne	SIGMAR1	42	55
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1F	ZINC000872165182	EH	On-Demand	Anodyne	SLC18A3	18	45
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1F	ZINC000872165182	EH	On-Demand	Anodyne	MCHR2	79	39
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1F	ZINC000872165183	EH	On-Demand	Anodyne	SIGMAR1	42	55
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1F	ZINC000872165183	EH	On-Demand	Anodyne	SLC18A3	18	45
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1F	ZINC000872165183	EH	On-Demand	Anodyne	MCHR2	79	39
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	DRD2	15	42
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	DRD4	19	41
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	SLC6A1	78	34
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	HRH1	31	44
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	CHRM3	18	48
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	SIGMAR1	39	44
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	CCR3	70	46
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	SLC18A3	28	42
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	MLNR	42	48
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	EPHX2	18	41
O=C(O)Cc1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165189	EG	On-Demand	Anodyne	LIPG	15	44
O=C(O)c1ccccc1OCCN1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165190	FE	On-Demand	Anodyne	CPT1A	15	41
O=C(O)c1ccccc1OCCN1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165190	FE	On-Demand	Anodyne	ETHR	51	34
O=C(O)c1ccccc1OCCN1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165191	FE	On-Demand	Anodyne	CPT1A	15	41
O=C(O)c1ccccc1OCCN1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165191	FE	On-Demand	Anodyne	ETHR	51	34
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	HTR1A	35	44
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	DRD2	38	54
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	DRD4	24	52
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	SLC6A1	96	42
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	HRH1	22	42
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	SIGMAR1	24	44
COc1ccccc1[C@@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165192	DG	On-Demand	Anodyne	ACKR3	63	36
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	HTR1A	35	44
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	DRD2	38	54
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	DRD4	24	52
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	SLC6A1	96	42
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	HRH1	22	42
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	SIGMAR1	24	44
COc1ccccc1[C@H]1CCCN(C/C=C(\C)C(=O)O)CC1	ZINC000872165193	DG	On-Demand	Anodyne	ACKR3	63	36
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	HTR1A	35	44
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	DRD2	38	54
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	DRD4	24	52
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	SLC6A1	96	42
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	HRH1	22	42
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	SIGMAR1	24	44
COc1ccccc1[C@@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165194	DG	On-Demand	Anodyne	ACKR3	63	36
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	HTR1A	35	44
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	DRD2	38	54
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	DRD4	24	52
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	SLC6A1	96	42
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	HRH1	22	42
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	SIGMAR1	24	44
COc1ccccc1[C@H]1CCCN(C/C=C(/C)C(=O)O)CC1	ZINC000872165195	DG	On-Demand	Anodyne	ACKR3	63	36
O=C(O)c1coc(CN2CC[C@@]3(CCc4ccccc43)C2)n1	ZINC000872165196	CE	On-Demand	Anodyne	SIGMAR1	25	49
O=C(O)c1coc(CN2CC[C@]3(CCc4ccccc43)C2)n1	ZINC000872165197	CE	On-Demand	Anodyne	SIGMAR1	25	49
Cn1nnnc1C1CCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165205	EE	On-Demand	Anodyne	SSTR5	44	37
C/C(=C\CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165212	CF	On-Demand	Anodyne	OXTR	46	37
C/C(=C\CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165212	CF	On-Demand	Anodyne	SIGMAR1	25	63
C/C(=C\CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165212	CF	On-Demand	Anodyne	SLC18A3	15	40
C/C(=C\CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165212	CF	On-Demand	Anodyne	MCHR2	40	32
C/C(=C/CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165213	CF	On-Demand	Anodyne	OXTR	46	37
C/C(=C/CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165213	CF	On-Demand	Anodyne	SIGMAR1	25	63
C/C(=C/CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165213	CF	On-Demand	Anodyne	SLC18A3	15	40
C/C(=C/CN1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165213	CF	On-Demand	Anodyne	MCHR2	40	32
C/C(=C/CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165214	CF	On-Demand	Anodyne	OXTR	46	37
C/C(=C/CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165214	CF	On-Demand	Anodyne	SIGMAR1	25	63
C/C(=C/CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165214	CF	On-Demand	Anodyne	SLC18A3	15	40
C/C(=C/CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165214	CF	On-Demand	Anodyne	MCHR2	40	32
C/C(=C\CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165215	CF	On-Demand	Anodyne	OXTR	46	37
C/C(=C\CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165215	CF	On-Demand	Anodyne	SIGMAR1	25	63
C/C(=C\CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165215	CF	On-Demand	Anodyne	SLC18A3	15	40
C/C(=C\CN1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872165215	CF	On-Demand	Anodyne	MCHR2	40	32
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2cccc(F)c2)CC1	ZINC000872165218	EH	On-Demand	Anodyne	CCR5	106	41
O=C(O)[C@@H](c1ccccc1F)N1CCC(c2cccc(F)c2)CC1	ZINC000872165218	EH	On-Demand	Anodyne	SLC18A3	42	40
O=C(O)[C@H](c1ccccc1F)N1CCC(c2cccc(F)c2)CC1	ZINC000872165219	EH	On-Demand	Anodyne	CCR5	106	41
O=C(O)[C@H](c1ccccc1F)N1CCC(c2cccc(F)c2)CC1	ZINC000872165219	EH	On-Demand	Anodyne	SLC18A3	42	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	HTR1A	30	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	DRD2	57	51
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	DRD4	63	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	ACHE	44	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	ADRA1D	22	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	HTR2A	15	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	SLC6A1	69	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	ADRA1A	22	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	HRH1	37	51
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	ADRA1B	23	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	DRD3	32	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	AVPR1B	41	34
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	KCNH2	15	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	HTR4	23	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	SIGMAR1	59	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	SSTR5	72	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	CCR3	68	49
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	MCHR1	46	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	MCHR2	40	35
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	CACNA1G	32	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	CCR8	26	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165223	FI	On-Demand	Anodyne	ACKR3	61	31
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	HTR1A	30	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	DRD2	57	51
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	DRD4	63	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	ACHE	44	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	ADRA1D	22	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	HTR2A	15	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	SLC6A1	69	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	ADRA1A	22	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	HRH1	37	51
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	ADRA1B	23	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	DRD3	32	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	AVPR1B	41	34
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	KCNH2	15	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	HTR4	23	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	SIGMAR1	59	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	SSTR5	72	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	CCR3	68	49
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	MCHR1	46	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	MCHR2	40	35
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	CACNA1G	32	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	CCR8	26	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165224	FI	On-Demand	Anodyne	ACKR3	61	31
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165227	GJ	On-Demand	Anodyne	HTR1A	20	43
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165227	GJ	On-Demand	Anodyne	DRD2	25	48
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165227	GJ	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165227	GJ	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165227	GJ	On-Demand	Anodyne	SIGMAR1	22	43
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165228	GJ	On-Demand	Anodyne	HTR1A	20	43
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165228	GJ	On-Demand	Anodyne	DRD2	25	48
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165228	GJ	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165228	GJ	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)oc3ccccc23)CC1	ZINC000872165228	GJ	On-Demand	Anodyne	SIGMAR1	22	43
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	DRD2	16	50
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	DRD4	29	48
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	ACHE	16	42
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	SIGMAR1	39	47
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	CCR3	31	41
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	CCR5	97	36
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	SLC18A3	29	41
O=C(O)c1cc(CN2CCC(c3cccc(F)c3)CC2)cs1	ZINC000872165232	DH	On-Demand	Anodyne	MCHR1	40	42
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	DRD2	19	46
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	DRD4	26	48
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	ACHE	19	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	SIGMAR1	34	48
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	CCR3	26	42
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	CCR5	98	38
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	SLC18A3	44	37
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1	ZINC000872165236	EI	On-Demand	Anodyne	MCHR1	40	50
CCCC[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165237	CG	On-Demand	Anodyne	OXTR	45	34
CCCC[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165237	CG	On-Demand	Anodyne	OPRL1	18	44
CCCC[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165237	CG	On-Demand	Anodyne	GHRHR	26	41
CCCC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165238	CG	On-Demand	Anodyne	OXTR	45	34
CCCC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165238	CG	On-Demand	Anodyne	OPRL1	18	44
CCCC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165238	CG	On-Demand	Anodyne	GHRHR	26	41
CCCC[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165239	CG	On-Demand	Anodyne	OXTR	45	34
CCCC[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165239	CG	On-Demand	Anodyne	OPRL1	18	44
CCCC[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165239	CG	On-Demand	Anodyne	GHRHR	26	41
CCCC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165240	CG	On-Demand	Anodyne	OXTR	45	34
CCCC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165240	CG	On-Demand	Anodyne	OPRL1	18	44
CCCC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165240	CG	On-Demand	Anodyne	GHRHR	26	41
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	DRD2	16	45
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	SIGMAR1	23	43
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	PRCP	15	41
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	CCR5	100	39
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	MCHR1	30	40
O=C(O)c1cnoc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165243	DF	On-Demand	Anodyne	MGEA5	27	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	HTR1A	28	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	DRD4	38	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	ACHE	31	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	HRH1	28	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	SIGMAR1	48	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	SSTR5	51	37
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165245	EH	On-Demand	Anodyne	MBTPS1	57	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	HTR1A	28	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	DRD4	38	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	ACHE	31	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	HRH1	28	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	SIGMAR1	48	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	SSTR5	51	37
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)o2)CC1	ZINC000872165246	EH	On-Demand	Anodyne	MBTPS1	57	40
O=C(O)[C@H](c1cccnc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165247	DG	On-Demand	Anodyne	CCR5	107	41
O=C(O)[C@@H](c1cccnc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165248	DG	On-Demand	Anodyne	CCR5	107	41
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	DRD2	70	57
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HRH2	20	53
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	ADRA1D	50	43
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HTR2A	28	46
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HTR2C	15	42
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	SLC6A1	123	43
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	ADRA1A	44	43
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HRH1	38	61
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	ADRA1B	43	41
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	DRD3	52	38
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HTR4	59	43
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HTR7	50	46
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HRH3	20	42
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	SIGMAR1	37	46
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	ABCB1	32	44
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	RBP4	42	35
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	MCHR1	20	46
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HCN1	58	33
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	HCN4	50	32
COc1ccccc1[C@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165249	FI	On-Demand	Anodyne	ACKR3	63	32
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	DRD2	70	57
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HRH2	20	53
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	ADRA1D	50	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HTR2A	28	46
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HTR2C	15	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	SLC6A1	123	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	ADRA1A	44	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HRH1	38	61
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	ADRA1B	43	41
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	DRD3	52	38
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HTR4	59	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HTR7	50	46
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HRH3	20	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	SIGMAR1	37	46
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	ABCB1	32	44
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	RBP4	42	35
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	MCHR1	20	46
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HCN1	58	33
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	HCN4	50	32
COc1ccccc1[C@@H]1CCCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872165250	FI	On-Demand	Anodyne	ACKR3	63	32
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	DRD2	37	48
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	ACHE	26	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	SLC6A1	66	39
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	HRH1	26	43
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	DRD3	21	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	FABP4	37	45
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	SIGMAR1	37	46
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	CCR3	25	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165255	FJ	On-Demand	Anodyne	MBTPS1	54	41
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	DRD2	37	48
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	ACHE	26	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	SLC6A1	66	39
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	HRH1	26	43
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	DRD3	21	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	FABP4	37	45
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	SIGMAR1	37	46
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	CCR3	25	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2Cl)CC1	ZINC000872165256	FJ	On-Demand	Anodyne	MBTPS1	54	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	HTR1A	34	45
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	DRD2	44	53
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	DRD4	37	48
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	ACHE	27	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	SLC6A1	88	42
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	HRH1	28	51
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	DRD3	26	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	TACR1	15	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	FABP4	41	49
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	SIGMAR1	41	47
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	SSTR5	30	43
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	CCR3	25	42
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	CACNA1G	19	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	CCR8	30	42
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	MBTPS1	52	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165257	EI	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	HTR1A	34	45
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	DRD2	44	53
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	DRD4	37	48
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	ACHE	27	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	SLC6A1	88	42
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	HRH1	28	51
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	DRD3	26	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	TACR1	15	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	FABP4	41	49
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	SIGMAR1	41	47
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	SSTR5	30	43
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	CCR3	25	42
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	CACNA1G	19	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	CCR8	30	42
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	MBTPS1	52	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2C(=O)O)CC1	ZINC000872165258	EI	On-Demand	Anodyne	HCN4	40	31
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HTR1A	25	43
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	DRD2	19	43
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HRH2	27	42
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HTR1D	19	40
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HTR2A	16	43
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HRH1	24	42
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	PPARG	43	42
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	AVPR1B	36	42
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	LTA4H	41	41
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	HRH3	25	52
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	SIGMAR1	25	40
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	EBP	40	36
COc1cccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)c1	ZINC000872165263	GG	On-Demand	Anodyne	CARM1	44	31
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1Cc1oncc1C(=O)O	ZINC000872165281	FI	On-Demand	Anodyne	LIPG	48	33
CSc1ccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165283	FI	On-Demand	Anodyne	DRD4	25	41
CSc1ccc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165283	FI	On-Demand	Anodyne	SIGMAR1	29	47
C/C(=C\CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165303	EI	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C\CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165303	EI	On-Demand	Anodyne	CCR2	49	37
C/C(=C\CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165303	EI	On-Demand	Anodyne	LIPG	41	32
C/C(=C\CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165303	EI	On-Demand	Anodyne	SFRP1	69	32
C/C(=C\CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165304	EI	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C\CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165304	EI	On-Demand	Anodyne	CCR2	49	37
C/C(=C\CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165304	EI	On-Demand	Anodyne	LIPG	41	32
C/C(=C\CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165304	EI	On-Demand	Anodyne	SFRP1	69	32
C/C(=C/CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165305	EI	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C/CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165305	EI	On-Demand	Anodyne	CCR2	49	37
C/C(=C/CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165305	EI	On-Demand	Anodyne	LIPG	41	32
C/C(=C/CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165305	EI	On-Demand	Anodyne	SFRP1	69	32
C/C(=C/CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165306	EI	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C/CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165306	EI	On-Demand	Anodyne	CCR2	49	37
C/C(=C/CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165306	EI	On-Demand	Anodyne	LIPG	41	32
C/C(=C/CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1(C)C)C(=O)O	ZINC000872165306	EI	On-Demand	Anodyne	SFRP1	69	32
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	ESR1	49	37
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	HRH2	18	44
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	HRH1	19	44
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	PPARG	31	42
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	LTA4H	64	45
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	HRH3	43	41
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	PSMB2	40	39
CCOc1ccc(OCCN2CCC(c3nc(C)c(C(=O)O)s3)CC2)cc1	ZINC000872165309	GH	On-Demand	Anodyne	PSMB1	43	39
Cc1ccc2ccccc2c1CN1CCC(c2nc(C)c(C(=O)O)s2)CC1	ZINC000872165312	GJ	On-Demand	Anodyne	DRD4	19	40
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1Cc1nc(C(=O)O)cs1	ZINC000872165313	GJ	On-Demand	Anodyne	PTGER1	23	40
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1ccccc1C(=O)O	ZINC000872165325	EI	On-Demand	Anodyne	FABP4	35	40
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1oncc1C(=O)O	ZINC000872165337	FI	On-Demand	Anodyne	CACNA1B	52	34
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1oncc1C(=O)O	ZINC000872165337	FI	On-Demand	Anodyne	LIPG	49	33
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1cnc(C(=O)O)cn1	ZINC000872165357	GH	On-Demand	Anodyne	CACNA1B	52	36
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1cnc(C(=O)O)cn1	ZINC000872165357	GH	On-Demand	Anodyne	CCR2	46	36
Cc1ccccc1[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165359	DH	On-Demand	Anodyne	OXTR	43	35
Cc1ccccc1[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165359	DH	On-Demand	Anodyne	OPRL1	15	42
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165360	DH	On-Demand	Anodyne	OXTR	43	35
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165360	DH	On-Demand	Anodyne	OPRL1	15	42
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165361	DH	On-Demand	Anodyne	OXTR	43	35
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165361	DH	On-Demand	Anodyne	OPRL1	15	42
Cc1ccccc1[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165362	DH	On-Demand	Anodyne	OXTR	43	35
Cc1ccccc1[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165362	DH	On-Demand	Anodyne	OPRL1	15	42
COc1cccc([C@H](C(=O)O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165363	EG	On-Demand	Anodyne	OPRL1	22	45
COc1cccc([C@@H](C(=O)O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165364	EG	On-Demand	Anodyne	OPRL1	22	45
COc1cccc([C@@H](C(=O)O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165365	EG	On-Demand	Anodyne	OPRL1	22	45
COc1cccc([C@H](C(=O)O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165366	EG	On-Demand	Anodyne	OPRL1	22	45
CN(CCCCC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872165367	CF	On-Demand	Anodyne	FFAR2	40	50
COC1([C@@H](C(=O)O)N2CC[C@@]3(CCc4ccccc43)C2)CCC1	ZINC000872165368	DF	On-Demand	Anodyne	OXTR	41	35
COC1([C@H](C(=O)O)N2CC[C@]3(CCc4ccccc43)C2)CCC1	ZINC000872165369	DF	On-Demand	Anodyne	OXTR	41	35
COC1([C@@H](C(=O)O)N2CC[C@]3(CCc4ccccc43)C2)CCC1	ZINC000872165370	DF	On-Demand	Anodyne	OXTR	41	35
COC1([C@H](C(=O)O)N2CC[C@@]3(CCc4ccccc43)C2)CCC1	ZINC000872165371	DF	On-Demand	Anodyne	OXTR	41	35
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)co2)cc1	ZINC000872165372	GJ	On-Demand	Anodyne	DRD4	16	44
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)co2)cc1	ZINC000872165372	GJ	On-Demand	Anodyne	CCR5	95	37
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)co2)cc1	ZINC000872165372	GJ	On-Demand	Anodyne	MCHR1	35	41
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	ADRB2	15	46
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	ADRB1	26	46
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	HRH1	32	43
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	CCR3	38	43
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	ABCB1	64	54
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	CACNA1G	17	44
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165373	GE	On-Demand	Anodyne	LIPG	22	43
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	ADRB2	15	46
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	ADRB1	26	46
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	HRH1	32	43
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	CCR3	38	43
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	ABCB1	64	54
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	CACNA1G	17	44
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165374	GE	On-Demand	Anodyne	LIPG	22	43
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	HRH1	25	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	SIGMAR1	18	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	CCR3	57	48
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	SLC18A3	16	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	MLNR	43	45
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(F)c1	ZINC000872165375	EG	On-Demand	Anodyne	LIPG	37	47
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	HTR1A	37	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	DRD2	50	57
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	DRD4	26	51
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	ADRA1D	23	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	HTR2A	49	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	HTR2C	21	42
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	ADRA1A	35	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	HRH1	25	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	ADRA1B	31	46
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	DRD3	19	40
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	PTGFR	26	40
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	PTGER4	21	42
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	HTR7	73	48
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	SIGMAR1	41	50
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	PRCP	25	49
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	CCR3	40	39
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	CCR5	100	38
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	SLC18A3	45	39
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	CCR2	18	40
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	MCHR1	38	50
O=C(O)CCCCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165376	CH	On-Demand	Anodyne	CYP2J2	48	34
O=C(O)CCCc1nc(CN2CC[C@H](Oc3ccc(F)cc3)C2)no1	ZINC000872165377	EE	On-Demand	Anodyne	CCR3	18	41
O=C(O)c1ccccc1CCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165378	DH	On-Demand	Anodyne	SIGMAR1	26	56
O=C(O)c1ccccc1CCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165378	DH	On-Demand	Anodyne	EBP	17	42
O=C(O)c1ccccc1CCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165379	DH	On-Demand	Anodyne	SIGMAR1	26	56
O=C(O)c1ccccc1CCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165379	DH	On-Demand	Anodyne	EBP	17	42
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	DRD2	22	47
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	DRD4	20	50
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	SIGMAR1	37	47
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	PRCP	17	40
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	CCR3	42	42
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	CCR5	99	38
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	SLC18A3	44	41
O=C(O)c1cc(F)ccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165380	EI	On-Demand	Anodyne	MCHR1	38	43
CN(CCCC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872165381	BE	On-Demand	Anodyne	LTA4H	20	40
CN(CCCC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872165381	BE	On-Demand	Anodyne	FFAR2	50	52
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	DRD2	43	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	ACHE	24	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	SLC6A1	68	37
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	HRH1	26	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165384	EI	On-Demand	Anodyne	SIGMAR1	33	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	DRD2	43	50
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	ACHE	24	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	SLC6A1	68	37
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	HRH1	26	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)c(C)o2)CC1	ZINC000872165385	EI	On-Demand	Anodyne	SIGMAR1	33	40
O=C(O)C1CCN(C(=O)CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165388	FD	On-Demand	Anodyne	HRH1	20	41
O=C(O)C1CCN(C(=O)CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165388	FD	On-Demand	Anodyne	CCR3	31	47
O=C(O)C1CCN(C(=O)CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165388	FD	On-Demand	Anodyne	MLNR	24	48
O=C(O)C1CCN(C(=O)CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165388	FD	On-Demand	Anodyne	EPHX2	18	42
O=C(O)C1CCN(C(=O)CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165388	FD	On-Demand	Anodyne	LIPG	46	48
CCn1c(CN2CC[C@]3(CCc4ccccc43)C2)nc2cc(C(=O)O)ccc21	ZINC000872165389	GH	On-Demand	Anodyne	MCHR2	64	39
CCn1c(CN2CC[C@@]3(CCc4ccccc43)C2)nc2cc(C(=O)O)ccc21	ZINC000872165390	GH	On-Demand	Anodyne	MCHR2	64	39
O=C(O)COCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165393	CD	On-Demand	Anodyne	DRD2	16	40
O=C(O)COCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165393	CD	On-Demand	Anodyne	SLC6A1	66	40
O=C(O)COCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165393	CD	On-Demand	Anodyne	HRH1	31	42
O=C(O)COCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165393	CD	On-Demand	Anodyne	CCR3	43	53
O=C(O)COCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165393	CD	On-Demand	Anodyne	LIPG	24	44
O=C(O)Cn1cc(CCN2CCC(c3cccc(F)c3)CC2)nn1	ZINC000872165394	ED	On-Demand	Anodyne	PRCP	16	41
O=C(O)Cn1cc(CCN2CCC(c3cccc(F)c3)CC2)nn1	ZINC000872165394	ED	On-Demand	Anodyne	CCR5	92	36
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872165395	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872165395	FF	On-Demand	Anodyne	ABCB1	68	47
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872165396	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872165396	FF	On-Demand	Anodyne	ABCB1	68	47
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872165397	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)c1ccc(OC[C@@H](O)CN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872165397	FF	On-Demand	Anodyne	ABCB1	68	47
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872165398	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)c1ccc(OC[C@H](O)CN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872165398	FF	On-Demand	Anodyne	ABCB1	68	47
O=C(O)c1cc(F)ccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165399	EG	On-Demand	Anodyne	HRH1	28	45
O=C(O)c1cc(F)ccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165399	EG	On-Demand	Anodyne	CCR3	65	48
O=C(O)c1cc(F)ccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165399	EG	On-Demand	Anodyne	MLNR	44	47
O=C(O)c1cc(F)ccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165399	EG	On-Demand	Anodyne	LIPG	54	51
CC[C@@H](C(=O)O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165401	CD	On-Demand	Anodyne	ETHR	48	37
CC[C@@H](C(=O)O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165402	CD	On-Demand	Anodyne	ETHR	48	37
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	HTR1A	23	45
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	DRD2	41	48
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	DRD4	48	45
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	ACHE	38	46
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	HRH1	31	45
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	DRD3	26	41
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	KCNH2	15	41
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	SIGMAR1	47	43
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	SSTR5	76	43
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	CCR3	44	45
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	MCHR1	42	43
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	CCR8	20	42
COc1ccccc1[C@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165404	GJ	On-Demand	Anodyne	MBTPS1	42	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	HTR1A	23	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	DRD2	41	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	DRD4	48	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	ACHE	38	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	HRH1	31	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	DRD3	26	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	KCNH2	15	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	SIGMAR1	47	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	SSTR5	76	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	CCR3	44	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	MCHR1	42	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	CCR8	20	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc3oc(C(=O)O)cc3c2)CC1	ZINC000872165405	GJ	On-Demand	Anodyne	MBTPS1	42	40
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	HTR1A	32	43
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	DRD2	27	53
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	DRD4	19	51
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	SLC6A1	40	38
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	HRH1	25	40
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	SIGMAR1	23	43
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165406	DG	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	HTR1A	32	43
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	DRD2	27	53
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	DRD4	19	51
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	SLC6A1	40	38
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	HRH1	25	40
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	SIGMAR1	23	43
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@@H]1CCCN(CC2(C(=O)O)CC2)CC1	ZINC000872165407	DG	On-Demand	Anodyne	HCN4	40	31
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	HRH1	23	44
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	KCNH2	25	42
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	HRH3	17	40
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	SIGMAR1	38	45
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	SSTR5	51	35
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	CHEK2	20	47
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	CCR3	79	49
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	UTS2R	15	41
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	SLC18A3	19	43
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	MLNR	52	47
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	MCHR1	40	45
O=C(O)c1cc2cc(CN3CC[C@H](Oc4ccc(F)cc4)C3)ccc2o1	ZINC000872165408	FH	On-Demand	Anodyne	LIPG	17	42
O=C(O)CCCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165409	CG	On-Demand	Anodyne	OXTR	42	38
O=C(O)CCCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165409	CG	On-Demand	Anodyne	SIGMAR1	35	60
O=C(O)CCCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165409	CG	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)CCCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165409	CG	On-Demand	Anodyne	EBP	20	49
O=C(O)CCCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165410	CG	On-Demand	Anodyne	OXTR	42	38
O=C(O)CCCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165410	CG	On-Demand	Anodyne	SIGMAR1	35	60
O=C(O)CCCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165410	CG	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)CCCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165410	CG	On-Demand	Anodyne	EBP	20	49
O=C(O)CC1(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872165411	CF	On-Demand	Anodyne	CCR3	26	45
Cn1nnnc1C1CCN(CCOc2ccc(C(=O)O)cc2Cl)CC1	ZINC000872165422	FD	On-Demand	Anodyne	HRH1	21	40
Cn1nnnc1C1CCN(CCOc2ccc(C(=O)O)cc2Cl)CC1	ZINC000872165422	FD	On-Demand	Anodyne	IL2RA	54	35
Cn1nnnc1C1CCN(CCOc2ccc(C(=O)O)cc2Cl)CC1	ZINC000872165422	FD	On-Demand	Anodyne	UTS2R	19	43
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	SLC6A1	61	36
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	HRH1	43	45
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	SIGMAR1	20	41
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	CCR3	71	45
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	SLC18A3	19	41
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	MLNR	36	44
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	EPHX2	15	42
O=C(O)c1cccc(Cl)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165423	EH	On-Demand	Anodyne	LIPG	27	45
O=C(O)c1ccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)c(Cl)c1	ZINC000872165424	FI	On-Demand	Anodyne	TACR2	16	44
O=C(O)c1ccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)c(Cl)c1	ZINC000872165424	FI	On-Demand	Anodyne	SIGMAR1	17	44
O=C(O)c1ccc(OCCN2CC[C@]3(CCc4ccccc43)C2)c(Cl)c1	ZINC000872165425	FI	On-Demand	Anodyne	TACR2	16	44
O=C(O)c1ccc(OCCN2CC[C@]3(CCc4ccccc43)C2)c(Cl)c1	ZINC000872165425	FI	On-Demand	Anodyne	SIGMAR1	17	44
O=C(O)C1CCN(C(=O)CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165426	ED	On-Demand	Anodyne	OXTR	53	38
O=C(O)C1CCN(C(=O)CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165426	ED	On-Demand	Anodyne	SIGMAR1	19	46
O=C(O)C1CCN(C(=O)CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165427	ED	On-Demand	Anodyne	OXTR	53	38
O=C(O)C1CCN(C(=O)CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165427	ED	On-Demand	Anodyne	SIGMAR1	19	46
O=C(O)c1oc2ccccc2c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165432	EI	On-Demand	Anodyne	SIGMAR1	27	50
O=C(O)c1oc2ccccc2c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165432	EI	On-Demand	Anodyne	MCHR2	53	34
O=C(O)c1oc2ccccc2c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165433	EI	On-Demand	Anodyne	SIGMAR1	27	50
O=C(O)c1oc2ccccc2c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165433	EI	On-Demand	Anodyne	MCHR2	53	34
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	ESR1	78	40
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	DRD2	21	44
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	ESR2	53	40
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	LTA4H	46	44
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	HRH3	32	43
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	SIGMAR1	20	41
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	CCR5	94	39
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	MCHR1	30	41
O=C(O)/C=C/c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165437	FI	On-Demand	Anodyne	PSMB1	41	38
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	ESR1	78	40
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	DRD2	21	44
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	ESR2	53	40
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	LTA4H	46	44
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	HRH3	32	43
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	SIGMAR1	20	41
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	CCR5	94	39
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	MCHR1	30	41
O=C(O)/C=C\c1ccc(OCCN2CCC(c3cccc(F)c3)CC2)cc1	ZINC000872165438	FI	On-Demand	Anodyne	PSMB1	41	38
C=C[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165439	CE	On-Demand	Mild	SLC18A3	15	41
C=C[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165440	CE	On-Demand	Mild	SLC18A3	15	41
C=C[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165441	CE	On-Demand	Mild	SLC18A3	15	41
C=C[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165442	CE	On-Demand	Mild	SLC18A3	15	41
O=C(O)[C@@H](c1ccccc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165451	DH	On-Demand	Anodyne	CCR5	107	38
O=C(O)[C@@H](c1ccccc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165451	DH	On-Demand	Anodyne	SLC18A3	47	37
O=C(O)[C@H](c1ccccc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165452	DH	On-Demand	Anodyne	CCR5	107	38
O=C(O)[C@H](c1ccccc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165452	DH	On-Demand	Anodyne	SLC18A3	47	37
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1CC1(C(=O)O)CC1	ZINC000872165502	EI	On-Demand	Anodyne	TRPM8	48	33
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1oc(-c2ccccc2)nc1C(=O)O	ZINC000872165509	GJ	On-Demand	Anodyne	PDE8B	55	33
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872165517	EI	On-Demand	Anodyne	ACHE	16	40
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872165517	EI	On-Demand	Anodyne	LTA4H	22	42
CC1(C)[C@@H](c2ccccc2F)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872165517	EI	On-Demand	Anodyne	CYP2J2	44	32
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1cc(C(=O)O)co1	ZINC000872165519	FJ	On-Demand	Anodyne	CACNA1B	52	34
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1cc(C(=O)O)co1	ZINC000872165519	FJ	On-Demand	Anodyne	CCR2	54	37
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1CCCCCC(=O)O	ZINC000872165543	FJ	On-Demand	Anodyne	LIPG	45	34
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCCC(=O)O	ZINC000872165553	FJ	On-Demand	Anodyne	PTGFR	29	41
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCCC(=O)O	ZINC000872165553	FJ	On-Demand	Anodyne	PTGER4	24	47
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCCC(=O)O	ZINC000872165553	FJ	On-Demand	Anodyne	CACNA1B	48	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCCC(=O)O	ZINC000872165553	FJ	On-Demand	Anodyne	CCR2	62	38
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCCCC(=O)O	ZINC000872165553	FJ	On-Demand	Anodyne	LIPG	48	34
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)nc1	ZINC000872165559	DF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)nc1	ZINC000872165559	DF	On-Demand	Anodyne	SLC18A3	19	48
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)nc1	ZINC000872165560	DF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)nc1	ZINC000872165560	DF	On-Demand	Anodyne	SLC18A3	19	48
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	DRD4	15	43
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	SIGMAR1	24	43
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	PRCP	17	41
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	CCR5	97	39
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	MCHR1	34	42
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	PDE8B	60	36
O=C(O)c1nc(-c2ccccc2)oc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165563	GJ	On-Demand	Anodyne	DGAT1	15	40
O=C(O)c1cnc(CN2CCC(c3cccc(F)c3)CC2)cn1	ZINC000872165570	DF	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1cnc(CN2CCC(c3cccc(F)c3)CC2)cn1	ZINC000872165570	DF	On-Demand	Anodyne	CCR5	102	38
O=C(O)c1cnc(CN2CCC(c3cccc(F)c3)CC2)cn1	ZINC000872165570	DF	On-Demand	Anodyne	MCHR1	37	44
O=C(O)c1cnc(CN2CCC(c3cccc(F)c3)CC2)cn1	ZINC000872165570	DF	On-Demand	Anodyne	MGEA5	28	42
O=C(O)c1ccc([N+](=O)[O-])c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165577	FG	On-Demand	Bother	CCR3	40	42
O=C(O)c1ccc([N+](=O)[O-])c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165577	FG	On-Demand	Bother	MLNR	21	42
O=C(O)c1ccc([N+](=O)[O-])c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165577	FG	On-Demand	Bother	LIPG	17	43
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	DRD2	20	47
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	DRD4	18	45
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	ACHE	30	45
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	HRH1	20	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	SIGMAR1	18	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165578	GI	On-Demand	Bother	SSTR5	29	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	DRD2	20	47
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	DRD4	18	45
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	ACHE	30	45
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	HRH1	20	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	SIGMAR1	18	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2[N+](=O)[O-])CC1	ZINC000872165579	GI	On-Demand	Bother	SSTR5	29	41
O=C(O)COCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165584	CD	On-Demand	Anodyne	OPRL1	15	52
O=C(O)COCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165584	CD	On-Demand	Anodyne	SIGMAR1	31	52
O=C(O)COCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165584	CD	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)COCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165584	CD	On-Demand	Anodyne	EBP	18	45
O=C(O)COCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165585	CD	On-Demand	Anodyne	OPRL1	15	52
O=C(O)COCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165585	CD	On-Demand	Anodyne	SIGMAR1	31	52
O=C(O)COCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165585	CD	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)COCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165585	CD	On-Demand	Anodyne	EBP	18	45
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	OPRL1	15	48
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	GHRHR	16	40
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	CHRM3	17	44
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	SIGMAR1	58	61
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	SLC18A3	18	47
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	MCHR2	76	38
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165586	DG	On-Demand	Anodyne	AKR1C3	45	36
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	OPRL1	15	48
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	GHRHR	16	40
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	CHRM3	17	44
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	SIGMAR1	58	61
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	SLC18A3	18	47
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	MCHR2	76	38
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165587	DG	On-Demand	Anodyne	AKR1C3	45	36
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165588	GG	On-Demand	Anodyne	RBP4	47	35
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165588	GG	On-Demand	Anodyne	SMO	20	40
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165588	GG	On-Demand	Anodyne	ETHR	57	38
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165589	GG	On-Demand	Anodyne	RBP4	47	35
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165589	GG	On-Demand	Anodyne	SMO	20	40
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165589	GG	On-Demand	Anodyne	ETHR	57	38
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165590	GG	On-Demand	Anodyne	RBP4	47	35
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165590	GG	On-Demand	Anodyne	SMO	20	40
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872165590	GG	On-Demand	Anodyne	ETHR	57	38
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165591	GG	On-Demand	Anodyne	RBP4	47	35
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165591	GG	On-Demand	Anodyne	SMO	20	40
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872165591	GG	On-Demand	Anodyne	ETHR	57	38
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	DRD2	15	47
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	DRD4	23	48
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	HRH1	16	40
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	SIGMAR1	34	47
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	PRCP	17	42
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	CCR3	33	40
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	CCR5	91	36
O=C(O)c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1Cl	ZINC000872165592	EJ	On-Demand	Anodyne	MCHR1	38	45
O=C(O)c1cccc(CN2CC[C@@]3(CCc4ccccc43)C2)c1Cl	ZINC000872165593	EI	On-Demand	Anodyne	SIGMAR1	23	52
O=C(O)c1cccc(CN2CC[C@]3(CCc4ccccc43)C2)c1Cl	ZINC000872165594	EI	On-Demand	Anodyne	SIGMAR1	23	52
Cn1nnnc1C1CCN([C@@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872165595	DD	On-Demand	Anodyne	CCR3	44	31
Cn1nnnc1C1CCN([C@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872165596	DD	On-Demand	Anodyne	CCR3	44	31
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	HTR1A	15	46
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	DRD2	28	43
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	DRD4	17	40
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	HTR2A	34	41
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	HTR2C	16	46
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	SLC6A1	41	35
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	HRH1	36	43
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	DRD3	15	42
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	HRH3	26	40
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	CCR3	56	58
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)CCCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165601	CF	On-Demand	Anodyne	LIPG	22	46
COc1ccccc1[C@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165602	EH	On-Demand	Anodyne	HTR1A	20	41
COc1ccccc1[C@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165602	EH	On-Demand	Anodyne	DRD2	27	49
COc1ccccc1[C@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165602	EH	On-Demand	Anodyne	DRD4	22	45
COc1ccccc1[C@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165602	EH	On-Demand	Anodyne	HRH1	23	43
COc1ccccc1[C@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165602	EH	On-Demand	Anodyne	SIGMAR1	18	41
COc1ccccc1[C@@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165603	EH	On-Demand	Anodyne	HTR1A	20	41
COc1ccccc1[C@@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165603	EH	On-Demand	Anodyne	DRD2	27	49
COc1ccccc1[C@@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165603	EH	On-Demand	Anodyne	DRD4	22	45
COc1ccccc1[C@@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165603	EH	On-Demand	Anodyne	HRH1	23	43
COc1ccccc1[C@@H]1CCCN(Cc2occc2C(=O)O)CC1	ZINC000872165603	EH	On-Demand	Anodyne	SIGMAR1	18	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	HTR1A	40	46
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	DRD2	44	54
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	DRD4	37	49
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	ADRA1D	41	37
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	SLC6A1	86	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	HRH1	25	44
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	DRD3	24	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	HTR7	26	40
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	SIGMAR1	45	48
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	SSTR5	27	42
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	CCR3	23	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	CACNA1G	18	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	CCR8	24	41
COc1ccccc1[C@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165604	FI	On-Demand	Anodyne	MBTPS1	58	41
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	HTR1A	40	46
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	DRD2	44	54
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	DRD4	37	49
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	ADRA1D	41	37
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	SLC6A1	86	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	HRH1	25	44
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	DRD3	24	41
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	HTR7	26	40
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	SIGMAR1	45	48
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	SSTR5	27	42
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	CCR3	23	41
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	CACNA1G	18	41
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	CCR8	24	41
COc1ccccc1[C@@H]1CCCN(Cc2ccccc2CC(=O)O)CC1	ZINC000872165605	FI	On-Demand	Anodyne	MBTPS1	58	41
O=C(O)C1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165606	CE	On-Demand	Anodyne	OXTR	42	36
O=C(O)C1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165606	CE	On-Demand	Anodyne	SIGMAR1	24	54
O=C(O)C1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165606	CE	On-Demand	Anodyne	SLC18A3	17	42
O=C(O)C1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165607	CE	On-Demand	Anodyne	OXTR	42	36
O=C(O)C1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165607	CE	On-Demand	Anodyne	SIGMAR1	24	54
O=C(O)C1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165607	CE	On-Demand	Anodyne	SLC18A3	17	42
O=C(O)c1cnn2c(O)cc(CN3CCC(c4cccc(F)c4)CC3)nc12	ZINC000872165608	FF	On-Demand	Clean	PRCP	15	40
O=C(O)c1cnn2c(O)cc(CN3CCC(c4cccc(F)c4)CC3)nc12	ZINC000872165608	FF	On-Demand	Clean	CCR5	89	36
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	DRD2	26	50
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	DRD4	23	51
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	SLC6A1	128	42
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	HRH1	19	40
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	FDFT1	32	42
COc1ccccc1[C@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165609	FF	On-Demand	Anodyne	SIGMAR1	15	41
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	DRD2	26	50
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	DRD4	23	51
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	SLC6A1	128	42
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	HRH1	19	40
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	FDFT1	32	42
COc1ccccc1[C@@H]1CCCN(CC(=O)N2CCC(C(=O)O)CC2)CC1	ZINC000872165610	FF	On-Demand	Anodyne	SIGMAR1	15	41
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCC(=O)O	ZINC000872165626	EI	On-Demand	Anodyne	CACNA1B	54	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCC(=O)O	ZINC000872165626	EI	On-Demand	Anodyne	CCR2	67	39
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCC(=O)O	ZINC000872165626	EI	On-Demand	Anodyne	CYP2J2	46	33
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1CCCC(=O)O	ZINC000872165626	EI	On-Demand	Anodyne	LIPG	44	33
Cc1ncc(CN2CCC(c3nc(C)c(C(=O)O)s3)CC2)s1	ZINC000872165633	EG	On-Demand	Anodyne	MGEA5	38	47
COc1ccccc1[C@@H]1CCCN([C@@H](C(=O)O)c2cccc(Cl)c2)CC1	ZINC000872165639	FJ	On-Demand	Anodyne	RBP4	20	41
COc1ccccc1[C@H]1CCCN([C@@H](C(=O)O)c2cccc(Cl)c2)CC1	ZINC000872165645	FJ	On-Demand	Anodyne	RBP4	20	41
COc1ccccc1[C@@H]1CCCN([C@H](C(=O)O)c2cccc(Cl)c2)CC1	ZINC000872165646	FJ	On-Demand	Anodyne	RBP4	20	41
COc1ccccc1[C@H]1CCCN([C@H](C(=O)O)c2cccc(Cl)c2)CC1	ZINC000872165647	FJ	On-Demand	Anodyne	RBP4	20	41
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	DRD2	23	46
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	DRD4	52	40
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	ACHE	47	44
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	HRH2	15	45
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	HRH1	15	51
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	SIGMAR1	42	43
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	SSTR5	46	36
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	CCR3	29	45
Cn1nnnc1C1CCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872165648	DD	On-Demand	Anodyne	MCHR1	34	41
O=C(O)c1cccc(Br)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165649	GJ	On-Demand	Anodyne	SIGMAR1	26	42
O=C(O)c1cccc(Br)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165649	GJ	On-Demand	Anodyne	CCR3	17	42
O=C(O)c1cccc(Br)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165649	GJ	On-Demand	Anodyne	CCR5	89	34
O=C(O)/C=C/c1ccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165650	GE	On-Demand	Anodyne	CPT1A	19	41
O=C(O)/C=C/c1ccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165650	GE	On-Demand	Anodyne	ETHR	57	35
O=C(O)/C=C/c1ccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165651	GE	On-Demand	Anodyne	CPT1A	19	41
O=C(O)/C=C/c1ccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165651	GE	On-Demand	Anodyne	ETHR	57	35
O=C(O)/C=C\c1ccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165652	GE	On-Demand	Anodyne	CPT1A	19	41
O=C(O)/C=C\c1ccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165652	GE	On-Demand	Anodyne	ETHR	57	35
O=C(O)/C=C\c1ccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165654	GE	On-Demand	Anodyne	CPT1A	19	41
O=C(O)/C=C\c1ccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000872165654	GE	On-Demand	Anodyne	ETHR	57	35
O=C(O)Cn1cc(CCN2CC[C@]3(CCc4ccccc43)C2)nn1	ZINC000872165680	ED	On-Demand	Anodyne	SIGMAR1	15	48
O=C(O)Cn1cc(CCN2CC[C@@]3(CCc4ccccc43)C2)nn1	ZINC000872165681	ED	On-Demand	Anodyne	SIGMAR1	15	48
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HTR1A	83	49
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	DRD2	76	58
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	DRD1	15	40
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	DRD4	43	48
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HRH2	17	43
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HTR2A	32	49
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	SLC6A1	106	42
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	SLC6A4	15	41
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	ADRA1A	60	43
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HRH1	38	45
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	ADRA1B	60	43
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	DRD3	58	40
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HTR4	51	44
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HTR7	60	42
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	HRH3	20	41
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	SIGMAR1	49	49
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	EBP	38	42
COc1ccccc1[C@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165682	DE	On-Demand	Anodyne	MCHR1	15	40
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HTR1A	83	49
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	DRD2	76	58
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	DRD1	15	40
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	DRD4	43	48
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HRH2	17	43
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HTR2A	32	49
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	SLC6A1	106	42
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	SLC6A4	15	41
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	ADRA1A	60	43
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HRH1	38	45
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	ADRA1B	60	43
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	DRD3	58	40
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HTR4	51	44
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HTR7	60	42
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	HRH3	20	41
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	SIGMAR1	49	49
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	EBP	38	42
COc1ccccc1[C@@H]1CCCN(CCOCC(=O)O)CC1	ZINC000872165683	DE	On-Demand	Anodyne	MCHR1	15	40
O=C(O)CC1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165684	CF	On-Demand	Anodyne	OXTR	40	35
O=C(O)CC1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165684	CF	On-Demand	Anodyne	SIGMAR1	18	51
O=C(O)CC1(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872165684	CF	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)CC1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165685	CF	On-Demand	Anodyne	OXTR	40	35
O=C(O)CC1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165685	CF	On-Demand	Anodyne	SIGMAR1	18	51
O=C(O)CC1(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872165685	CF	On-Demand	Anodyne	SLC18A3	16	40
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(C(=O)O)o1	ZINC000872165696	FJ	On-Demand	Anodyne	CACNA1B	53	35
CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(C(=O)O)o1	ZINC000872165696	FJ	On-Demand	Anodyne	CCR2	53	37
CC1(C)[C@@H](c2ccc(C(F)(F)F)cc2)CCN1CCc1ccccc1C(=O)O	ZINC000872165712	GK	On-Demand	Anodyne	LIPG	46	34
O=C(O)[C@@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165724	EG	On-Demand	Anodyne	HRH1	19	42
O=C(O)[C@@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165724	EG	On-Demand	Anodyne	CCR3	30	47
O=C(O)[C@@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165724	EG	On-Demand	Anodyne	LIPG	16	43
O=C(O)[C@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165725	EG	On-Demand	Anodyne	HRH1	19	42
O=C(O)[C@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165725	EG	On-Demand	Anodyne	CCR3	30	47
O=C(O)[C@H](c1ccccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165725	EG	On-Demand	Anodyne	LIPG	16	43
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	DRD2	22	51
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	DRD4	34	51
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	ACHE	16	43
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	HTR2A	16	43
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	SIGMAR1	45	51
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	PRCP	18	40
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	CCR3	45	43
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	CCR5	108	40
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	SLC18A3	56	41
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	CCR2	17	40
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	MCHR1	40	47
O=C(O)Cc1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165728	EH	On-Demand	Anodyne	MGEA5	26	40
C[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165729	BE	On-Demand	Anodyne	OXTR	47	36
C[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165729	BE	On-Demand	Anodyne	OPRL1	20	45
C[C@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165729	BE	On-Demand	Anodyne	SLC18A3	15	43
C[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165730	BE	On-Demand	Anodyne	OXTR	47	36
C[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165730	BE	On-Demand	Anodyne	OPRL1	20	45
C[C@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165730	BE	On-Demand	Anodyne	SLC18A3	15	43
C[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165731	BE	On-Demand	Anodyne	OXTR	47	36
C[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165731	BE	On-Demand	Anodyne	OPRL1	20	45
C[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165731	BE	On-Demand	Anodyne	SLC18A3	15	43
C[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165732	BE	On-Demand	Anodyne	OXTR	47	36
C[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165732	BE	On-Demand	Anodyne	OPRL1	20	45
C[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165732	BE	On-Demand	Anodyne	SLC18A3	15	43
O=C(O)[C@H](c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165737	DG	On-Demand	Anodyne	OPRL1	29	44
O=C(O)[C@H](c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165737	DG	On-Demand	Anodyne	SLC18A3	15	42
O=C(O)[C@H](c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165738	DG	On-Demand	Anodyne	OPRL1	29	44
O=C(O)[C@H](c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165738	DG	On-Demand	Anodyne	SLC18A3	15	42
O=C(O)[C@@H](c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165739	DG	On-Demand	Anodyne	OPRL1	29	44
O=C(O)[C@@H](c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165739	DG	On-Demand	Anodyne	SLC18A3	15	42
O=C(O)[C@@H](c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165740	DG	On-Demand	Anodyne	OPRL1	29	44
O=C(O)[C@@H](c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165740	DG	On-Demand	Anodyne	SLC18A3	15	42
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	HTR1A	31	45
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	DRD2	29	49
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	DRD4	21	44
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	ADRA1D	42	33
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	HRH1	22	40
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1[C@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165741	FE	On-Demand	Anodyne	SIGMAR1	19	45
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	HTR1A	31	45
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	DRD2	29	49
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	DRD4	21	44
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	ADRA1D	42	33
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	HRH1	22	40
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1[C@@H]1CCCN(CCc2cn(CC(=O)O)nn2)CC1	ZINC000872165742	FE	On-Demand	Anodyne	SIGMAR1	19	45
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)s1	ZINC000872165743	DH	On-Demand	Anodyne	SIGMAR1	31	51
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)s1	ZINC000872165744	DH	On-Demand	Anodyne	SIGMAR1	31	51
C[C@H](c1ccc(C(=O)O)o1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165747	DH	On-Demand	Anodyne	SLC18A3	15	42
C[C@@H](c1ccc(C(=O)O)o1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165748	DH	On-Demand	Anodyne	SLC18A3	15	42
C[C@@H](c1ccc(C(=O)O)o1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165749	DH	On-Demand	Anodyne	SLC18A3	15	42
C[C@H](c1ccc(C(=O)O)o1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165750	DH	On-Demand	Anodyne	SLC18A3	15	42
O=C(O)c1ccccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165753	DG	On-Demand	Anodyne	SIGMAR1	26	54
O=C(O)c1ccccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165753	DG	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)c1ccccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165754	DG	On-Demand	Anodyne	SIGMAR1	26	54
O=C(O)c1ccccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165754	DG	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	HTR1A	18	42
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	DRD2	34	49
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	DRD4	20	49
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	ADRA1D	17	41
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	HTR2A	40	40
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	SLC6A1	51	42
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	ADRA1A	25	41
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	HRH1	29	45
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	ADRA1B	21	41
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	SIGMAR1	29	47
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	PRCP	21	43
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	CCR5	100	38
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	SLC18A3	43	40
O=C(O)COCCN1CCC(c2cccc(F)c2)CC1	ZINC000872165757	CE	On-Demand	Anodyne	MCHR1	36	44
COc1ccccc1[C@H]1CCCN([C@H](C(=O)O)c2ccccc2)CC1	ZINC000872165760	EI	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@H]1CCCN([C@H](C(=O)O)c2ccccc2)CC1	ZINC000872165760	EI	On-Demand	Anodyne	DRD2	15	50
COc1ccccc1[C@H]1CCCN([C@@H](C(=O)O)c2ccccc2)CC1	ZINC000872165761	EI	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@H]1CCCN([C@@H](C(=O)O)c2ccccc2)CC1	ZINC000872165761	EI	On-Demand	Anodyne	DRD2	15	50
COc1ccccc1[C@@H]1CCCN([C@@H](C(=O)O)c2ccccc2)CC1	ZINC000872165762	EI	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@@H]1CCCN([C@@H](C(=O)O)c2ccccc2)CC1	ZINC000872165762	EI	On-Demand	Anodyne	DRD2	15	50
COc1ccccc1[C@@H]1CCCN([C@H](C(=O)O)c2ccccc2)CC1	ZINC000872165763	EI	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@@H]1CCCN([C@H](C(=O)O)c2ccccc2)CC1	ZINC000872165763	EI	On-Demand	Anodyne	DRD2	15	50
C=C[C@@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165764	CF	On-Demand	Mild	CCR5	102	38
C=C[C@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872165765	CF	On-Demand	Mild	CCR5	102	38
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	HTR1A	49	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	DRD2	43	53
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	ADRA1D	57	37
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	ADRA1A	47	49
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	HRH1	24	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	SIGMAR1	26	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165766	EI	On-Demand	Anodyne	MGEA5	32	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	HTR1A	49	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	DRD2	43	53
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	ADRA1D	57	37
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	ADRA1A	47	49
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	HRH1	24	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	SIGMAR1	26	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165767	EI	On-Demand	Anodyne	MGEA5	32	42
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)c(F)c1	ZINC000872165768	EH	On-Demand	Anodyne	SIGMAR1	20	50
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)c(F)c1	ZINC000872165769	EH	On-Demand	Anodyne	SIGMAR1	20	50
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)s2)CC1	ZINC000872165770	DD	On-Demand	Anodyne	MGEA5	34	42
COc1ccccc1[C@H]1CCCN([C@H](CC(C)C)C(=O)O)CC1	ZINC000872165775	DH	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@H]1CCCN([C@H](CC(C)C)C(=O)O)CC1	ZINC000872165775	DH	On-Demand	Anodyne	DRD2	18	49
COc1ccccc1[C@@H]1CCCN([C@H](CC(C)C)C(=O)O)CC1	ZINC000872165776	DH	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@@H]1CCCN([C@H](CC(C)C)C(=O)O)CC1	ZINC000872165776	DH	On-Demand	Anodyne	DRD2	18	49
COc1ccccc1[C@H]1CCCN([C@@H](CC(C)C)C(=O)O)CC1	ZINC000872165777	DH	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@H]1CCCN([C@@H](CC(C)C)C(=O)O)CC1	ZINC000872165777	DH	On-Demand	Anodyne	DRD2	18	49
COc1ccccc1[C@@H]1CCCN([C@@H](CC(C)C)C(=O)O)CC1	ZINC000872165778	DH	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@@H]1CCCN([C@@H](CC(C)C)C(=O)O)CC1	ZINC000872165778	DH	On-Demand	Anodyne	DRD2	18	49
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	DRD2	26	52
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	DRD4	46	49
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	ACHE	23	46
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	HRH1	20	42
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	KCNH2	15	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	CHRM3	21	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	FABP4	28	45
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	SIGMAR1	50	52
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	CCR3	66	47
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	CCR5	104	38
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	SLC18A3	46	45
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	MLNR	30	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	CCR2	21	40
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	S1PR1	15	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	MCHR1	60	46
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F	ZINC000872165781	EI	On-Demand	Anodyne	CACNA1G	28	41
O=C(O)c1oc2ccccc2c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165782	FJ	On-Demand	Anodyne	DRD2	15	45
O=C(O)c1oc2ccccc2c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165782	FJ	On-Demand	Anodyne	SIGMAR1	31	43
O=C(O)c1oc2ccccc2c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165782	FJ	On-Demand	Anodyne	CCR5	89	35
O=C(O)c1oc2ccccc2c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165782	FJ	On-Demand	Anodyne	SLC18A3	42	37
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	DRD2	29	45
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	DRD4	18	42
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	HTR2A	36	42
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	HTR2C	18	46
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	SLC6A1	78	37
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	HRH1	36	43
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	DRD3	15	42
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	HRH3	26	40
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	SIGMAR1	33	42
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	CCR3	56	58
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	CYP2J2	47	33
O=C(O)CCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165787	CE	On-Demand	Anodyne	LIPG	22	46
O=C(O)c1cccc(CN2CCO[C@@H](c3noc(C4CC4)n3)C2)c1Cl	ZINC000872165790	FF	On-Demand	Anodyne	ETHR	53	34
O=C(O)c1cccc(CN2CCO[C@H](c3noc(C4CC4)n3)C2)c1Cl	ZINC000872165791	FF	On-Demand	Anodyne	ETHR	53	34
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165793	EI	On-Demand	Anodyne	CCR1	17	40
O=C(O)[C@@H](c1cccc(Cl)c1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165793	EI	On-Demand	Anodyne	CCR5	92	38
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165794	EI	On-Demand	Anodyne	CCR1	17	40
O=C(O)[C@H](c1cccc(Cl)c1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165794	EI	On-Demand	Anodyne	CCR5	92	38
O=C(O)[C@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165795	DE	On-Demand	Anodyne	HRH1	16	46
O=C(O)[C@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165795	DE	On-Demand	Anodyne	CCR3	19	46
O=C(O)[C@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165795	DE	On-Demand	Anodyne	LIPG	19	41
O=C(O)[C@@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165796	DE	On-Demand	Anodyne	HRH1	16	46
O=C(O)[C@@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165796	DE	On-Demand	Anodyne	CCR3	19	46
O=C(O)[C@@H](c1cccnc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165796	DE	On-Demand	Anodyne	LIPG	19	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	DRD4	25	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	HRH1	32	49
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	CHRM3	20	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	HRH3	15	43
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	SIGMAR1	32	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	CCR3	92	49
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	UTS2R	16	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	SLC18A3	23	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	MLNR	75	51
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	MCHR1	31	42
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1F	ZINC000872165797	EG	On-Demand	Anodyne	LIPG	50	50
CCCC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165802	CF	On-Demand	Anodyne	HRH1	19	46
CCCC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165802	CF	On-Demand	Anodyne	HRH3	21	46
CCCC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165802	CF	On-Demand	Anodyne	CCR3	30	49
CCCC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165802	CF	On-Demand	Anodyne	CCR5	52	36
CCCC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165802	CF	On-Demand	Anodyne	LIPG	25	45
CCCC[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165803	CF	On-Demand	Anodyne	HRH1	19	46
CCCC[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165803	CF	On-Demand	Anodyne	HRH3	21	46
CCCC[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165803	CF	On-Demand	Anodyne	CCR3	30	49
CCCC[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165803	CF	On-Demand	Anodyne	CCR5	52	36
CCCC[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165803	CF	On-Demand	Anodyne	LIPG	25	45
COc1ccccc1[C@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165804	FG	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1[C@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165804	FG	On-Demand	Anodyne	DRD2	22	49
COc1ccccc1[C@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165804	FG	On-Demand	Anodyne	SLC6A1	120	41
COc1ccccc1[C@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165804	FG	On-Demand	Anodyne	SIGMAR1	16	41
COc1ccccc1[C@@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165805	FG	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1[C@@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165805	FG	On-Demand	Anodyne	DRD2	22	49
COc1ccccc1[C@@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165805	FG	On-Demand	Anodyne	SLC6A1	120	41
COc1ccccc1[C@@H]1CCCN(CC2(O)CCC(C(=O)O)CC2)CC1	ZINC000872165805	FG	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)c1csc(CN2CC[C@@]3(CCc4ccccc43)C2)n1	ZINC000872165812	DF	On-Demand	Anodyne	SIGMAR1	27	49
O=C(O)c1csc(CN2CC[C@]3(CCc4ccccc43)C2)n1	ZINC000872165813	DF	On-Demand	Anodyne	SIGMAR1	27	49
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165815	GH	On-Demand	Anodyne	HRH1	26	43
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165815	GH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165815	GH	On-Demand	Anodyne	CCR3	50	45
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165815	GH	On-Demand	Anodyne	MLNR	22	44
O=C(O)c1ccc(Br)cc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165815	GH	On-Demand	Anodyne	LIPG	38	48
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)c(Br)c1	ZINC000872165819	GI	On-Demand	Anodyne	SIGMAR1	17	48
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)c(Br)c1	ZINC000872165820	GI	On-Demand	Anodyne	SIGMAR1	17	48
O=C(O)c1csc(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872165823	DH	On-Demand	Anodyne	SIGMAR1	37	50
O=C(O)c1csc(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872165824	DH	On-Demand	Anodyne	SIGMAR1	37	50
CN(Cc1ccc2cc[nH]c2c1)CC1(C(=O)O)CC1	ZINC000872165829	CE	On-Demand	Anodyne	FFAR2	24	41
CC[C@@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165834	CG	On-Demand	Anodyne	DRD2	28	54
CC[C@@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165834	CG	On-Demand	Anodyne	DRD4	16	47
CC[C@@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165834	CG	On-Demand	Anodyne	ACKR3	43	32
CC[C@@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165836	CG	On-Demand	Anodyne	DRD2	28	54
CC[C@@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165836	CG	On-Demand	Anodyne	DRD4	16	47
CC[C@@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165836	CG	On-Demand	Anodyne	ACKR3	43	32
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	HTR1A	15	48
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	DRD2	24	48
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	HRH2	23	49
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	SLC6A1	124	38
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	HRH1	48	51
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	LTA4H	39	44
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	HTR7	23	48
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	SIGMAR1	24	40
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	CCR3	51	50
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	MLNR	18	43
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	ABCB1	20	42
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	CACNA1G	28	41
O=C(O)c1ccccc1OCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165837	EG	On-Demand	Anodyne	LIPG	50	46
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	DRD2	22	47
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	DRD4	31	48
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	SIGMAR1	34	45
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	PRCP	24	44
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	CCR3	25	42
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	CCR5	90	37
O=C(O)c1cccc(Cl)c1CN1CCC(c2cccc(F)c2)CC1	ZINC000872165838	EJ	On-Demand	Anodyne	MCHR1	36	40
O=C(O)[C@@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165839	DG	On-Demand	Anodyne	HRH1	18	53
O=C(O)[C@@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165839	DG	On-Demand	Anodyne	SLC6A3	23	44
O=C(O)[C@@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165839	DG	On-Demand	Anodyne	CCR3	25	53
O=C(O)[C@@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165839	DG	On-Demand	Anodyne	LIPG	15	45
O=C(O)[C@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165840	DG	On-Demand	Anodyne	HRH1	18	53
O=C(O)[C@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165840	DG	On-Demand	Anodyne	SLC6A3	23	44
O=C(O)[C@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165840	DG	On-Demand	Anodyne	CCR3	25	53
O=C(O)[C@H](c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165840	DG	On-Demand	Anodyne	LIPG	15	45
O=C(O)c1ccc(CN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1Cl	ZINC000872165841	FF	On-Demand	Anodyne	ETHR	50	33
O=C(O)c1ccc(CN2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1Cl	ZINC000872165842	FF	On-Demand	Anodyne	ETHR	50	33
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)cc1	ZINC000872165843	GK	On-Demand	Anodyne	DRD4	24	46
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)cc1	ZINC000872165843	GK	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)cc1	ZINC000872165843	GK	On-Demand	Anodyne	CCR3	18	40
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)cc1	ZINC000872165843	GK	On-Demand	Anodyne	CCR5	100	39
O=C(O)c1ccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)cc1	ZINC000872165843	GK	On-Demand	Anodyne	MCHR1	43	46
COc1ccccc1[C@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165844	DH	On-Demand	Anodyne	HTR1A	28	42
COc1ccccc1[C@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165844	DH	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1[C@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165844	DH	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccccc1[C@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165844	DH	On-Demand	Anodyne	EBP	22	40
COc1ccccc1[C@@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165845	DH	On-Demand	Anodyne	HTR1A	28	42
COc1ccccc1[C@@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165845	DH	On-Demand	Anodyne	DRD2	23	51
COc1ccccc1[C@@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165845	DH	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccccc1[C@@H]1CCCN(CC2(CC(=O)O)CC2)CC1	ZINC000872165845	DH	On-Demand	Anodyne	EBP	22	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	HTR1A	26	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	DRD2	42	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	DRD4	38	48
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	ACHE	34	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	ADRA1D	24	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	HTR2A	15	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	SLC6A1	59	39
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	ADRA1A	25	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	HRH1	33	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	ADRA1B	26	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	HTR7	15	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	SIGMAR1	34	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	SSTR5	43	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	MCHR1	28	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	CACNA1G	28	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	MBTPS1	42	39
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165848	FI	On-Demand	Anodyne	ACKR3	65	33
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	HTR1A	26	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	DRD2	42	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	DRD4	38	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	ACHE	34	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	ADRA1D	24	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	HTR2A	15	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	SLC6A1	59	39
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	ADRA1A	25	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	HRH1	33	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	ADRA1B	26	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	HTR7	15	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	SIGMAR1	34	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	SSTR5	43	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	MCHR1	28	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	CACNA1G	28	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	MBTPS1	42	39
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872165849	FI	On-Demand	Anodyne	ACKR3	65	33
C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165850	CD	On-Demand	Anodyne	HRH3	25	45
C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165850	CD	On-Demand	Anodyne	CCR3	21	47
C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165850	CD	On-Demand	Anodyne	EPHX2	17	40
C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165850	CD	On-Demand	Anodyne	LIPG	20	47
C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165851	CD	On-Demand	Anodyne	HRH3	25	45
C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165851	CD	On-Demand	Anodyne	CCR3	21	47
C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165851	CD	On-Demand	Anodyne	EPHX2	17	40
C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165851	CD	On-Demand	Anodyne	LIPG	20	47
COc1ccccc1[C@@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165852	EG	On-Demand	Anodyne	DRD2	27	48
COc1ccccc1[C@@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165852	EG	On-Demand	Anodyne	DRD4	22	46
COc1ccccc1[C@@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165852	EG	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165852	EG	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165852	EG	On-Demand	Anodyne	ADRA1B	19	41
COc1ccccc1[C@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165853	EG	On-Demand	Anodyne	DRD2	27	48
COc1ccccc1[C@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165853	EG	On-Demand	Anodyne	DRD4	22	46
COc1ccccc1[C@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165853	EG	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165853	EG	On-Demand	Anodyne	HRH1	22	41
COc1ccccc1[C@H]1CCCN(Cc2oncc2C(=O)O)CC1	ZINC000872165853	EG	On-Demand	Anodyne	ADRA1B	19	41
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ADRB2	22	47
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ADRB1	31	47
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	HTR1A	24	41
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	DRD2	19	48
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	DRD4	16	52
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ADRA1A	22	41
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	HRH1	24	40
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ADRB3	18	41
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ACOX1	58	40
COc1ccccc1[C@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165854	GG	On-Demand	Anodyne	ABCB1	85	51
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ADRB2	22	47
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ADRB1	31	47
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	HTR1A	24	41
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	DRD2	19	48
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	DRD4	16	52
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ADRA1A	22	41
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	HRH1	24	40
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ADRB3	18	41
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ACOX1	58	40
COc1ccccc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165855	GG	On-Demand	Anodyne	ABCB1	85	51
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ADRB2	22	47
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ADRB1	31	47
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	HTR1A	24	41
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	DRD2	19	48
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	DRD4	16	52
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ADRA1A	22	41
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	HRH1	24	40
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ADRB3	18	41
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ACOX1	58	40
COc1ccccc1[C@@H]1CCCN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165856	GG	On-Demand	Anodyne	ABCB1	85	51
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ADRB2	22	47
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ADRB1	31	47
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	HTR1A	24	41
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	DRD2	19	48
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	DRD4	16	52
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ADRA1A	22	41
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	HRH1	24	40
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ADRB3	18	41
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ACOX1	58	40
COc1ccccc1[C@H]1CCCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC1	ZINC000872165857	GG	On-Demand	Anodyne	ABCB1	85	51
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CHRM2	20	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HTR1A	49	48
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	DRD2	69	53
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	FKBP1A	42	35
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	DRD4	87	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	ACHE	68	52
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HTR2A	18	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	SLC6A1	62	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HRH1	45	46
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	DRD3	43	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	SLC6A3	16	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	KCNH2	17	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HTR4	32	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CHRM3	22	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	LTA4H	41	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	TACR1	17	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HTR7	20	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	FABP4	28	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HRH3	28	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	SIGMAR1	84	50
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	SSTR5	71	39
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	BCHE	15	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CCR3	49	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CCR5	31	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	SLC18A3	25	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	HCRTR2	32	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	MCHR1	42	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CCR8	31	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	CYP2J2	47	34
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	MBTPS1	66	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	NOD2	42	38
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165858	EI	On-Demand	Anodyne	ACKR3	47	32
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CHRM2	20	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HTR1A	49	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	DRD2	69	53
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	FKBP1A	42	35
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	DRD4	87	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	ACHE	68	52
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HTR2A	18	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	SLC6A1	62	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HRH1	45	46
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	DRD3	43	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	SLC6A3	16	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	KCNH2	17	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HTR4	32	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CHRM3	22	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	LTA4H	41	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	TACR1	17	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HTR7	20	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	FABP4	28	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HRH3	28	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	SIGMAR1	84	50
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	SSTR5	71	39
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	BCHE	15	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CCR3	49	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CCR5	31	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	SLC18A3	25	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	HCRTR2	32	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	MCHR1	42	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CCR8	31	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	CYP2J2	47	34
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	MBTPS1	66	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	NOD2	42	38
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000872165859	EI	On-Demand	Anodyne	ACKR3	47	32
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	DRD2	30	48
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	DRD4	28	48
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	ADRA1D	15	40
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	HTR2A	46	44
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	HTR2C	20	44
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	SLC6A1	46	36
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	HRH1	30	41
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	ADRA1B	19	40
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	HTR7	17	44
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	FABP4	38	42
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	SIGMAR1	38	46
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	PRCP	23	42
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	CCR3	52	43
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	CCR5	100	38
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	SLC18A3	46	39
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	CCR2	17	42
O=C(O)c1ccccc1CCN1CCC(c2cccc(F)c2)CC1	ZINC000872165860	EH	On-Demand	Anodyne	MCHR1	36	45
O=C(O)Cn1cc(CCN2CC[C@H](Oc3ccc(F)cc3)C2)nn1	ZINC000872165861	ED	On-Demand	Anodyne	CCR3	31	44
O=C(O)c1sc2cccc(F)c2c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165867	GJ	On-Demand	Anodyne	CCR3	31	42
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165868	EH	On-Demand	Anodyne	OPRL1	16	41
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165868	EH	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165869	EH	On-Demand	Anodyne	OPRL1	16	41
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165869	EH	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165870	EH	On-Demand	Anodyne	OPRL1	16	41
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165870	EH	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165871	EH	On-Demand	Anodyne	OPRL1	16	41
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872165871	EH	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)c1cc(CN2CC[C@]3(CCc4ccccc43)C2)cs1	ZINC000872165872	DH	On-Demand	Anodyne	SIGMAR1	38	56
O=C(O)c1cc(CN2CC[C@]3(CCc4ccccc43)C2)cs1	ZINC000872165872	DH	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)c1cc(CN2CC[C@]3(CCc4ccccc43)C2)cs1	ZINC000872165872	DH	On-Demand	Anodyne	MCHR2	62	35
O=C(O)c1cc(CN2CC[C@@]3(CCc4ccccc43)C2)cs1	ZINC000872165873	DH	On-Demand	Anodyne	SIGMAR1	38	56
O=C(O)c1cc(CN2CC[C@@]3(CCc4ccccc43)C2)cs1	ZINC000872165873	DH	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)c1cc(CN2CC[C@@]3(CCc4ccccc43)C2)cs1	ZINC000872165873	DH	On-Demand	Anodyne	MCHR2	62	35
CCCC[C@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165876	DH	On-Demand	Anodyne	DRD2	25	53
CCCC[C@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165876	DH	On-Demand	Anodyne	DRD4	15	44
CCCC[C@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165877	DH	On-Demand	Anodyne	DRD2	25	53
CCCC[C@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165877	DH	On-Demand	Anodyne	DRD4	15	44
CCCC[C@@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165878	DH	On-Demand	Anodyne	DRD2	25	53
CCCC[C@@H](C(=O)O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000872165878	DH	On-Demand	Anodyne	DRD4	15	44
CCCC[C@@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165879	DH	On-Demand	Anodyne	DRD2	25	53
CCCC[C@@H](C(=O)O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000872165879	DH	On-Demand	Anodyne	DRD4	15	44
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	DRD2	16	47
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	DRD4	27	50
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	KCNH2	18	44
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	SIGMAR1	40	47
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	CCR3	56	48
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	CCR5	103	39
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	SLC18A3	32	41
O=C(O)c1cc2cc(CN3CCC(c4cccc(F)c4)CC3)ccc2o1	ZINC000872165880	FJ	On-Demand	Anodyne	MCHR1	55	47
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165883	EG	On-Demand	Anodyne	SLC6A3	19	41
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165883	EG	On-Demand	Anodyne	CCR3	18	47
O=C(O)[C@@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165883	EG	On-Demand	Anodyne	LIPG	15	47
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165884	EG	On-Demand	Anodyne	SLC6A3	19	41
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165884	EG	On-Demand	Anodyne	CCR3	18	47
O=C(O)[C@H](c1ccc(F)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165884	EG	On-Demand	Anodyne	LIPG	15	47
O=C(O)c1cnc(CN2CC[C@]3(CCc4ccccc43)C2)cn1	ZINC000872165885	DE	On-Demand	Anodyne	OXTR	44	35
O=C(O)c1cnc(CN2CC[C@]3(CCc4ccccc43)C2)cn1	ZINC000872165885	DE	On-Demand	Anodyne	SIGMAR1	16	49
O=C(O)c1cnc(CN2CC[C@@]3(CCc4ccccc43)C2)cn1	ZINC000872165886	DE	On-Demand	Anodyne	OXTR	44	35
O=C(O)c1cnc(CN2CC[C@@]3(CCc4ccccc43)C2)cn1	ZINC000872165886	DE	On-Demand	Anodyne	SIGMAR1	16	49
COc1ccccc1[C@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165887	EH	On-Demand	Anodyne	HTR1A	21	43
COc1ccccc1[C@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165887	EH	On-Demand	Anodyne	DRD2	24	49
COc1ccccc1[C@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165887	EH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1[C@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165887	EH	On-Demand	Anodyne	HRH1	21	40
COc1ccccc1[C@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165887	EH	On-Demand	Anodyne	SIGMAR1	25	43
COc1ccccc1[C@@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165888	EH	On-Demand	Anodyne	HTR1A	21	43
COc1ccccc1[C@@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165888	EH	On-Demand	Anodyne	DRD2	24	49
COc1ccccc1[C@@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165888	EH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1[C@@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165888	EH	On-Demand	Anodyne	HRH1	21	40
COc1ccccc1[C@@H]1CCCN(Cc2ccoc2C(=O)O)CC1	ZINC000872165888	EH	On-Demand	Anodyne	SIGMAR1	25	43
Cc1ccc(CN2CCO[C@H](c3noc(C4CC4)n3)C2)cc1C(=O)O	ZINC000872165889	EF	On-Demand	Anodyne	ETHR	45	33
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	HTR1A	34	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	DRD2	58	51
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	DRD4	69	49
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	ACHE	47	44
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	SLC6A1	63	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	ADRA1A	24	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	HRH1	33	53
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	DRD3	40	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	AVPR1B	40	33
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	HTR4	25	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	FABP4	35	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	SIGMAR1	54	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	SSTR5	72	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	CCR3	48	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	MCHR1	43	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	CCR8	25	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165893	FI	On-Demand	Anodyne	MBTPS1	49	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	HTR1A	34	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	DRD2	58	51
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	DRD4	69	49
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	ACHE	47	44
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	SLC6A1	63	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	ADRA1A	24	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	HRH1	33	53
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	DRD3	40	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	AVPR1B	40	33
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	HTR4	25	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	FABP4	35	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	SIGMAR1	54	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	SSTR5	72	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	CCR3	48	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	MCHR1	43	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	CCR8	25	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C)c(C(=O)O)c2)CC1	ZINC000872165894	FI	On-Demand	Anodyne	MBTPS1	49	44
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ESR1	49	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HTR1A	71	44
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	DRD2	71	52
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	FKBP1A	50	38
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	DRD1	15	44
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	DRD4	50	52
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ACHE	42	45
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HRH2	51	57
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ADRA1D	56	37
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HTR2A	36	43
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	SLC6A1	97	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	SLC6A4	21	47
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ADRA1A	51	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HRH1	48	57
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ADRA1B	54	37
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	DRD3	50	44
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HTR4	42	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ESR2	34	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	LTA4H	55	45
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HCRTR1	15	40
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HTR7	44	43
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	HRH3	58	47
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	SIGMAR1	49	43
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	NPY1R	44	40
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	CCR3	27	40
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	EBP	49	39
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	PLA2G4B	46	41
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	CHRNA10	47	37
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	MCHR1	36	46
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	CACNA1G	17	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	PSMB2	40	41
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	PSMB1	44	42
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	MEN1	42	34
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	ACKR3	71	37
COc1ccccc1[C@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165900	FI	On-Demand	Anodyne	CYSK1	40	33
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ESR1	49	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HTR1A	71	44
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	DRD2	71	52
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	FKBP1A	50	38
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	DRD1	15	44
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	DRD4	50	52
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ACHE	42	45
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HRH2	51	57
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ADRA1D	56	37
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HTR2A	36	43
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	SLC6A1	97	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	SLC6A4	21	47
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ADRA1A	51	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HRH1	48	57
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ADRA1B	54	37
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	DRD3	50	44
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HTR4	42	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ESR2	34	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	LTA4H	55	45
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HCRTR1	15	40
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HTR7	44	43
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	HRH3	58	47
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	SIGMAR1	49	43
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	NPY1R	44	40
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	CCR3	27	40
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	EBP	49	39
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	PLA2G4B	46	41
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	CHRNA10	47	37
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	MCHR1	36	46
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	CACNA1G	17	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	PSMB2	40	41
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	PSMB1	44	42
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	MEN1	42	34
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	ACKR3	71	37
COc1ccccc1[C@@H]1CCCN(CCOc2cccc(C(=O)O)c2)CC1	ZINC000872165901	FI	On-Demand	Anodyne	CYSK1	40	33
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165904	FG	On-Demand	Anodyne	LTA4H	36	42
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165904	FG	On-Demand	Anodyne	HRH3	20	41
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165904	FG	On-Demand	Anodyne	CCR3	18	46
O=C(O)/C=C\c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165904	FG	On-Demand	Anodyne	LIPG	19	42
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165905	FG	On-Demand	Anodyne	LTA4H	36	42
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165905	FG	On-Demand	Anodyne	HRH3	20	41
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165905	FG	On-Demand	Anodyne	CCR3	18	46
O=C(O)/C=C/c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000872165905	FG	On-Demand	Anodyne	LIPG	19	42
C[C@@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165906	DG	On-Demand	Anodyne	HRH3	17	42
C[C@@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165906	DG	On-Demand	Anodyne	CCR3	25	45
C[C@@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165906	DG	On-Demand	Anodyne	LIPG	17	43
C[C@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165907	DG	On-Demand	Anodyne	HRH3	17	42
C[C@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165907	DG	On-Demand	Anodyne	CCR3	25	45
C[C@H](c1ccc(C(=O)O)o1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165907	DG	On-Demand	Anodyne	LIPG	17	43
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	DRD2	15	44
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	DRD4	18	48
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	SIGMAR1	28	42
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	PRCP	15	40
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	CCR5	98	36
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	MCHR1	34	40
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	MLYCD	15	40
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872165909	DH	On-Demand	Anodyne	MGEA5	35	43
Cc1ccccc1[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165916	EG	On-Demand	Anodyne	HRH1	18	44
Cc1ccccc1[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165916	EG	On-Demand	Anodyne	CCR3	28	44
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165917	EG	On-Demand	Anodyne	HRH1	18	44
Cc1ccccc1[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165917	EG	On-Demand	Anodyne	CCR3	28	44
O=C(O)c1ccoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165920	DF	On-Demand	Anodyne	CCR3	34	46
O=C(O)c1ccoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165920	DF	On-Demand	Anodyne	MLNR	18	43
O=C(O)c1ccoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165920	DF	On-Demand	Anodyne	LIPG	37	47
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	ESR1	62	41
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	HTR1A	39	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	DRD2	39	50
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	DRD4	17	44
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	HRH2	20	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	SLC6A1	63	37
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	HRH1	27	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	DRD3	28	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	ESR2	45	41
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	LTA4H	58	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	HRH3	52	47
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	SIGMAR1	29	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	PSMB2	42	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	PSMB1	46	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165921	GI	On-Demand	Anodyne	ACKR3	49	36
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	ESR1	62	41
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	HTR1A	39	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	DRD2	39	50
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	DRD4	17	44
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	HRH2	20	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	SLC6A1	63	37
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	HRH1	27	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	DRD3	28	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	ESR2	45	41
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	LTA4H	58	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	HRH3	52	47
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	SIGMAR1	29	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	PSMB2	42	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	PSMB1	46	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872165922	GI	On-Demand	Anodyne	ACKR3	49	36
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	ESR1	62	41
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	HTR1A	39	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	DRD2	39	50
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	DRD4	17	44
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	HRH2	20	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	SLC6A1	63	37
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	HRH1	27	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	DRD3	28	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	ESR2	45	41
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	LTA4H	58	43
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	HRH3	52	47
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	SIGMAR1	29	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	PSMB2	42	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	PSMB1	46	42
COc1ccccc1[C@@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165923	GI	On-Demand	Anodyne	ACKR3	49	36
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	ESR1	62	41
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	HTR1A	39	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	DRD2	39	50
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	DRD4	17	44
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	HRH2	20	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	SLC6A1	63	37
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	HRH1	27	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	DRD3	28	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	ESR2	45	41
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	LTA4H	58	43
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	HRH3	52	47
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	SIGMAR1	29	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	PSMB2	42	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	PSMB1	46	42
COc1ccccc1[C@H]1CCCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872165924	GI	On-Demand	Anodyne	ACKR3	49	36
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	DRD2	27	52
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	DRD4	55	47
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	ACHE	26	46
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	HRH1	26	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	FABP4	29	43
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	SIGMAR1	53	49
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	PRCP	21	43
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	CCR3	69	45
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	CCR5	99	37
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	SLC18A3	35	45
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	MLNR	36	41
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	CCR2	23	44
O=C(O)c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1Cl	ZINC000872165927	EJ	On-Demand	Anodyne	MCHR1	63	45
CN(CCOCC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872165929	CD	On-Demand	Anodyne	FFAR2	25	43
O=C(O)[C@H](c1ccsc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165932	DH	On-Demand	Anodyne	CCR5	92	36
O=C(O)[C@@H](c1ccsc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165933	DH	On-Demand	Anodyne	CCR5	92	36
O=C(O)[C@@H](c1ccc(F)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165934	EH	On-Demand	Anodyne	PRCP	16	43
O=C(O)[C@@H](c1ccc(F)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165934	EH	On-Demand	Anodyne	CCR5	102	43
O=C(O)[C@H](c1ccc(F)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165935	EH	On-Demand	Anodyne	PRCP	16	43
O=C(O)[C@H](c1ccc(F)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000872165935	EH	On-Demand	Anodyne	CCR5	102	43
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HTR1A	19	47
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	DRD2	31	47
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HRH2	32	45
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HTR2C	15	47
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	SLC6A1	82	39
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	SLC6A4	18	42
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HRH1	45	45
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	KCNH2	46	38
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	CHRM3	19	48
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	LTA4H	42	42
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HTR7	19	55
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	HRH3	41	42
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	SIGMAR1	29	42
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	CCR3	71	49
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	MLNR	15	40
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	PLA2G4B	47	43
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	EPHX2	32	40
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	CHRNA10	42	34
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	CACNA1G	31	46
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	LIPG	39	45
O=C(O)c1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872165938	EG	On-Demand	Anodyne	MEN1	42	38
O=C(O)CCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165939	CF	On-Demand	Anodyne	OXTR	44	39
O=C(O)CCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165939	CF	On-Demand	Anodyne	SIGMAR1	37	57
O=C(O)CCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165939	CF	On-Demand	Anodyne	SLC18A3	16	41
O=C(O)CCCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165939	CF	On-Demand	Anodyne	EBP	20	50
O=C(O)CCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165940	CF	On-Demand	Anodyne	OXTR	44	39
O=C(O)CCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165940	CF	On-Demand	Anodyne	SIGMAR1	37	57
O=C(O)CCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165940	CF	On-Demand	Anodyne	SLC18A3	16	41
O=C(O)CCCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165940	CF	On-Demand	Anodyne	EBP	20	50
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HTR1A	109	55
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	DRD2	92	59
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	DRD1	20	43
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	DRD4	51	48
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	ACHE	28	40
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	ADRA1D	77	44
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HTR2A	46	55
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	SLC6A1	71	40
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	SLC6A4	17	43
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	ADRA1A	79	50
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HRH1	37	43
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	ADRA1B	76	50
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	DRD3	70	42
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HTR4	67	43
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HTR7	90	50
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	HRH3	23	41
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	SIGMAR1	63	55
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	BCHE	15	40
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	CCR5	16	41
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	EBP	58	48
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	ABCB1	15	40
COc1ccccc1[C@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165949	DH	On-Demand	Anodyne	CYP2J2	49	35
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HTR1A	109	55
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	DRD2	92	59
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	DRD1	20	43
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	DRD4	51	48
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	ACHE	28	40
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	ADRA1D	77	44
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HTR2A	46	55
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	SLC6A1	71	40
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	SLC6A4	17	43
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	ADRA1A	79	50
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HRH1	37	43
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	ADRA1B	76	50
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	DRD3	70	42
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HTR4	67	43
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HTR7	90	50
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	HRH3	23	41
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	SIGMAR1	63	55
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	BCHE	15	40
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	CCR5	16	41
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	EBP	58	48
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	ABCB1	15	40
COc1ccccc1[C@@H]1CCCN(CCCCCC(=O)O)CC1	ZINC000872165950	DH	On-Demand	Anodyne	CYP2J2	49	35
O=C(O)c1coc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165953	DE	On-Demand	Anodyne	CCR3	37	46
O=C(O)c1coc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165953	DE	On-Demand	Anodyne	CACNA1G	16	43
O=C(O)c1coc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165953	DE	On-Demand	Anodyne	LIPG	16	42
O=C(O)c1ccc(CN2CCO[C@H](c3noc(C4CC4)n3)C2)c(F)c1	ZINC000872165954	EE	On-Demand	Anodyne	ETHR	63	37
O=C(O)c1ccc(CN2CCO[C@@H](c3noc(C4CC4)n3)C2)c(F)c1	ZINC000872165955	EE	On-Demand	Anodyne	ETHR	63	37
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HTR1A	109	53
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	DRD2	95	60
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	DRD1	19	43
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	DRD4	54	49
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	ACHE	27	40
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	ADRA1D	79	44
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HTR2A	48	53
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	SLC6A1	86	40
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	SLC6A4	17	42
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	ADRA1A	80	49
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HRH1	39	44
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	ADRA1B	77	49
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	DRD3	73	43
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HTR4	65	44
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HTR7	85	49
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	HRH3	26	42
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	SIGMAR1	66	53
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	CCR5	19	42
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	EBP	59	46
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	MCHR1	29	40
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	CYP2J2	50	35
COc1ccccc1[C@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165958	DH	On-Demand	Anodyne	ACKR3	47	33
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HTR1A	109	53
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	DRD2	95	60
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	DRD1	19	43
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	DRD4	54	49
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	ACHE	27	40
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	ADRA1D	79	44
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HTR2A	48	53
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	SLC6A1	86	40
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	SLC6A4	17	42
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	ADRA1A	80	49
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HRH1	39	44
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	ADRA1B	77	49
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	DRD3	73	43
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HTR4	65	44
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HTR7	85	49
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	HRH3	26	42
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	SIGMAR1	66	53
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	CCR5	19	42
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	EBP	59	46
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	MCHR1	29	40
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	CYP2J2	50	35
COc1ccccc1[C@@H]1CCCN(CCCCC(=O)O)CC1	ZINC000872165959	DH	On-Demand	Anodyne	ACKR3	47	33
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165967	FI	On-Demand	Anodyne	SIGMAR1	16	45
O=C(O)c1nc(-c2ccccc2)oc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165968	FI	On-Demand	Anodyne	SIGMAR1	16	45
O=C(O)[C@H](c1ccsc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165969	DG	On-Demand	Anodyne	LIPG	17	44
O=C(O)[C@@H](c1ccsc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165970	DG	On-Demand	Anodyne	LIPG	17	44
COc1ccccc1[C@@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165971	EH	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165971	EH	On-Demand	Anodyne	DRD2	25	49
COc1ccccc1[C@@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165971	EH	On-Demand	Anodyne	DRD4	22	49
COc1ccccc1[C@@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165971	EH	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccccc1[C@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165972	EH	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165972	EH	On-Demand	Anodyne	DRD2	25	49
COc1ccccc1[C@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165972	EH	On-Demand	Anodyne	DRD4	22	49
COc1ccccc1[C@H]1CCCN(Cc2nc(C(=O)O)cs2)CC1	ZINC000872165972	EH	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165973	DF	On-Demand	Anodyne	CCR3	37	45
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165973	DF	On-Demand	Anodyne	MLNR	19	42
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(F)cc3)C2)n1	ZINC000872165973	DF	On-Demand	Anodyne	LIPG	21	43
O=C(O)c1cc(F)ccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165980	EH	On-Demand	Anodyne	SIGMAR1	24	50
O=C(O)c1cc(F)ccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872165980	EH	On-Demand	Anodyne	SLC18A3	17	42
O=C(O)c1cc(F)ccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165981	EH	On-Demand	Anodyne	SIGMAR1	24	50
O=C(O)c1cc(F)ccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872165981	EH	On-Demand	Anodyne	SLC18A3	17	42
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165982	DD	On-Demand	Anodyne	SIGMAR1	24	43
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)c(F)c2)CC1	ZINC000872165982	DD	On-Demand	Anodyne	CCR3	43	33
CCn1c(CN2CCC(c3cccc(F)c3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165983	GI	On-Demand	Anodyne	CCR5	100	38
CCn1c(CN2CCC(c3cccc(F)c3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165983	GI	On-Demand	Anodyne	GRM2	17	47
CCn1c(CN2CCC(c3cccc(F)c3)CC2)nc2cc(C(=O)O)ccc21	ZINC000872165983	GI	On-Demand	Anodyne	MCHR1	36	44
O=C(O)c1cccc(Br)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165988	GH	On-Demand	Anodyne	CCR3	49	43
O=C(O)c1cccc(Br)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165988	GH	On-Demand	Anodyne	MLNR	38	44
O=C(O)c1cccc(Br)c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872165988	GH	On-Demand	Anodyne	LIPG	29	45
O=C(O)CC1(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872165989	CG	On-Demand	Anodyne	CCR5	92	35
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	HTR1A	22	43
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	DRD2	22	47
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	ADRA1D	45	39
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	HRH1	22	40
COc1ccccc1[C@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165990	GK	On-Demand	Anodyne	ADRA1B	43	39
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	HTR1A	22	43
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	DRD2	22	47
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	ADRA1D	45	39
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	HRH1	22	40
COc1ccccc1[C@@H]1CCCN(Cc2c(C(=O)O)sc3ccccc23)CC1	ZINC000872165991	GK	On-Demand	Anodyne	ADRA1B	43	39
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	DRD2	15	45
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	PRCP	17	42
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	CCR5	106	40
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	SLC18A3	39	40
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	CCR2	18	43
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	MCHR1	33	43
C[C@@](O)(CN1CCC(c2cccc(F)c2)CC1)C(=O)O	ZINC000872165999	CD	On-Demand	Anodyne	MLYCD	15	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	DRD4	33	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	SLC6A1	22	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	HRH1	46	49
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	HRH3	15	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	SIGMAR1	37	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	CHEK2	19	46
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	CCR3	102	49
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	UTS2R	24	49
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	SLC18A3	20	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	MLNR	79	51
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	CCR2	19	42
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	MCHR1	32	45
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	CACNA1G	35	42
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1Cl	ZINC000872166000	EH	On-Demand	Anodyne	LIPG	41	48
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	HTR1A	48	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	DRD2	47	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ACHE	21	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ADRA1D	17	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	HTR2A	23	51
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ADRA1A	18	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	DRD3	55	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	HTR7	42	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	HRH3	61	44
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	SIGMAR1	34	41
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	HTR5A	45	51
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ABCB1B	47	36
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	PLA2G4B	44	37
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ABCB1	33	47
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1)CC2	ZINC000872166005	EG	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	HTR1A	49	43
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	DRD2	52	43
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	DRD4	38	43
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	HTR2A	27	49
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	HTR2C	17	49
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	DRD3	54	46
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	CHRM5	35	43
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	HTR7	39	41
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	SIGMAR1	50	48
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	HTR5A	41	50
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	ABCB1B	66	42
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	EBP	17	47
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	ABCB1	50	42
COc1ccc(C(=O)O)c2c1CN(CCCCc1ccccc1)CC2	ZINC000872166006	EH	On-Demand	Anodyne	ABCG2	30	41
O=C(O)c1oc2ccccc2c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166007	FH	On-Demand	Anodyne	CCR3	41	41
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	DRD2	20	46
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	DRD4	33	47
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	ACHE	22	42
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	SIGMAR1	35	47
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	PRCP	20	43
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	CCR3	37	43
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	CCR5	101	38
O=C(O)c1ccc(Cl)c(CN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166012	EJ	On-Demand	Anodyne	MCHR1	44	46
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	ESR1	17	43
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	PPARG	21	42
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	LTA4H	44	43
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	HTR5A	25	44
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	ABCB1	24	53
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	PSMB2	40	37
COc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166013	FF	On-Demand	Anodyne	PSMB1	43	38
C/C(=C/CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166014	CH	On-Demand	Anodyne	SLC6A3	22	47
C/C(=C/CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166014	CH	On-Demand	Anodyne	GRIN2B	43	40
C/C(=C/CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166014	CH	On-Demand	Anodyne	ACHP_LYMST	22	41
C/C(=C/CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166014	CH	On-Demand	Anodyne	Q8WSF8_APLCA	37	41
C/C(=C\CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166015	CH	On-Demand	Anodyne	SLC6A3	22	47
C/C(=C\CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166015	CH	On-Demand	Anodyne	GRIN2B	43	40
C/C(=C\CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166015	CH	On-Demand	Anodyne	ACHP_LYMST	22	41
C/C(=C\CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)C(=O)O	ZINC000872166015	CH	On-Demand	Anodyne	Q8WSF8_APLCA	37	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(C)cc1C)CC2	ZINC000872166017	GF	On-Demand	Anodyne	ABCB1	71	46
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	DRD2	37	53
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	DRD4	22	48
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	ADRA1B	28	40
COc1ccccc1[C@@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166018	DE	On-Demand	Anodyne	SIGMAR1	23	45
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(C)cc1C)CC2	ZINC000872166019	GF	On-Demand	Anodyne	ABCB1	71	46
Cc1ccc(CN2CC[C@@](C)(C(F)(F)F)C2)cc1C(=O)O	ZINC000872166029	DG	On-Demand	Anodyne	MCHR2	64	32
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	SLC6A1	41	33
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	HRH1	15	43
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	HTR7	15	40
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	RBP4	16	40
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	HCN1	67	35
C[C@]1(C(F)(F)F)CCN(CCOc2ccccc2C(=O)O)C1	ZINC000872166033	DG	On-Demand	Anodyne	HCN4	49	34
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)CCc1ccccc1)CC2	ZINC000872166035	FF	On-Demand	Anodyne	DRD4	15	40
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)CCc1ccccc1)CC2	ZINC000872166035	FF	On-Demand	Anodyne	ABCB1	94	43
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)CCc1ccccc1)CC2	ZINC000872166036	FF	On-Demand	Anodyne	DRD4	15	40
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)CCc1ccccc1)CC2	ZINC000872166036	FF	On-Demand	Anodyne	ABCB1	94	43
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	HTR1A	48	40
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	DRD2	46	41
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	HTR2A	23	48
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	DRD3	54	41
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	HTR7	42	40
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	HRH3	41	46
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	SIGMAR1	33	41
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	HTR5A	43	48
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	ABCB1B	47	36
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	PLA2G4B	76	39
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	ABCB1	34	50
COc1ccc(C(=O)O)c2c1CN(CCCCOc1ccccc1)CC2	ZINC000872166037	FH	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1ccccc1)CC2	ZINC000872166048	EE	On-Demand	Anodyne	OPRK1	17	40
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1ccccc1)CC2	ZINC000872166048	EE	On-Demand	Anodyne	ADRB3	20	40
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)c1ccccc1)CC2	ZINC000872166049	EE	On-Demand	Anodyne	OPRK1	17	40
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)c1ccccc1)CC2	ZINC000872166049	EE	On-Demand	Anodyne	ADRB3	20	40
CCCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166054	GH	On-Demand	Anodyne	PLA2G4B	70	40
CCCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166054	GH	On-Demand	Anodyne	ABCB1	15	46
CCCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166054	GH	On-Demand	Anodyne	PSMB2	40	38
CCCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166054	GH	On-Demand	Anodyne	PSMB1	42	37
COc1ccc(C(=O)O)c2c1CN(CCCc1nc(C)no1)CC2	ZINC000872166055	EE	On-Demand	Anodyne	ABCB1B	41	33
COc1ccc(C(=O)O)c2c1CN(CCSc1ccccc1F)CC2	ZINC000872166062	FH	On-Demand	Anodyne	ABCB1B	42	35
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	RARA	41	33
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	RARG	48	35
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	RXRG	43	36
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	RARB	52	35
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	RXRB	43	34
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	ACOX1	62	33
C[C@]1(C(F)(F)F)CCN(C[C@@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166063	EE	On-Demand	Anodyne	ABCB1	73	49
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	RARA	41	33
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	RARG	48	35
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	RXRG	43	36
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	RARB	52	35
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	RXRB	43	34
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	ACOX1	62	33
C[C@]1(C(F)(F)F)CCN(C[C@H](O)COc2ccc(C(=O)O)cc2)C1	ZINC000872166066	EE	On-Demand	Anodyne	ABCB1	73	49
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCCC[C@H]1O)CC2	ZINC000872166074	DE	On-Demand	Anodyne	SLC18A3	44	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1c(C)ccc(C)c1C)CC2	ZINC000872166075	GG	On-Demand	Anodyne	ABCB1	64	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1c(C)ccc(C)c1C)CC2	ZINC000872166076	GG	On-Demand	Anodyne	ABCB1	64	41
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	HTR1A	20	42
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	HRH2	15	43
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	HRH3	74	43
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	SIGMAR1	25	42
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	HTR5A	38	51
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	PPARD	26	41
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	PLA2G4B	61	39
COc1ccc(OCCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166080	FG	On-Demand	Anodyne	ABCB1	28	53
O=C(O)c1cnoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166081	DE	On-Demand	Anodyne	HRH1	27	40
O=C(O)c1cnoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166081	DE	On-Demand	Anodyne	CCR3	39	45
O=C(O)c1cnoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166081	DE	On-Demand	Anodyne	MLNR	29	44
O=C(O)c1cnoc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166081	DE	On-Demand	Anodyne	LIPG	30	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(S(C)(=O)=O)c1)CC2	ZINC000872166086	GE	On-Demand	Anodyne	DRD4	19	47
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(S(C)(=O)=O)c1)CC2	ZINC000872166086	GE	On-Demand	Anodyne	AKR1C3	26	42
COc1ccc(C(=O)O)c2c1CN(CCCC(C)C)CC2	ZINC000872166087	CG	On-Demand	Anodyne	DRD3	16	40
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	HTR1A	48	43
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	DRD2	51	42
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	DRD4	36	43
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	HTR2A	27	47
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	HTR2C	17	47
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	DRD3	53	44
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	CHRM5	35	41
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	HTR7	38	41
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	SIGMAR1	50	51
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	HTR5A	40	48
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	ABCB1B	66	42
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	EBP	18	50
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	ABCB1	50	42
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1)CC2	ZINC000872166094	EG	On-Demand	Anodyne	ABCG2	30	41
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	HTR1A	27	44
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	DRD2	33	44
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	DRD3	42	44
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	HTR7	32	54
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	ABCB1B	58	37
COc1ccc(C(=O)O)c2c1CN(CCNS(=O)(=O)c1ccccc1)CC2	ZINC000872166098	GD	On-Demand	Anodyne	AKR1C3	17	41
COc1ccc(C(=O)O)c2c1CN(CCCn1ccnc1)CC2	ZINC000872166101	DE	On-Demand	Anodyne	TBXAS1	67	44
COc1ccc(C(=O)O)c2c1CN(CCCn1ccnc1)CC2	ZINC000872166101	DE	On-Demand	Anodyne	QPCT	37	45
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COCc1ccccc1)CC2	ZINC000872166102	FE	On-Demand	Anodyne	ABCB1	74	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COCc1ccccc1)CC2	ZINC000872166103	FE	On-Demand	Anodyne	ABCB1	74	42
COc1ccc(C(=O)O)c2c1CN(CCCCO)CC2	ZINC000872166108	CD	On-Demand	Anodyne	HTR1A	22	40
COc1ccc(C(=O)O)c2c1CN(CCCCO)CC2	ZINC000872166108	CD	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	DRD2	37	53
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	DRD4	22	48
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	ADRA1B	28	40
COc1ccccc1[C@@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166113	DE	On-Demand	Anodyne	SIGMAR1	23	45
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	DRD2	37	53
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	DRD4	22	48
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	ADRA1B	28	40
COc1ccccc1[C@H]1CCCN(C[C@](C)(O)C(=O)O)CC1	ZINC000872166114	DE	On-Demand	Anodyne	SIGMAR1	23	45
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	DRD2	37	53
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	DRD4	22	48
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	ADRA1B	28	40
COc1ccccc1[C@H]1CCCN(C[C@@](C)(O)C(=O)O)CC1	ZINC000872166115	DE	On-Demand	Anodyne	SIGMAR1	23	45
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	HRH1	23	48
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	HRH3	23	43
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	CCR3	39	52
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	CCR5	67	39
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	EPHX2	16	41
CC[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166117	CE	On-Demand	Anodyne	LIPG	38	47
O=C(O)c1ccc(-c2nc(CN3CC[C@]4(CCc5ccccc54)C3)cs2)cc1	ZINC000872166118	GJ	On-Demand	Anodyne	RARB	15	40
O=C(O)c1ccc(-c2nc(CN3CC[C@]4(CCc5ccccc54)C3)cs2)cc1	ZINC000872166118	GJ	On-Demand	Anodyne	SIGMAR1	23	47
O=C(O)c1ccc(-c2nc(CN3CC[C@@]4(CCc5ccccc54)C3)cs2)cc1	ZINC000872166119	GJ	On-Demand	Anodyne	RARB	15	40
O=C(O)c1ccc(-c2nc(CN3CC[C@@]4(CCc5ccccc54)C3)cs2)cc1	ZINC000872166119	GJ	On-Demand	Anodyne	SIGMAR1	23	47
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)cc2F)CC1	ZINC000872166120	DD	On-Demand	Anodyne	MCHR1	15	40
O=C(O)c1ccoc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166121	CG	On-Demand	Anodyne	SIGMAR1	23	50
O=C(O)c1ccoc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166122	CG	On-Demand	Anodyne	SIGMAR1	23	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	HTR1A	29	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	DRD2	34	51
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	ACHE	34	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	ADRA1D	34	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	HRH1	27	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	ADRA1B	31	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166125	EI	On-Demand	Anodyne	SIGMAR1	32	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	HTR1A	29	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	DRD2	34	51
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	DRD4	31	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	ACHE	34	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	ADRA1D	34	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	HRH1	27	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	ADRA1B	31	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)cs2)CC1	ZINC000872166126	EI	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	ESR1	49	39
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HTR1A	25	50
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	DRD2	38	50
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	DRD4	41	31
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HRH2	38	53
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HTR1D	19	43
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HTR1B	17	43
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	SLC6A1	40	39
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	SLC6A4	15	41
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HRH1	37	53
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	DRD3	15	45
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	KCNH2	23	42
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	LTA4H	39	42
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HTR7	22	56
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	HRH3	37	44
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	SIGMAR1	30	49
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	PRCP	20	41
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	CCR3	40	40
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	CCR5	105	40
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	PLA2G4B	22	40
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	CHRNA10	50	40
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	MCHR1	42	43
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	CACNA1G	22	46
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	PSMB1	41	39
O=C(O)c1cccc(OCCN2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166127	EH	On-Demand	Anodyne	MEN1	46	41
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166129	GG	On-Demand	Anodyne	ETHR	45	32
O=C(O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166130	GG	On-Demand	Anodyne	ETHR	45	32
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166131	GG	On-Demand	Anodyne	ETHR	45	32
O=C(O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166132	GG	On-Demand	Anodyne	ETHR	45	32
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	DRD2	15	43
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	DRD4	23	43
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	SLC6A1	76	34
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	HRH1	36	55
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	CHRM3	17	45
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	SIGMAR1	38	43
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	CCR3	74	55
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	SLC18A3	25	41
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	MLNR	39	47
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	EPHX2	15	40
O=C(O)c1ccccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166133	DG	On-Demand	Anodyne	LIPG	45	48
O=C(O)c1sc2ccccc2c1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166134	FI	On-Demand	Anodyne	CCR3	45	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	HTR1A	27	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	DRD2	46	38
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	DRD4	31	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	HRH2	19	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	HTR2A	15	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	SLC6A1	72	39
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	ADRA1A	21	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	HRH1	32	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	ADRA1B	21	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	DRD3	20	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	SIGMAR1	35	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	SSTR5	34	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	CCR3	50	45
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	CACNA1G	28	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	CCR8	25	41
COc1ccccc1[C@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166135	FI	On-Demand	Anodyne	ACKR3	66	33
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	HTR1A	27	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	DRD2	46	38
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	DRD4	31	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	HRH2	19	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	HTR2A	15	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	SLC6A1	72	39
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	ADRA1A	21	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	HRH1	32	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	ADRA1B	21	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	DRD3	20	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	SIGMAR1	35	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	SSTR5	34	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	CCR3	50	45
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	CACNA1G	28	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	CCR8	25	41
COc1ccccc1[C@@H]1CCCN(Cc2ccc(F)cc2C(=O)O)CC1	ZINC000872166136	FI	On-Demand	Anodyne	ACKR3	66	33
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872166141	DG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872166141	DG	On-Demand	Anodyne	PRCP	17	43
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872166141	DG	On-Demand	Anodyne	CCR5	98	40
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872166141	DG	On-Demand	Anodyne	MCHR1	36	41
O=C(O)c1csc(CN2CCC(c3cccc(F)c3)CC2)n1	ZINC000872166141	DG	On-Demand	Anodyne	MGEA5	26	40
O=C(O)[C@H](c1ccsc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166142	EE	On-Demand	Anodyne	ETHR	49	36
O=C(O)[C@@H](c1ccsc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166143	EE	On-Demand	Anodyne	ETHR	49	36
O=C(O)[C@H](c1ccsc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166144	EE	On-Demand	Anodyne	ETHR	49	36
O=C(O)[C@@H](c1ccsc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166145	EE	On-Demand	Anodyne	ETHR	49	36
O=C(O)[C@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166146	CE	On-Demand	Anodyne	HRH3	15	40
O=C(O)[C@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166146	CE	On-Demand	Anodyne	CCR3	16	46
O=C(O)[C@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166146	CE	On-Demand	Anodyne	LIPG	18	47
O=C(O)[C@@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166147	CE	On-Demand	Anodyne	HRH3	15	40
O=C(O)[C@@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166147	CE	On-Demand	Anodyne	CCR3	16	46
O=C(O)[C@@H](C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166147	CE	On-Demand	Anodyne	LIPG	18	47
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	HTR1A	24	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	DRD4	37	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	ACHE	31	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	SLC6A1	62	37
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	HRH1	26	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	SIGMAR1	38	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	SSTR5	51	39
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	MCHR1	25	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	CCR8	24	43
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166150	EI	On-Demand	Anodyne	MBTPS1	54	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	HTR1A	24	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	DRD4	37	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	ACHE	31	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	SLC6A1	62	37
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	HRH1	26	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	SIGMAR1	38	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	SSTR5	51	39
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	MCHR1	25	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	CCR8	24	43
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)oc2C)CC1	ZINC000872166151	EI	On-Demand	Anodyne	MBTPS1	54	42
CCn1c(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872166152	GH	On-Demand	Anodyne	CNR2	16	41
CCn1c(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872166152	GH	On-Demand	Anodyne	TRY1_BOVIN	21	40
CCn1c(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872166152	GH	On-Demand	Anodyne	CHEK2	32	47
CCn1c(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872166152	GH	On-Demand	Anodyne	CCR3	40	42
CCn1c(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc2cc(C(=O)O)ccc21	ZINC000872166152	GH	On-Demand	Anodyne	LIPG	26	42
Cn1nnnc1C1CCN([C@@H](C(=O)O)c2ccccc2C(F)(F)F)CC1	ZINC000872166153	FE	On-Demand	Anodyne	RBP4	65	38
Cn1nnnc1C1CCN([C@H](C(=O)O)c2ccccc2C(F)(F)F)CC1	ZINC000872166154	FE	On-Demand	Anodyne	RBP4	65	38
O=C(O)c1ccccc1OCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166156	EG	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1ccccc1OCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166156	EG	On-Demand	Anodyne	SIGMAR1	22	47
O=C(O)c1ccccc1OCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166156	EG	On-Demand	Anodyne	EBP	17	40
O=C(O)c1ccccc1OCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166156	EG	On-Demand	Anodyne	HCN1	41	34
O=C(O)c1ccccc1OCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166157	EG	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1ccccc1OCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166157	EG	On-Demand	Anodyne	SIGMAR1	22	47
O=C(O)c1ccccc1OCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166157	EG	On-Demand	Anodyne	EBP	17	40
O=C(O)c1ccccc1OCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166157	EG	On-Demand	Anodyne	HCN1	41	34
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166158	EI	On-Demand	Anodyne	SIGMAR1	49	57
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166158	EI	On-Demand	Anodyne	SLC18A3	17	42
O=C(O)c1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166158	EI	On-Demand	Anodyne	MCHR2	78	38
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166159	EI	On-Demand	Anodyne	SIGMAR1	49	57
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166159	EI	On-Demand	Anodyne	SLC18A3	17	42
O=C(O)c1ccc(CN2CC[C@]3(CCc4ccccc43)C2)cc1Cl	ZINC000872166159	EI	On-Demand	Anodyne	MCHR2	78	38
O=C(O)c1cccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)c1	ZINC000872166162	GK	On-Demand	Anodyne	DRD4	15	45
O=C(O)c1cccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)c1	ZINC000872166162	GK	On-Demand	Anodyne	CCR5	93	37
O=C(O)c1cccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)c1	ZINC000872166162	GK	On-Demand	Anodyne	MCHR1	35	42
O=C(O)c1cccc(-c2nc(CN3CCC(c4cccc(F)c4)CC3)cs2)c1	ZINC000872166162	GK	On-Demand	Anodyne	MLYCD	22	41
O=C(O)C1CCC(O)(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872166165	EF	On-Demand	Anodyne	OXTR	51	37
O=C(O)C1CCC(O)(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872166165	EF	On-Demand	Anodyne	SIGMAR1	24	47
O=C(O)C1CCC(O)(CN2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872166165	EF	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)C1CCC(O)(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872166166	EF	On-Demand	Anodyne	OXTR	51	37
O=C(O)C1CCC(O)(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872166166	EF	On-Demand	Anodyne	SIGMAR1	24	47
O=C(O)C1CCC(O)(CN2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872166166	EF	On-Demand	Anodyne	SLC18A3	16	40
COc1ccccc1[C@@H]1CCCN([C@@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872166167	FI	On-Demand	Anodyne	SLC6A3	22	40
COc1ccccc1[C@H]1CCCN([C@@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872166168	FI	On-Demand	Anodyne	SLC6A3	22	40
COc1ccccc1[C@@H]1CCCN([C@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872166169	FI	On-Demand	Anodyne	SLC6A3	22	40
COc1ccccc1[C@H]1CCCN([C@H](C(=O)O)c2ccc(F)cc2)CC1	ZINC000872166170	FI	On-Demand	Anodyne	SLC6A3	22	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	DRD2	28	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	DRD4	25	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	ADRA1A	17	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	HRH1	23	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	ADRA1B	18	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166171	FJ	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	DRD2	28	50
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	DRD4	25	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	ADRA1A	17	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	HRH1	23	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	ADRA1B	18	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)sc2C)CC1	ZINC000872166172	FJ	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	DRD2	17	45
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	HTR2A	34	45
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	HTR2C	19	45
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	SLC6A1	108	37
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	HRH1	38	46
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	CHRM3	15	48
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	CCR3	67	48
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	EPHX2	18	41
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	CACNA1G	34	41
O=C(O)c1ccccc1CCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166175	EG	On-Demand	Anodyne	LIPG	44	47
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	HTR1A	53	45
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	DRD2	49	56
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	DRD4	30	48
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	ADRA1D	58	37
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	SLC6A1	46	38
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	HRH1	27	41
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	HTR7	34	42
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	SIGMAR1	26	45
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	EBP	32	41
COc1ccccc1[C@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166180	EI	On-Demand	Anodyne	MBTPS1	51	39
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	HTR1A	53	45
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	DRD2	49	56
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	DRD4	30	48
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	ADRA1D	58	37
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	SLC6A1	46	38
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	HRH1	27	41
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	HTR7	34	42
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	SIGMAR1	26	45
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	EBP	32	41
COc1ccccc1[C@@H]1CCCN(CCC(C)(C)CC(=O)O)CC1	ZINC000872166181	EI	On-Demand	Anodyne	MBTPS1	51	39
COC1([C@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)CCC1	ZINC000872166187	DG	On-Demand	Anodyne	CCR5	103	37
COC1([C@@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)CCC1	ZINC000872166188	DG	On-Demand	Anodyne	CCR5	103	37
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	HTR1A	25	43
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	DRD2	29	50
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	DRD4	24	46
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	HRH2	15	41
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	SLC6A1	51	37
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	HRH1	21	42
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	SIGMAR1	29	43
COc1ccccc1[C@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166193	EI	On-Demand	Anodyne	MBTPS1	42	39
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	HTR1A	25	43
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	DRD2	29	50
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	DRD4	24	46
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	HRH2	15	41
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	SLC6A1	51	37
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	HRH1	21	42
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	SIGMAR1	29	43
COc1ccccc1[C@@H]1CCCN(Cc2ccsc2C(=O)O)CC1	ZINC000872166194	EI	On-Demand	Anodyne	MBTPS1	42	39
O=C(O)C1CCC(O)(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872166195	EG	On-Demand	Anodyne	CCR5	98	36
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	DRD2	37	51
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	DRD4	42	47
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	ACHE	40	43
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	ADRA1A	16	40
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	HRH1	24	44
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	ADRA1B	16	40
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	SIGMAR1	44	45
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	SSTR5	51	36
COc1ccccc1[C@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166199	EI	On-Demand	Anodyne	CCR8	20	41
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	DRD2	37	51
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	DRD4	42	47
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	ACHE	40	43
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	ADRA1A	16	40
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	HRH1	24	44
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	ADRA1B	16	40
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	SIGMAR1	44	45
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	SSTR5	51	36
COc1ccccc1[C@@H]1CCCN(Cc2csc(C(=O)O)c2)CC1	ZINC000872166200	EI	On-Demand	Anodyne	CCR8	20	41
O=C(O)c1ccc(Br)cc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166201	GJ	On-Demand	Anodyne	SIGMAR1	26	44
O=C(O)c1ccc(Br)cc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166201	GJ	On-Demand	Anodyne	CCR5	87	35
O=C(O)c1ccc(Br)cc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166201	GJ	On-Demand	Anodyne	SLC18A3	27	41
O=C(O)C1CCC(O)(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872166206	EE	On-Demand	Anodyne	SLC6A1	71	35
O=C(O)C1CCC(O)(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872166206	EE	On-Demand	Anodyne	CCR3	21	44
O=C(O)C1CCC(O)(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872166206	EE	On-Demand	Anodyne	LIPG	22	44
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	HTR1A	62	51
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	ADRA1D	51	37
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	HTR2A	28	51
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	SLC6A1	97	43
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	ADRA1A	46	41
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	HRH1	31	45
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	ADRA1B	46	41
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	DRD3	42	36
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	HTR7	41	38
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	FABP4	30	45
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	SIGMAR1	43	51
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	CCR3	21	43
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	CCR5	18	41
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	EBP	44	38
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	CACNA1G	17	42
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	BIRC2	29	42
COc1ccccc1[C@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166207	FI	On-Demand	Anodyne	MBTPS1	57	39
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	HTR1A	62	51
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	DRD4	38	47
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	ADRA1D	51	37
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	HTR2A	28	51
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	SLC6A1	97	43
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	ADRA1A	46	41
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	HRH1	31	45
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	ADRA1B	46	41
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	DRD3	42	36
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	HTR7	41	38
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	FABP4	30	45
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	SIGMAR1	43	51
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	CCR3	21	43
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	CCR5	18	41
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	EBP	44	38
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	CACNA1G	17	42
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	BIRC2	29	42
COc1ccccc1[C@@H]1CCCN(CCc2ccccc2C(=O)O)CC1	ZINC000872166208	FI	On-Demand	Anodyne	MBTPS1	57	39
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	DRD2	39	51
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	DRD4	34	47
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	SLC6A1	55	39
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	ADRA1A	29	40
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	HRH1	28	41
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	ADRA1B	21	40
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	EBP	21	42
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	HCN1	51	31
COc1ccccc1[C@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166209	EH	On-Demand	Anodyne	HCN4	49	31
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	HTR1A	34	42
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	DRD2	39	51
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	DRD4	34	47
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	SLC6A1	55	39
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	ADRA1A	29	40
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	HRH1	28	41
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	ADRA1B	21	40
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	EBP	21	42
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	HCN1	51	31
COc1ccccc1[C@@H]1CCCN(Cc2ncccc2C(=O)O)CC1	ZINC000872166210	EH	On-Demand	Anodyne	HCN4	49	31
CN(Cc1ccc2cc[nH]c2c1)Cc1noc(CCCC(=O)O)n1	ZINC000872166211	EF	On-Demand	Anodyne	FFAR2	31	42
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(F)cc1)CC2	ZINC000872166232	GE	On-Demand	Anodyne	ACOX1	44	37
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(F)cc1)CC2	ZINC000872166232	GE	On-Demand	Anodyne	ABCB1	75	48
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000872166233	GE	On-Demand	Anodyne	ACOX1	44	37
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000872166233	GE	On-Demand	Anodyne	ABCB1	75	48
C[C@]1(C(F)(F)F)CCN(CCOc2ccc(/C=C\C(=O)O)cc2)C1	ZINC000872166240	EG	On-Demand	Anodyne	PSMB1	40	35
C[C@]1(C(F)(F)F)CCN(CCOc2ccc(/C=C/C(=O)O)cc2)C1	ZINC000872166241	EG	On-Demand	Anodyne	PSMB1	40	35
COc1ccc(C(=O)O)c2c1CN(Cc1cccnc1)CC2	ZINC000872166248	CE	On-Demand	Anodyne	DRD4	19	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccnc1)CC2	ZINC000872166248	CE	On-Demand	Anodyne	PTAFR	23	42
COc1ccc(C(=O)O)c2c1CN(CCCSC)CC2	ZINC000872166250	CF	On-Demand	Anodyne	DRD3	18	40
C[C@]1(C(F)(F)F)CCN(Cc2cc(C(=O)O)ccc2Cl)C1	ZINC000872166252	DH	On-Demand	Anodyne	RARA	40	33
C[C@]1(C(F)(F)F)CCN(Cc2cc(C(=O)O)ccc2Cl)C1	ZINC000872166252	DH	On-Demand	Anodyne	RARG	55	35
C[C@]1(C(F)(F)F)CCN(Cc2cc(C(=O)O)ccc2Cl)C1	ZINC000872166252	DH	On-Demand	Anodyne	RARB	49	35
COc1ccc(C(=O)O)c2c1CN(CCCCCn1cccn1)CC2	ZINC000872166263	EF	On-Demand	Anodyne	HTR1A	18	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(SC)cc1)CC2	ZINC000872166266	FH	On-Demand	Anodyne	PSMB1	40	34
COc1ccc(C(=O)O)c2c1CN(CCOC1CCCCCC1)CC2	ZINC000872166267	EG	On-Demand	Anodyne	SLC6A1	60	34
COc1ccc(C(=O)O)c2c1CN(CCOC1CCCCCC1)CC2	ZINC000872166267	EG	On-Demand	Anodyne	CHRM5	18	40
COc1ccc(C(=O)O)c2c1CN(CCF)CC2	ZINC000872166268	CD	On-Demand	Anodyne	ABCB1B	51	35
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1Cl)CC2	ZINC000872166274	FG	On-Demand	Anodyne	HTR1A	30	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1Cl)CC2	ZINC000872166274	FG	On-Demand	Anodyne	HTR2C	15	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1Cl)CC2	ZINC000872166274	FG	On-Demand	Anodyne	SLC6A1	53	42
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1Cl)CC2	ZINC000872166274	FG	On-Demand	Anodyne	HTR4	41	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1Cl)CC2	ZINC000872166274	FG	On-Demand	Anodyne	ABCB1B	42	35
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3c(c1)CCO3)CC2	ZINC000872166275	FF	On-Demand	Anodyne	ABCB1B	40	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3c(c1)CCO3)CC2	ZINC000872166275	FF	On-Demand	Anodyne	ABCB1	21	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3c(c1)CCO3)CC2	ZINC000872166275	FF	On-Demand	Anodyne	ABCG2	29	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3c(c1)CCO3)CC2	ZINC000872166275	FF	On-Demand	Anodyne	KCNJ1	58	42
COCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166276	CE	On-Demand	Anodyne	HTR1A	19	40
COCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166276	CE	On-Demand	Anodyne	DRD2	23	44
COCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166276	CE	On-Demand	Anodyne	ABCB1	22	41
COc1ccc(C(=O)O)c2c1CN(CCCSCc1ccccc1)CC2	ZINC000872166282	FI	On-Demand	Anodyne	HTR1A	40	39
COc1ccc(C(=O)O)c2c1CN(CCCSCc1ccccc1)CC2	ZINC000872166282	FI	On-Demand	Anodyne	DRD3	47	39
COc1ccc(C(=O)O)c2c1CN(CCn1ccnc1C)CC2	ZINC000872166285	DD	On-Demand	Anodyne	ABCB1B	56	33
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1F)CC2	ZINC000872166287	GE	On-Demand	Anodyne	ADRB2	16	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1F)CC2	ZINC000872166287	GE	On-Demand	Anodyne	ABCB1	87	48
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1F)CC2	ZINC000872166288	GE	On-Demand	Anodyne	ADRB2	16	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1F)CC2	ZINC000872166288	GE	On-Demand	Anodyne	ABCB1	87	48
C[C@H]1CN([C@H](C)C(=O)NCc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166293	FG	On-Demand	Anodyne	FURIN	49	34
C[C@H]1CN([C@H](C)C(=O)NCc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166293	FG	On-Demand	Anodyne	PROC	63	38
C[C@H]1CN([C@H](C)C(=O)NCc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166293	FG	On-Demand	Anodyne	TMPRSS11D	40	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000872166296	GH	On-Demand	Anodyne	CPT1A	47	37
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000872166297	GH	On-Demand	Anodyne	CPT1A	47	37
COc1ccc(C(=O)O)c2c1CN(CCc1cn[nH]c1)CC2	ZINC000872166302	DD	On-Demand	Anodyne	ABCB1B	35	40
COc1ccc(C(=O)O)c2c1CN(CCc1cn[nH]c1)CC2	ZINC000872166302	DD	On-Demand	Anodyne	ABCB1	15	40
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCCN1C)CC2	ZINC000872166312	DD	On-Demand	Anodyne	CHRNA10	57	36
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCCN1C)CC2	ZINC000872166312	DD	On-Demand	Anodyne	ACKR3	75	41
O=C(O)c1cccc(Cl)c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166314	EI	On-Demand	Anodyne	OPRL1	18	41
O=C(O)c1cccc(Cl)c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166314	EI	On-Demand	Anodyne	SIGMAR1	30	52
O=C(O)c1cccc(Cl)c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166314	EI	On-Demand	Anodyne	SLC18A3	17	41
O=C(O)c1cccc(Cl)c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166315	EI	On-Demand	Anodyne	OPRL1	18	41
O=C(O)c1cccc(Cl)c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166315	EI	On-Demand	Anodyne	SIGMAR1	30	52
O=C(O)c1cccc(Cl)c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166315	EI	On-Demand	Anodyne	SLC18A3	17	41
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	DRD2	21	50
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	DRD4	36	50
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	ACHE	15	44
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	HTR2A	17	42
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	HRH1	25	45
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	FABP4	44	46
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	SIGMAR1	43	50
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	PRCP	18	40
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	CCR3	48	44
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	CCR5	101	39
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	SLC18A3	55	41
O=C(O)c1ccccc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166316	DH	On-Demand	Anodyne	MCHR1	40	48
O=C(O)[C@H](C1CC1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166322	CF	On-Demand	Anodyne	CCR5	115	45
O=C(O)[C@H](C1CC1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166322	CF	On-Demand	Anodyne	CCR2	15	43
O=C(O)[C@@H](C1CC1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166323	CF	On-Demand	Anodyne	CCR5	115	45
O=C(O)[C@@H](C1CC1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166323	CF	On-Demand	Anodyne	CCR2	15	43
CN(Cc1ccc2cc[nH]c2c1)C[C@H](O)COc1ccc(C(=O)O)cc1	ZINC000872166326	FF	On-Demand	Anodyne	PLA2G4B	58	36
CN(Cc1ccc2cc[nH]c2c1)C[C@@H](O)COc1ccc(C(=O)O)cc1	ZINC000872166327	FF	On-Demand	Anodyne	PLA2G4B	58	36
O=C(O)CCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166328	CE	On-Demand	Anodyne	OXTR	45	39
O=C(O)CCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166328	CE	On-Demand	Anodyne	ERG2	16	50
O=C(O)CCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166328	CE	On-Demand	Anodyne	SIGMAR1	38	60
O=C(O)CCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166328	CE	On-Demand	Anodyne	SLC18A3	16	41
O=C(O)CCCN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166328	CE	On-Demand	Anodyne	EBP	20	50
O=C(O)CCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166329	CE	On-Demand	Anodyne	OXTR	45	39
O=C(O)CCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166329	CE	On-Demand	Anodyne	ERG2	16	50
O=C(O)CCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166329	CE	On-Demand	Anodyne	SIGMAR1	38	60
O=C(O)CCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166329	CE	On-Demand	Anodyne	SLC18A3	16	41
O=C(O)CCCN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166329	CE	On-Demand	Anodyne	EBP	20	50
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	CHEK2	19	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	CCR3	46	46
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	SLC18A3	18	41
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	MLNR	52	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	SCN5A	22	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)nc1	ZINC000872166336	DF	On-Demand	Anodyne	LIPG	28	44
COc1ccccc1[C@H]1CCCN([C@@H](C(=O)O)c2ccsc2)CC1	ZINC000872166337	EI	On-Demand	Anodyne	HTR1A	16	40
COc1ccccc1[C@@H]1CCCN([C@H](C(=O)O)c2ccsc2)CC1	ZINC000872166338	EI	On-Demand	Anodyne	HTR1A	16	40
COc1ccccc1[C@H]1CCCN([C@H](C(=O)O)c2ccsc2)CC1	ZINC000872166339	EI	On-Demand	Anodyne	HTR1A	16	40
COc1ccccc1[C@@H]1CCCN([C@@H](C(=O)O)c2ccsc2)CC1	ZINC000872166340	EI	On-Demand	Anodyne	HTR1A	16	40
O=C(O)c1csc(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c1	ZINC000872166341	EI	On-Demand	Anodyne	KCNH2	36	40
O=C(O)c1csc(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c1	ZINC000872166341	EI	On-Demand	Anodyne	GRIN2B	43	38
O=C(O)c1csc(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c1	ZINC000872166341	EI	On-Demand	Anodyne	LTA4H	15	43
Cc1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872166342	DH	On-Demand	Anodyne	SIGMAR1	37	56
Cc1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872166342	DH	On-Demand	Anodyne	SLC18A3	17	41
Cc1ccc(CN2CC[C@@]3(CCc4ccccc43)C2)cc1C(=O)O	ZINC000872166342	DH	On-Demand	Anodyne	MCHR2	81	38
COc1ccccc1[C@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166350	EF	On-Demand	Anodyne	HTR1A	20	42
COc1ccccc1[C@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166350	EF	On-Demand	Anodyne	DRD2	25	48
COc1ccccc1[C@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166350	EF	On-Demand	Anodyne	DRD4	26	47
COc1ccccc1[C@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166350	EF	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1[C@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166350	EF	On-Demand	Anodyne	SSTR5	56	36
COc1ccccc1[C@@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166351	EF	On-Demand	Anodyne	HTR1A	20	42
COc1ccccc1[C@@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166351	EF	On-Demand	Anodyne	DRD2	25	48
COc1ccccc1[C@@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166351	EF	On-Demand	Anodyne	DRD4	26	47
COc1ccccc1[C@@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166351	EF	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccccc1[C@@H]1CCCN(Cc2cnc(C(=O)O)cn2)CC1	ZINC000872166351	EF	On-Demand	Anodyne	SSTR5	56	36
COc1cccc([C@@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166352	EH	On-Demand	Anodyne	CCR5	104	43
COc1cccc([C@@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166352	EH	On-Demand	Anodyne	LIPE	18	40
COc1cccc([C@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166353	EH	On-Demand	Anodyne	CCR5	104	43
COc1cccc([C@H](C(=O)O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000872166353	EH	On-Demand	Anodyne	LIPE	18	40
CC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166362	CE	On-Demand	Anodyne	OXTR	53	36
CC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166362	CE	On-Demand	Anodyne	OPRL1	24	44
CC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166362	CE	On-Demand	Anodyne	GHRHR	17	40
CC[C@@H](C(=O)O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166362	CE	On-Demand	Anodyne	SLC18A3	17	42
CC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166363	CE	On-Demand	Anodyne	OXTR	53	36
CC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166363	CE	On-Demand	Anodyne	OPRL1	24	44
CC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166363	CE	On-Demand	Anodyne	GHRHR	17	40
CC[C@@H](C(=O)O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166363	CE	On-Demand	Anodyne	SLC18A3	17	42
Cn1nnnc1C1CCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872166369	FD	On-Demand	Anodyne	LTA4H	46	42
Cn1nnnc1C1CCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872166369	FD	On-Demand	Anodyne	HRH3	26	43
Cn1nnnc1C1CCN(CCOc2ccc(/C=C\C(=O)O)cc2)CC1	ZINC000872166369	FD	On-Demand	Anodyne	PSMB1	41	35
Cn1nnnc1C1CCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872166370	FD	On-Demand	Anodyne	LTA4H	46	42
Cn1nnnc1C1CCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872166370	FD	On-Demand	Anodyne	HRH3	26	43
Cn1nnnc1C1CCN(CCOc2ccc(/C=C/C(=O)O)cc2)CC1	ZINC000872166370	FD	On-Demand	Anodyne	PSMB1	41	35
C[C@H](c1ccc(C(=O)O)o1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166375	DI	On-Demand	Anodyne	CCR5	105	40
C[C@@H](c1ccc(C(=O)O)o1)N1CCC(c2cccc(F)c2)CC1	ZINC000872166376	DI	On-Demand	Anodyne	CCR5	105	40
C[C@H](C(=O)O)N(C)Cc1ccc2cc[nH]c2c1	ZINC000872166379	BE	On-Demand	Anodyne	FFAR2	24	41
C[C@@H](C(=O)O)N(C)Cc1ccc2cc[nH]c2c1	ZINC000872166380	BE	On-Demand	Anodyne	FFAR2	24	41
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	HTR1A	15	46
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	DRD2	28	43
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	DRD4	17	40
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	HTR2A	34	41
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	HTR2C	16	46
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	SLC6A1	41	35
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	HRH1	36	43
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	DRD3	15	42
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	HRH3	26	40
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	CCR3	56	58
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)CCCCN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166381	CF	On-Demand	Anodyne	LIPG	22	46
O=C(O)c1ccc(Cl)c(CN2CCO[C@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166382	FF	On-Demand	Anodyne	ETHR	59	35
O=C(O)c1ccc(Cl)c(CN2CCO[C@@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166383	FF	On-Demand	Anodyne	ETHR	59	35
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HTR1A	107	53
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	DRD2	97	60
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	DRD1	20	43
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	DRD4	55	49
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	ACHE	26	41
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	ADRA1D	79	44
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HTR2A	50	53
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	SLC6A1	127	42
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	SLC6A4	17	42
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	ADRA1A	81	49
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HRH1	40	44
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	ADRA1B	78	49
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	DRD3	74	43
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HTR4	63	44
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HTR7	78	49
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	HRH3	26	42
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	SIGMAR1	67	53
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	CCR5	19	42
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	EBP	59	46
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	MCHR1	29	42
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	CYP2J2	53	38
COc1ccccc1[C@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166384	CG	On-Demand	Anodyne	ACKR3	47	33
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HTR1A	107	53
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	DRD2	97	60
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	DRD1	20	43
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	DRD4	55	49
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	ACHE	26	41
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	ADRA1D	79	44
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HTR2A	50	53
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	SLC6A1	127	42
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	SLC6A4	17	42
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	ADRA1A	81	49
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HRH1	40	44
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	ADRA1B	78	49
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	DRD3	74	43
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HTR4	63	44
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HTR7	78	49
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	HRH3	26	42
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	SIGMAR1	67	53
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	CCR5	19	42
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	EBP	59	46
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	MCHR1	29	42
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	CYP2J2	53	38
COc1ccccc1[C@@H]1CCCN(CCCC(=O)O)CC1	ZINC000872166385	CG	On-Demand	Anodyne	ACKR3	47	33
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	HTR1A	19	41
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	DRD2	18	43
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	HRH2	15	49
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	SLC6A1	52	32
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	HRH1	30	54
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	LTA4H	26	40
Cn1nnnc1C1CCN(CCOc2ccccc2C(=O)O)CC1	ZINC000872166386	ED	On-Demand	Anodyne	HTR7	19	46
O=C(O)/C=C\c1ccc(OCCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872166391	DD	On-Demand	Anodyne	LTA4H	40	38
O=C(O)/C=C\c1ccc(OCCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872166391	DD	On-Demand	Anodyne	PSMB1	40	36
O=C(O)/C=C/c1ccc(OCCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872166392	DD	On-Demand	Anodyne	LTA4H	40	38
O=C(O)/C=C/c1ccc(OCCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872166392	DD	On-Demand	Anodyne	PSMB1	40	36
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	HTR1A	36	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	DRD2	42	48
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	DRD4	36	47
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	ACHE	32	43
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	ADRA1A	29	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	ADRA1B	27	40
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	SIGMAR1	28	42
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	SSTR5	59	38
COc1ccccc1[C@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166393	EH	On-Demand	Anodyne	MCHR1	24	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	HTR1A	36	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	DRD2	42	48
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	DRD4	36	47
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	ACHE	32	43
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	ADRA1A	29	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	ADRA1B	27	40
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	SIGMAR1	28	42
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	SSTR5	59	38
COc1ccccc1[C@@H]1CCCN(Cc2ccc(C(=O)O)cn2)CC1	ZINC000872166394	EH	On-Demand	Anodyne	MCHR1	24	40
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	DRD2	18	44
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	DRD4	22	47
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	SIGMAR1	24	42
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	PRCP	20	41
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	CCR5	100	38
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	MCHR1	32	42
O=C(O)c1cccnc1CN1CCC(c2cccc(F)c2)CC1	ZINC000872166399	DG	On-Demand	Anodyne	MGEA5	26	40
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	KCNH2	35	40
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	GRIN2B	57	43
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	SIGMAR1	28	43
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	CCR3	32	43
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	LNPEP	44	32
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	ACHP_LYMST	21	40
O=C(O)Cc1ccccc1CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000872166401	EI	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
O=C(O)/C=C\c1ccc(OCCN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872166404	FH	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)/C=C/c1ccc(OCCN2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000872166405	FH	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)/C=C\c1ccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872166406	FH	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)/C=C/c1ccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000872166407	FH	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)c1cccc(Cl)c1CN1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166411	FF	On-Demand	Anodyne	ETHR	52	33
O=C(O)c1cccc(Cl)c1CN1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166412	FF	On-Demand	Anodyne	ETHR	52	33
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCCN1C)CC2	ZINC000872166413	DD	On-Demand	Anodyne	CHRNA10	57	36
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCCN1C)CC2	ZINC000872166413	DD	On-Demand	Anodyne	ACKR3	75	41
COc1ccc(C(=O)O)c2c1CN(CC[S@@](=O)c1ccccc1)CC2	ZINC000872166419	FF	On-Demand	Anodyne	HTR1A	23	41
COc1ccc(C(=O)O)c2c1CN(CC[S@](=O)c1ccccc1)CC2	ZINC000872166420	FF	On-Demand	Anodyne	HTR1A	23	41
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	DRD4	44	34
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	HRH2	27	44
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	LTA4H	27	41
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	HRH3	16	40
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	PLA2G4B	47	44
C[C@]1(C(F)(F)F)CCN(CCOc2cccc(C(=O)O)c2)C1	ZINC000872166421	DG	On-Demand	Anodyne	PSMB1	40	38
COc1ccc(C(=O)O)c2c1CN(CCCN1CCOCC1)CC2	ZINC000872166424	ED	On-Demand	Anodyne	HTR1A	25	40
COc1ccc(C(=O)O)c2c1CN(CCCN1CCOCC1)CC2	ZINC000872166424	ED	On-Demand	Anodyne	DRD2	22	40
COc1ccc(C(=O)O)c2c1CN(CCCN1CCOCC1)CC2	ZINC000872166424	ED	On-Demand	Anodyne	HTR4	16	40
COc1ccc(C(=O)O)c2c1CN(CCCN1CCOCC1)CC2	ZINC000872166424	ED	On-Demand	Anodyne	SIGMAR1	17	44
COc1ccc(C(=O)O)c2c1CN(C1CCCC1)CC2	ZINC000872166432	CF	On-Demand	Anodyne	EBP	18	43
COc1ccc(C(=O)O)c2c1CN(C1CCCC1)CC2	ZINC000872166432	CF	On-Demand	Anodyne	L3MBTL3	52	34
COc1ccc(C(=O)O)c2c1CN(CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872166457	FF	On-Demand	Bother	ABCB1B	36	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872166457	FF	On-Demand	Bother	ABCG2	33	52
COc1ccc(C(=O)O)c2c1CN(CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872166457	FF	On-Demand	Bother	KCNJ1	41	49
C[C@@H]1CN(CC(=O)N2CCC(C(=O)O)CC2)Cc2ccccc21	ZINC000872166458	DD	On-Demand	Anodyne	SLC6A1	69	34
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cc(C)ccc1C)CC2	ZINC000872166470	GF	On-Demand	Anodyne	ABCB1	69	47
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cc(C)ccc1C)CC2	ZINC000872166471	GF	On-Demand	Anodyne	ABCB1	69	47
COc1ccc(C(=O)O)c2c1CN([C@H](C)c1cccnc1)CC2	ZINC000872166483	DF	On-Demand	Anodyne	PTAFR	19	40
COc1ccc(C(=O)O)c2c1CN([C@@H](C)c1cccnc1)CC2	ZINC000872166484	DF	On-Demand	Anodyne	PTAFR	19	40
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1c(C)cccc1C)CC2	ZINC000872166488	GF	On-Demand	Anodyne	ACOX1	48	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1c(C)cccc1C)CC2	ZINC000872166488	GF	On-Demand	Anodyne	ABCB1	76	43
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1c(C)cccc1C)CC2	ZINC000872166489	GF	On-Demand	Anodyne	ACOX1	48	32
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1c(C)cccc1C)CC2	ZINC000872166489	GF	On-Demand	Anodyne	ABCB1	76	43
COc1ccc(C(=O)O)c2c1CN(CCCCCCO)CC2	ZINC000872166490	DE	On-Demand	Anodyne	HTR1A	20	40
COc1ccc(C(=O)O)c2c1CN(CCCCCCO)CC2	ZINC000872166490	DE	On-Demand	Anodyne	DRD2	17	41
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)c(Cl)c2)C1	ZINC000872166492	DH	On-Demand	Anodyne	MCHR2	58	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1cccc(Cl)c1)CC2	ZINC000872166493	FG	On-Demand	Anodyne	ADRB1	31	47
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1cccc(Cl)c1)CC2	ZINC000872166493	FG	On-Demand	Anodyne	ADRB3	54	47
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000872166494	FG	On-Demand	Anodyne	ADRB1	31	47
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000872166494	FG	On-Demand	Anodyne	ADRB3	54	47
COCCSCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166495	EF	On-Demand	Anodyne	DRD3	17	40
COc1ccc(C(=O)O)c2c1CN(CCOCCC(C)C)CC2	ZINC000872166496	DF	On-Demand	Anodyne	SLC6A1	24	41
COc1ccc(C(=O)O)c2c1CN(CCCOCc1ccccc1)CC2	ZINC000872166497	FG	On-Demand	Anodyne	DRD2	37	42
COc1ccc(C(=O)O)c2c1CN(CCCOCc1ccccc1)CC2	ZINC000872166497	FG	On-Demand	Anodyne	DRD4	26	40
COc1ccc(C(=O)O)c2c1CN(CCCOCc1ccccc1)CC2	ZINC000872166497	FG	On-Demand	Anodyne	DRD3	42	42
COc1ccc(C(=O)O)c2c1CN(CCCOCc1ccccc1)CC2	ZINC000872166497	FG	On-Demand	Anodyne	HTR5A	35	53
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	PPARG	15	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	LTA4H	26	46
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	PPARD	68	41
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	PSEN1	15	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	PSMB1	40	37
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872166499	GH	On-Demand	Anodyne	LIPG	43	34
C[C@]1(C(F)(F)F)CCN(Cc2csc(-c3ccc(C(=O)O)cc3)n2)C1	ZINC000872166500	FI	On-Demand	Anodyne	RARA	37	45
C[C@]1(C(F)(F)F)CCN(Cc2csc(-c3ccc(C(=O)O)cc3)n2)C1	ZINC000872166500	FI	On-Demand	Anodyne	RARG	45	45
C[C@]1(C(F)(F)F)CCN(Cc2csc(-c3ccc(C(=O)O)cc3)n2)C1	ZINC000872166500	FI	On-Demand	Anodyne	RARB	52	45
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2Br)C1	ZINC000872166511	FH	On-Demand	Anodyne	RARG	49	35
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2Br)C1	ZINC000872166511	FH	On-Demand	Anodyne	RARB	45	35
COc1ccc(C(=O)O)c2c1CN(CC1CCCC1)CC2	ZINC000872166512	CF	On-Demand	Anodyne	HTR4	22	40
O=C(O)c1cccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166513	FE	On-Demand	Anodyne	CPT1A	58	41
O=C(O)c1cccc(OCCN2CCO[C@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166513	FE	On-Demand	Anodyne	ETHR	61	36
O=C(O)c1cccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166514	FE	On-Demand	Anodyne	CPT1A	58	41
O=C(O)c1cccc(OCCN2CCO[C@@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166514	FE	On-Demand	Anodyne	ETHR	61	36
C=C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166517	CD	On-Demand	Mild	CCR3	16	45
C=C[C@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166517	CD	On-Demand	Mild	LIPG	15	46
C=C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166518	CD	On-Demand	Mild	CCR3	16	45
C=C[C@@H](C(=O)O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166518	CD	On-Demand	Mild	LIPG	15	46
O=C(O)c1cccnc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166519	DF	On-Demand	Anodyne	HRH1	32	46
O=C(O)c1cccnc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166519	DF	On-Demand	Anodyne	CCR3	51	46
O=C(O)c1cccnc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166519	DF	On-Demand	Anodyne	MLNR	47	44
O=C(O)c1cccnc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166519	DF	On-Demand	Anodyne	LIPG	48	48
O=C(O)c1cccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166520	EG	On-Demand	Anodyne	DRD4	43	33
O=C(O)c1cccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166520	EG	On-Demand	Anodyne	LTA4H	22	40
O=C(O)c1cccc(OCCN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166520	EG	On-Demand	Anodyne	SIGMAR1	27	45
O=C(O)c1cccc(OCCN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166521	EG	On-Demand	Anodyne	DRD4	43	33
O=C(O)c1cccc(OCCN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166521	EG	On-Demand	Anodyne	LTA4H	22	40
O=C(O)c1cccc(OCCN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166521	EG	On-Demand	Anodyne	SIGMAR1	27	45
O=C(O)c1ccc(Br)cc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166522	GI	On-Demand	Anodyne	SIGMAR1	16	49
O=C(O)c1ccc(Br)cc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166523	GI	On-Demand	Anodyne	SIGMAR1	16	49
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	HTR1A	37	43
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	DRD2	55	48
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	DRD4	47	47
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	ACHE	26	43
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	SLC6A1	95	41
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	HRH1	31	43
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	DRD3	38	41
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	HTR4	53	41
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	FABP4	32	41
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	SIGMAR1	34	42
COc1ccccc1[C@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166524	FJ	On-Demand	Anodyne	CCR3	20	41
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	HTR1A	37	43
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	DRD2	55	48
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	DRD4	47	47
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	ACHE	26	43
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	SLC6A1	95	41
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	HRH1	31	43
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	DRD3	38	41
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	HTR4	53	41
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	FABP4	32	41
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	SIGMAR1	34	42
COc1ccccc1[C@@H]1CCCN(Cc2c(Cl)cccc2C(=O)O)CC1	ZINC000872166525	FJ	On-Demand	Anodyne	CCR3	20	41
O=C(O)[C@H](c1cccc(Cl)c1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166526	EI	On-Demand	Anodyne	OPRL1	21	44
O=C(O)[C@H](c1cccc(Cl)c1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166527	EI	On-Demand	Anodyne	OPRL1	21	44
O=C(O)[C@@H](c1cccc(Cl)c1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166528	EI	On-Demand	Anodyne	OPRL1	21	44
O=C(O)[C@@H](c1cccc(Cl)c1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166529	EI	On-Demand	Anodyne	OPRL1	21	44
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	SLC6A1	40	32
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	HRH1	34	49
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	SIGMAR1	23	40
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	CCR3	70	49
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	MLNR	45	46
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	EPHX2	15	42
O=C(O)c1cccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1Cl	ZINC000872166530	EH	On-Demand	Anodyne	LIPG	27	45
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	DRD4	22	42
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	HRH1	44	47
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	CHEK2	19	46
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	CCR3	79	49
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	UTS2R	27	51
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	SLC18A3	16	42
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	MLNR	42	46
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	EPHX2	20	40
O=C(O)c1ccc(Cl)c(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166539	EH	On-Demand	Anodyne	LIPG	27	45
COc1cccc([C@@H](C(=O)O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166540	FE	On-Demand	Anodyne	ETHR	47	36
COc1cccc([C@@H](C(=O)O)N2CCO[C@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166541	FE	On-Demand	Anodyne	ETHR	47	36
COc1cccc([C@H](C(=O)O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166542	FE	On-Demand	Anodyne	ETHR	47	36
COc1cccc([C@H](C(=O)O)N2CCO[C@H](c3noc(C4CC4)n3)C2)c1	ZINC000872166543	FE	On-Demand	Anodyne	ETHR	47	36
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)s1	ZINC000872166547	DG	On-Demand	Anodyne	CCR3	40	45
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)s1	ZINC000872166547	DG	On-Demand	Anodyne	MLNR	20	45
O=C(O)c1cc2cc(CN3CC[C@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166550	EI	On-Demand	Anodyne	DRD4	15	40
O=C(O)c1cc2cc(CN3CC[C@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166550	EI	On-Demand	Anodyne	SIGMAR1	46	54
O=C(O)c1cc2cc(CN3CC[C@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166550	EI	On-Demand	Anodyne	SLC18A3	18	41
O=C(O)c1cc2cc(CN3CC[C@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166550	EI	On-Demand	Anodyne	MCHR2	79	39
O=C(O)c1cc2cc(CN3CC[C@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166550	EI	On-Demand	Anodyne	NPFFR1	40	37
O=C(O)c1cc2cc(CN3CC[C@@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166551	EI	On-Demand	Anodyne	DRD4	15	40
O=C(O)c1cc2cc(CN3CC[C@@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166551	EI	On-Demand	Anodyne	SIGMAR1	46	54
O=C(O)c1cc2cc(CN3CC[C@@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166551	EI	On-Demand	Anodyne	SLC18A3	18	41
O=C(O)c1cc2cc(CN3CC[C@@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166551	EI	On-Demand	Anodyne	MCHR2	79	39
O=C(O)c1cc2cc(CN3CC[C@@]4(CCc5ccccc54)C3)ccc2o1	ZINC000872166551	EI	On-Demand	Anodyne	NPFFR1	40	37
O=C(O)c1sccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166552	DH	On-Demand	Anodyne	OXTR	42	36
O=C(O)c1sccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166552	DH	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)c1sccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166552	DH	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)c1sccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166553	DH	On-Demand	Anodyne	OXTR	42	36
O=C(O)c1sccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166553	DH	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)c1sccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166553	DH	On-Demand	Anodyne	SLC18A3	16	40
O=C(O)[C@H](C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166554	CE	On-Demand	Anodyne	OXTR	51	36
O=C(O)[C@H](C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166554	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@@H](C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166555	CE	On-Demand	Anodyne	OXTR	51	36
O=C(O)[C@@H](C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872166555	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@H](C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166556	CE	On-Demand	Anodyne	OXTR	51	36
O=C(O)[C@H](C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166556	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@@H](C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166557	CE	On-Demand	Anodyne	OXTR	51	36
O=C(O)[C@@H](C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166557	CE	On-Demand	Anodyne	SLC18A3	16	43
Cc1ccccc1[C@@H](C(=O)O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166558	EE	On-Demand	Anodyne	ETHR	52	36
Cc1ccccc1[C@@H](C(=O)O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166559	EE	On-Demand	Anodyne	ETHR	52	36
Cc1ccccc1[C@H](C(=O)O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166560	EE	On-Demand	Anodyne	ETHR	52	36
Cc1ccccc1[C@H](C(=O)O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166561	EE	On-Demand	Anodyne	ETHR	52	36
O=C(O)c1sccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166562	DG	On-Demand	Anodyne	CCR3	44	45
O=C(O)c1sccc1CN1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166562	DG	On-Demand	Anodyne	MLNR	28	46
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	HTR2C	15	43
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	SLC6A1	48	38
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	HRH1	48	42
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	PPARA	23	41
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	HTR7	16	42
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	CCR3	50	46
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	UTS2R	26	46
O=C(O)c1ccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c(Cl)c1	ZINC000872166568	GH	On-Demand	Anodyne	LIPG	24	43
O=C(O)Cc1ccccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166571	DG	On-Demand	Anodyne	OXTR	43	36
O=C(O)Cc1ccccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166571	DG	On-Demand	Anodyne	SIGMAR1	29	56
O=C(O)Cc1ccccc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166571	DG	On-Demand	Anodyne	SLC18A3	17	41
O=C(O)Cc1ccccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166572	DG	On-Demand	Anodyne	OXTR	43	36
O=C(O)Cc1ccccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166572	DG	On-Demand	Anodyne	SIGMAR1	29	56
O=C(O)Cc1ccccc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166572	DG	On-Demand	Anodyne	SLC18A3	17	41
O=C(O)c1cccnc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166573	DF	On-Demand	Anodyne	SIGMAR1	17	53
O=C(O)c1cccnc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166574	DF	On-Demand	Anodyne	SIGMAR1	17	53
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872166575	ED	On-Demand	Anodyne	SIGMAR1	31	44
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872166575	ED	On-Demand	Anodyne	CCR3	29	41
Cn1nnnc1C1CCN(Cc2ccc(C(=O)O)c(Cl)c2)CC1	ZINC000872166575	ED	On-Demand	Anodyne	MCHR1	28	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	DRD2	43	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	DRD4	49	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	ACHE	41	45
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	SLC6A1	44	36
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	HRH1	40	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	DRD3	26	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	HTR4	43	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	TACR1	22	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	SIGMAR1	39	44
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	SSTR5	42	43
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	CCR3	33	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	MCHR1	30	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166576	FJ	On-Demand	Anodyne	MBTPS1	46	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	HTR1A	23	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	DRD2	43	50
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	DRD4	49	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	ACHE	41	45
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	SLC6A1	44	36
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	HRH1	40	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	DRD3	26	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	HTR4	43	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	TACR1	22	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	SIGMAR1	39	44
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	SSTR5	42	43
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	CCR3	33	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	MCHR1	30	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)ccc2Cl)CC1	ZINC000872166577	FJ	On-Demand	Anodyne	MBTPS1	46	40
O=C(O)c1cccc(Br)c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166578	GI	On-Demand	Anodyne	OXTR	40	34
O=C(O)c1cccc(Br)c1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166578	GI	On-Demand	Anodyne	SIGMAR1	24	50
O=C(O)c1cccc(Br)c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166579	GI	On-Demand	Anodyne	OXTR	40	34
O=C(O)c1cccc(Br)c1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166579	GI	On-Demand	Anodyne	SIGMAR1	24	50
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	DRD2	51	51
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	DRD4	40	48
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	ACHE	38	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	SLC6A1	61	39
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	ADRA1A	34	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	HRH1	33	41
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	ADRA1B	34	40
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	SIGMAR1	35	42
COc1ccccc1[C@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166580	EH	On-Demand	Anodyne	ACKR3	65	33
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	DRD2	51	51
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	DRD4	40	48
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	ACHE	38	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	SLC6A1	61	39
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	ADRA1A	34	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	HRH1	33	41
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	ADRA1B	34	40
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	SIGMAR1	35	42
COc1ccccc1[C@@H]1CCCN(Cc2cc(C(=O)O)co2)CC1	ZINC000872166581	EH	On-Demand	Anodyne	ACKR3	65	33
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	HRH1	23	41
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	SIGMAR1	22	41
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	CCR3	59	46
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	SLC18A3	17	41
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	MLNR	41	47
O=C(O)c1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cs1	ZINC000872166584	DG	On-Demand	Anodyne	LIPG	22	44
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	CHRM2	19	44
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	HTR1A	51	60
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	DRD2	71	60
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	DRD4	82	55
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	ACHE	69	49
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	HRH2	40	49
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	ADRA1D	47	37
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	HTR2A	19	48
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	SLC6A1	63	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	ADRA1A	38	41
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	HRH1	37	54
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	ADRA1B	49	37
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	DRD3	44	42
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	KCNH2	16	42
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	HTR4	19	43
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	CHRM3	30	44
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	LTA4H	19	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	TACR1	16	42
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	FABP4	36	41
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	SIGMAR1	76	48
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	SSTR5	75	43
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	BCHE	17	42
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	CCR3	51	43
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	BDKRB1	36	46
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	MCHR1	42	47
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	CCR8	31	49
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	MBTPS1	48	40
COc1ccccc1[C@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166585	EI	On-Demand	Anodyne	ACKR3	62	34
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	CHRM2	19	44
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	HTR1A	51	60
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	DRD2	71	60
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	DRD4	82	55
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	ACHE	69	49
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	HRH2	40	49
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	ADRA1D	47	37
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	HTR2A	19	48
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	SLC6A1	63	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	ADRA1A	38	41
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	HRH1	37	54
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	ADRA1B	49	37
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	DRD3	44	42
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	KCNH2	16	42
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	HTR4	19	43
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	CHRM3	30	44
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	LTA4H	19	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	TACR1	16	42
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	FABP4	36	41
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	SIGMAR1	76	48
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	SSTR5	75	43
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	BCHE	17	42
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	CCR3	51	43
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	BDKRB1	36	46
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	MCHR1	42	47
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	CCR8	31	49
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	MBTPS1	48	40
COc1ccccc1[C@@H]1CCCN(Cc2cccc(C(=O)O)c2)CC1	ZINC000872166586	EI	On-Demand	Anodyne	ACKR3	62	34
CN(CCCCCC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872166587	CG	On-Demand	Anodyne	FFAR2	40	50
O=C(O)c1cnoc1CN1CC[C@@]2(CCc3ccccc32)C1	ZINC000872166588	CE	On-Demand	Anodyne	SIGMAR1	21	48
O=C(O)c1cnoc1CN1CC[C@]2(CCc3ccccc32)C1	ZINC000872166589	CE	On-Demand	Anodyne	SIGMAR1	21	48
CCCC[C@@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872166592	CH	On-Demand	Anodyne	CCR5	127	43
CCCC[C@@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872166592	CH	On-Demand	Anodyne	LIPE	15	46
CCCC[C@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872166593	CH	On-Demand	Anodyne	CCR5	127	43
CCCC[C@H](C(=O)O)N1CCC(c2cccc(F)c2)CC1	ZINC000872166593	CH	On-Demand	Anodyne	LIPE	15	46
O=C(O)c1ccc(Cl)c(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166598	EI	On-Demand	Anodyne	OPRL1	16	43
O=C(O)c1ccc(Cl)c(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166598	EI	On-Demand	Anodyne	TACR2	15	47
O=C(O)c1ccc(Cl)c(CN2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000872166598	EI	On-Demand	Anodyne	SIGMAR1	26	51
O=C(O)c1ccc(Cl)c(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166599	EI	On-Demand	Anodyne	OPRL1	16	43
O=C(O)c1ccc(Cl)c(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166599	EI	On-Demand	Anodyne	TACR2	15	47
O=C(O)c1ccc(Cl)c(CN2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000872166599	EI	On-Demand	Anodyne	SIGMAR1	26	51
CN(CCC(C)(C)CC(=O)O)Cc1ccc2cc[nH]c2c1	ZINC000872166610	CG	On-Demand	Anodyne	FFAR2	31	46
O=C(O)[C@@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166611	EH	On-Demand	Anodyne	HRH1	28	50
O=C(O)[C@@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166611	EH	On-Demand	Anodyne	CCR3	34	50
O=C(O)[C@@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166611	EH	On-Demand	Anodyne	EPHX2	16	43
O=C(O)[C@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166612	EH	On-Demand	Anodyne	HRH1	28	50
O=C(O)[C@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166612	EH	On-Demand	Anodyne	CCR3	34	50
O=C(O)[C@H](c1cccc(Cl)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872166612	EH	On-Demand	Anodyne	EPHX2	16	43
O=C(O)C1(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872166620	CE	On-Demand	Anodyne	CCR3	35	49
O=C(O)C1(CN2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872166620	CE	On-Demand	Anodyne	LIPG	17	45
O=C(O)[C@@H](c1cccc(Cl)c1Cl)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166622	GG	On-Demand	Anodyne	ETHR	46	33
O=C(O)[C@H](c1cccc(Cl)c1Cl)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872166623	GG	On-Demand	Anodyne	ETHR	46	33
O=C(O)[C@H](c1cccc(Cl)c1Cl)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166624	GG	On-Demand	Anodyne	ETHR	46	33
O=C(O)[C@@H](c1cccc(Cl)c1Cl)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872166625	GG	On-Demand	Anodyne	ETHR	46	33
O=C(O)C1(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872166626	CF	On-Demand	Anodyne	SIGMAR1	20	40
O=C(O)C1(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872166626	CF	On-Demand	Anodyne	PRCP	17	40
O=C(O)C1(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872166626	CF	On-Demand	Anodyne	CCR5	96	36
O=C(O)C1(CN2CCC(c3cccc(F)c3)CC2)CC1	ZINC000872166626	CF	On-Demand	Anodyne	MCHR1	29	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	CCR3	46	45
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	UTS2R	22	42
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	MLNR	31	44
O=C(O)c1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c(Br)c1	ZINC000872166627	GH	On-Demand	Anodyne	LIPG	27	45
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1Cl)CC2	ZINC000872166634	EH	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1Cl)CC2	ZINC000872166634	EH	On-Demand	Anodyne	ABCB1B	60	39
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1Cl)CC2	ZINC000872166634	EH	On-Demand	Anodyne	ABCB1	24	42
COc1ccc(C(=O)O)c2c1CN(CCc1cccc(C)n1)CC2	ZINC000872166635	EF	On-Demand	Anodyne	ABCB1B	61	36
COc1ccc(C(=O)O)c2c1CN(CCc1cccc(C)n1)CC2	ZINC000872166635	EF	On-Demand	Anodyne	ALS	49	33
COc1ccc(C(=O)O)c2c1CN(CCOc1cc(C)cc(C)c1)CC2	ZINC000872166636	FG	On-Demand	Anodyne	ABCB1	20	43
COc1ccc(C(=O)O)c2c1CN(CCn1cccn1)CC2	ZINC000872166644	DD	On-Demand	Anodyne	ABCB1B	57	34
COc1ccc(C(=O)O)c2c1CN(CCN(C)c1ccccc1)CC2	ZINC000872166645	EF	On-Demand	Anodyne	HTR1A	21	41
COc1ccc(C(=O)O)c2c1CN(CCN(C)c1ccccc1)CC2	ZINC000872166645	EF	On-Demand	Anodyne	HTR7	17	40
COc1ccc(C(=O)O)c2c1CN(CCN(C)c1ccccc1)CC2	ZINC000872166645	EF	On-Demand	Anodyne	ABCB1B	60	36
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CO)cc1)CC2	ZINC000872166649	EE	On-Demand	Anodyne	DRD4	21	46
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CO)cc1)CC2	ZINC000872166649	EE	On-Demand	Anodyne	NOD1	16	40
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CO)cc1)CC2	ZINC000872166649	EE	On-Demand	Anodyne	NOD2	42	40
COc1ccc(C(=O)O)c2c1CN(CCO[C@@H]1CCCC[C@@H]1C)CC2	ZINC000872166650	EG	On-Demand	Anodyne	SLC6A1	60	33
COc1ccc(C(=O)O)c2c1CN(CCO[C@H]1CCCC[C@H]1C)CC2	ZINC000872166651	EG	On-Demand	Anodyne	SLC6A1	60	33
COc1ccc(C(=O)O)c2c1CN(CCO[C@H]1CCCC[C@@H]1C)CC2	ZINC000872166652	EG	On-Demand	Anodyne	SLC6A1	60	33
COc1ccc(C(=O)O)c2c1CN(CCO[C@@H]1CCCC[C@H]1C)CC2	ZINC000872166653	EG	On-Demand	Anodyne	SLC6A1	60	33
COc1ccc(C(=O)O)c2c1CN(CCC1CCCC1)CC2	ZINC000872166656	DG	On-Demand	Anodyne	HTR1A	20	41
COc1ccc(C(=O)O)c2c1CN(CCC1CCCC1)CC2	ZINC000872166656	DG	On-Demand	Anodyne	DRD2	22	41
COc1ccc(C(=O)O)c2c1CN(CCC1CCCC1)CC2	ZINC000872166656	DG	On-Demand	Anodyne	HTR4	23	42
COc1ccc(C(=O)O)c2c1CN(CCC1CCCC1)CC2	ZINC000872166656	DG	On-Demand	Anodyne	ACKR3	43	33
C[C@]1(C(F)(F)F)CCN(Cc2ccc3oc(C(=O)O)cc3c2)C1	ZINC000872166659	EH	On-Demand	Anodyne	MCHR2	64	33
C[C@]1(C(F)(F)F)CCN(Cc2ccc3oc(C(=O)O)cc3c2)C1	ZINC000872166659	EH	On-Demand	Anodyne	NPFFR1	41	37
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2F)C1	ZINC000872166672	DG	On-Demand	Anodyne	RARA	41	34
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2F)C1	ZINC000872166672	DG	On-Demand	Anodyne	RARG	54	34
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2F)C1	ZINC000872166672	DG	On-Demand	Anodyne	RARB	50	37
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)cc2F)C1	ZINC000872166672	DG	On-Demand	Anodyne	RXRA	32	48
COc1ccc(C(=O)O)c2c1CN(CCc1nc(-c3ccccc3)no1)CC2	ZINC000872166675	GG	On-Demand	Anodyne	ABCB1B	65	36
COc1ccc(C(=O)O)c2c1CN(CCc1nc(-c3ccccc3)no1)CC2	ZINC000872166675	GG	On-Demand	Anodyne	S1PR1	28	40
COc1ccc(C(=O)O)c2c1CN(CCCCCn1cc(C)cn1)CC2	ZINC000872166676	FG	On-Demand	Anodyne	DRD2	20	42
C[C@]1(C(F)(F)F)CCN(Cc2oc(-c3ccccc3)nc2C(=O)O)C1	ZINC000872166680	FH	On-Demand	Anodyne	PDE8B	55	32
COc1ccc(C(=O)O)c2c1CN(CCS(=O)(=O)Cc1ccccc1)CC2	ZINC000872166682	GE	On-Demand	Anodyne	DRD4	15	42
COc1ccc(C(=O)O)c2c1CN(CCS(=O)(=O)Cc1ccccc1)CC2	ZINC000872166682	GE	On-Demand	Anodyne	ABCB1B	57	36
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	HTR1A	27	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	SLC6A1	44	38
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	DRD3	27	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	LTA4H	48	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	HRH3	17	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	SIGMAR1	15	40
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	HTR5A	36	44
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	ABCB1B	57	36
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	ABCB1	30	47
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	PSMB2	40	39
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1)CC2	ZINC000872166686	EF	On-Demand	Anodyne	PSMB1	43	40
COc1ccc(C(=O)O)c2c1CN(CC1CCCCCC1)CC2	ZINC000872166687	DH	On-Demand	Anodyne	HTR4	22	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	HTR1A	53	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	DRD2	48	41
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	ADRA1D	25	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	HTR2A	22	43
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	SLC6A1	51	39
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	ADRA1A	24	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	DRD3	51	37
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	HTR7	42	41
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	SIGMAR1	24	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	HTR5A	40	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	ABCB1B	57	35
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	GRM2	19	40
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccccc1C)CC2	ZINC000872166691	FH	On-Demand	Anodyne	ABCB1	39	41
COc1ccc(C(=O)O)c2c1CN(CCSc1ccccc1)CC2	ZINC000872166698	EH	On-Demand	Anodyne	ABCB1B	47	36
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1)CC2	ZINC000872166699	FE	On-Demand	Anodyne	ACOX1	50	35
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1)CC2	ZINC000872166699	FE	On-Demand	Anodyne	ABCB1	96	46
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1)CC2	ZINC000872166700	FE	On-Demand	Anodyne	ACOX1	50	35
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1)CC2	ZINC000872166700	FE	On-Demand	Anodyne	ABCB1	96	46
COC1([C@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCC1	ZINC000872166708	DE	On-Demand	Anodyne	CCR3	16	43
COC1([C@@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCC1	ZINC000872166709	DE	On-Demand	Anodyne	CCR3	16	43
COc1ccc(C(=O)O)c2c1CN(Cc1ccncc1)CC2	ZINC000872166711	CE	On-Demand	Anodyne	DRD4	18	48
COc1cccc([C@@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166715	EG	On-Demand	Anodyne	HRH1	19	45
COc1cccc([C@@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166715	EG	On-Demand	Anodyne	KCNH2	16	43
COc1cccc([C@@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166715	EG	On-Demand	Anodyne	CCR3	38	45
COc1cccc([C@@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166715	EG	On-Demand	Anodyne	CCR5	51	36
COc1cccc([C@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166716	EG	On-Demand	Anodyne	HRH1	19	45
COc1cccc([C@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166716	EG	On-Demand	Anodyne	KCNH2	16	43
COc1cccc([C@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166716	EG	On-Demand	Anodyne	CCR3	38	45
COc1cccc([C@H](C(=O)O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872166716	EG	On-Demand	Anodyne	CCR5	51	36
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCCCN1C)CC2	ZINC000872166722	EF	On-Demand	Anodyne	ACKR3	79	42
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCCCN1C)CC2	ZINC000872166723	EF	On-Demand	Anodyne	ACKR3	79	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1Cl)CC2	ZINC000872166724	GF	On-Demand	Anodyne	ADRB2	16	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1Cl)CC2	ZINC000872166724	GF	On-Demand	Anodyne	ABCB1	90	48
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1Cl)CC2	ZINC000872166725	GF	On-Demand	Anodyne	ADRB2	16	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1Cl)CC2	ZINC000872166725	GF	On-Demand	Anodyne	ABCB1	90	48
COc1ccc(C(=O)O)c2c1CN(CCCC1CCCC1)CC2	ZINC000872166726	DH	On-Demand	Anodyne	HTR1A	27	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CCCC1)CC2	ZINC000872166726	DH	On-Demand	Anodyne	DRD2	28	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CCCC1)CC2	ZINC000872166726	DH	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccc(C(=O)O)c2c1CN(CCCC1CCCC1)CC2	ZINC000872166726	DH	On-Demand	Anodyne	EBP	33	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CCCC1)CC2	ZINC000872166726	DH	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc(C)c1)CC2	ZINC000872166729	FE	On-Demand	Anodyne	ACOX1	69	36
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc(C)c1)CC2	ZINC000872166729	FE	On-Demand	Anodyne	ABCB1	81	44
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc(C)c1)CC2	ZINC000872166730	FE	On-Demand	Anodyne	ACOX1	69	36
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc(C)c1)CC2	ZINC000872166730	FE	On-Demand	Anodyne	ABCB1	81	44
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COCc1ccccc1F)CC2	ZINC000872166734	GE	On-Demand	Anodyne	ABCB1	59	37
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COCc1ccccc1F)CC2	ZINC000872166735	GE	On-Demand	Anodyne	ABCB1	59	37
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	HTR1A	20	43
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	DRD2	20	43
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	SLC6A1	41	36
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	HTR4	22	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	SIGMAR1	21	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCCCC1)CC2	ZINC000872166738	DE	On-Demand	Anodyne	ABCB1B	56	35
CCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166739	CF	On-Demand	Anodyne	HTR1A	23	46
CCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166739	CF	On-Demand	Anodyne	DRD2	23	46
CCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166739	CF	On-Demand	Anodyne	DRD3	26	42
CCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166739	CF	On-Demand	Anodyne	HTR4	20	40
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COCC(C)C)CC2	ZINC000872166741	ED	On-Demand	Anodyne	ABCB1	40	37
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COCC(C)C)CC2	ZINC000872166742	ED	On-Demand	Anodyne	ABCB1	40	37
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	DRD4	18	41
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	CHRM5	24	42
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	NOX4	15	42
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	CYBB	17	42
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	NOX1	15	42
COc1ccc(C(=O)O)c2c1CN(Cc1ccccn1)CC2	ZINC000872166743	CE	On-Demand	Anodyne	NOX5	16	42
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1)CC2	ZINC000872166744	EF	On-Demand	Anodyne	DRD2	18	43
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1)CC2	ZINC000872166744	EF	On-Demand	Anodyne	LTA4H	33	43
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1)CC2	ZINC000872166744	EF	On-Demand	Anodyne	HTR5A	33	49
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1)CC2	ZINC000872166744	EF	On-Demand	Anodyne	ABCB1	21	45
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1)CC2	ZINC000872166744	EF	On-Demand	Anodyne	PSMB1	41	36
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HTR1A	27	49
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	DRD2	39	49
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	DRD4	20	43
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HRH2	17	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HTR2A	26	57
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	DRD3	35	43
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HTR7	25	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HRH3	68	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	SIGMAR1	22	42
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	HTR5A	42	53
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc(F)cc1)CC2	ZINC000872166746	FG	On-Demand	Anodyne	ABCB1	25	45
COc1ccc(C(=O)O)c2c1CN(CCN1CCOCC1)CC2	ZINC000872166748	DD	On-Demand	Anodyne	ABCB1B	40	34
O=C(O)c1cnc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000872166752	DD	On-Demand	Anodyne	CCR3	39	43
O=C(O)c1cnc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000872166752	DD	On-Demand	Anodyne	LIPG	22	42
COc1ccc(C(=O)O)c2c1CN(CCC1CC1)CC2	ZINC000872166758	CF	On-Demand	Anodyne	DRD2	19	42
COc1ccc(C(=O)O)c2c1CN(CCCO)CC2	ZINC000872166759	CD	On-Demand	Anodyne	HTR1A	22	40
COc1ccc(C(=O)O)c2c1CN(CCCO)CC2	ZINC000872166759	CD	On-Demand	Anodyne	DRD2	19	42
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1F)CC2	ZINC000872166760	EF	On-Demand	Anodyne	HTR1A	30	42
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1F)CC2	ZINC000872166760	EF	On-Demand	Anodyne	DRD2	31	42
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1F)CC2	ZINC000872166760	EF	On-Demand	Anodyne	HTR2A	15	41
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1F)CC2	ZINC000872166760	EF	On-Demand	Anodyne	SLC6A1	50	39
COc1ccc(C(=O)O)c2c1CN(CCNS(C)(=O)=O)CC2	ZINC000872166761	EC	On-Demand	Anodyne	DRD3	16	40
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(C)cc1)CC2	ZINC000872166763	FE	On-Demand	Anodyne	ACOX1	72	34
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(C)cc1)CC2	ZINC000872166763	FE	On-Demand	Anodyne	ABCB1	74	43
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(C)cc1)CC2	ZINC000872166764	FE	On-Demand	Anodyne	ACOX1	72	34
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(C)cc1)CC2	ZINC000872166764	FE	On-Demand	Anodyne	ABCB1	74	43
CCOC[C@H](O)CN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166771	DD	On-Demand	Anodyne	ABCB1	42	38
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(C)c1)CC2	ZINC000872166773	EG	On-Demand	Anodyne	DRD4	42	35
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(C)c1)CC2	ZINC000872166773	EG	On-Demand	Anodyne	PPARD	26	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(C)c1)CC2	ZINC000872166773	EG	On-Demand	Anodyne	ABCB1B	52	34
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(C)c1)CC2	ZINC000872166773	EG	On-Demand	Anodyne	ABCB1	27	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	HTR1A	32	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	DRD2	36	44
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	DRD4	32	49
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	HTR2A	22	44
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	DRD3	34	49
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	SIGMAR1	39	47
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	HTR5A	26	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	ABCB1B	71	48
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	MTNR1B	19	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	ABCB1	56	48
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1)CC2	ZINC000872166774	DF	On-Demand	Anodyne	ABCG2	36	46
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)CN(C)Cc1ccccc1)CC2	ZINC000872166787	GE	On-Demand	Anodyne	ABCB1	52	37
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)CN(C)Cc1ccccc1)CC2	ZINC000872166788	GE	On-Demand	Anodyne	ABCB1	52	37
COc1ccc(C(=O)O)c2c1CN(CCOCCOc1ccccc1)CC2	ZINC000872166789	FF	On-Demand	Anodyne	DRD2	23	42
COc1ccc(C(=O)O)c2c1CN(CCOCCOc1ccccc1)CC2	ZINC000872166789	FF	On-Demand	Anodyne	DRD3	30	42
COc1ccc(C(=O)O)c2c1CN(CCOCCOc1ccccc1)CC2	ZINC000872166789	FF	On-Demand	Anodyne	HTR5A	36	44
COc1ccc(C(=O)O)c2c1CN(CCOCCOc1ccccc1)CC2	ZINC000872166789	FF	On-Demand	Anodyne	ABCB1B	51	35
COc1ccc(C(=O)O)c2c1CN(CCOCCOc1ccccc1)CC2	ZINC000872166789	FF	On-Demand	Anodyne	ABCB1	26	43
COc1ccc(C(=O)O)c2c1CN(CCOC[C@H]1CCCO1)CC2	ZINC000872166790	ED	On-Demand	Anodyne	SLC6A1	46	31
COc1ccc(C(=O)O)c2c1CN(CCOC[C@@H]1CCCO1)CC2	ZINC000872166791	ED	On-Demand	Anodyne	SLC6A1	46	31
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C)n1)CC2	ZINC000872166792	DF	On-Demand	Anodyne	ABCB1B	49	30
COc1ccc(C(=O)O)c2c1CN(CCCF)CC2	ZINC000872166799	CE	On-Demand	Anodyne	HTR1A	16	40
COc1ccc(C(=O)O)c2c1CN(CCCF)CC2	ZINC000872166799	CE	On-Demand	Anodyne	DRD2	18	41
COc1ccc(C(=O)O)c2c1CN(CCCF)CC2	ZINC000872166799	CE	On-Demand	Anodyne	DRD3	23	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1C)CC2	ZINC000872166802	FE	On-Demand	Anodyne	ADRB2	19	42
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1C)CC2	ZINC000872166802	FE	On-Demand	Anodyne	ADRB1	15	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccccc1C)CC2	ZINC000872166802	FE	On-Demand	Anodyne	ABCB1	96	49
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1C)CC2	ZINC000872166803	FE	On-Demand	Anodyne	ADRB2	19	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1C)CC2	ZINC000872166803	FE	On-Demand	Anodyne	ADRB1	15	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccccc1C)CC2	ZINC000872166803	FE	On-Demand	Anodyne	ABCB1	96	49
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cc(C)cc(C)c1)CC2	ZINC000872166807	GF	On-Demand	Anodyne	ACOX1	64	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cc(C)cc(C)c1)CC2	ZINC000872166807	GF	On-Demand	Anodyne	ABCB1	70	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cc(C)cc(C)c1)CC2	ZINC000872166808	GF	On-Demand	Anodyne	ACOX1	64	32
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cc(C)cc(C)c1)CC2	ZINC000872166808	GF	On-Demand	Anodyne	ABCB1	70	42
CCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166818	FG	On-Demand	Anodyne	PLA2G4B	45	38
CCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166818	FG	On-Demand	Anodyne	ABCB1	15	46
CCOc1ccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872166818	FG	On-Demand	Anodyne	PSMB1	42	37
CCOCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166819	CE	On-Demand	Anodyne	DRD2	17	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	DRD2	17	46
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	SLC6A1	37	42
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	HTR5A	27	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	ABCB1	21	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(F)c1)CC2	ZINC000872166822	EF	On-Demand	Anodyne	ACKR3	58	36
COc1ccc(C(=O)O)c2c1CN(CC1CCC1)CC2	ZINC000872166828	CF	On-Demand	Anodyne	HTR4	22	40
COCCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166830	DF	On-Demand	Anodyne	DRD2	22	43
COCCCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166830	DF	On-Demand	Anodyne	ABCB1	21	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	DRD4	44	36
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	SLC6A1	26	41
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	HTR4	44	40
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	CPT1A	44	31
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	CPT2	45	34
COc1ccc(C(=O)O)c2c1CN(CCOc1cccc(Cl)c1)CC2	ZINC000872166840	FG	On-Demand	Anodyne	ABCB1	20	40
C[C@]1(C(F)(F)F)CCN(Cc2ccc(C(=O)O)c(F)c2)C1	ZINC000872166844	DG	On-Demand	Anodyne	MCHR2	65	33
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	HTR1A	34	43
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	HRH1	18	42
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	HTR4	18	40
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	HTR7	30	42
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	ABCB1B	41	35
CCOc1ccccc1OCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166845	FG	On-Demand	Anodyne	HCN1	52	33
C[C@H]1CN(Cc2nc(C(=O)O)cs2)Cc2ccccc21	ZINC000872166847	CF	On-Demand	Anodyne	TRPC6	42	34
C[C@H]1CN(Cc2nc(C(=O)O)cs2)Cc2ccccc21	ZINC000872166847	CF	On-Demand	Anodyne	TRPC3	40	34
C[C@@H]1CN(Cc2nc(C(=O)O)cs2)Cc2ccccc21	ZINC000872166848	CF	On-Demand	Anodyne	TRPC6	42	34
C[C@@H]1CN(Cc2nc(C(=O)O)cs2)Cc2ccccc21	ZINC000872166848	CF	On-Demand	Anodyne	TRPC3	40	34
COC[C@@H](O)CN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166849	CC	On-Demand	Anodyne	ABCB1	55	40
COc1ccc(C(=O)O)c2c1CN(CCOc1c(C)cccc1C)CC2	ZINC000872166851	FG	On-Demand	Anodyne	SLC6A1	44	39
COc1ccc(C(=O)O)c2c1CN(CCOc1c(C)cccc1C)CC2	ZINC000872166851	FG	On-Demand	Anodyne	ABCB1B	57	34
COc1ccc(C(=O)O)c2c1CN(CCc1ccncc1)CC2	ZINC000872166852	DE	On-Demand	Anodyne	CHRM5	17	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccncc1)CC2	ZINC000872166852	DE	On-Demand	Anodyne	ABCB1B	41	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccncc1)CC2	ZINC000872166852	DE	On-Demand	Anodyne	ABCB1	19	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccncc1)CC2	ZINC000872166852	DE	On-Demand	Anodyne	ABCG2	30	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)Cc1ccccc1)CC2	ZINC000872166853	EE	On-Demand	Anodyne	ABCB1	72	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)Cc1ccccc1)CC2	ZINC000872166854	EE	On-Demand	Anodyne	ABCB1	72	41
COc1ccc(C(=O)O)c2c1CN(CCCc1nc(-c3ccccc3)no1)CC2	ZINC000872166856	GG	On-Demand	Anodyne	ABCB1B	58	35
COc1ccc(C(=O)O)c2c1CN(Cc1cn3ccccc3n1)CC2	ZINC000872166865	EF	On-Demand	Anodyne	DRD4	19	43
COc1ccc(C(=O)O)c2c1CN(CCS(=O)(=O)c1ccccc1)CC2	ZINC000872166868	GE	On-Demand	Anodyne	ABCB1B	57	36
COc1ccc(C(=O)O)c2c1CN(CCc1ccc(C)cc1)CC2	ZINC000872166871	EG	On-Demand	Anodyne	CHRM5	17	40
COc1ccc(C(=O)O)c2c1CN(CCc1ccc(C)cc1)CC2	ZINC000872166871	EG	On-Demand	Anodyne	ABCB1B	68	49
COc1ccc(C(=O)O)c2c1CN(CCc1ccc(C)cc1)CC2	ZINC000872166871	EG	On-Demand	Anodyne	ABCB1	30	49
COc1ccc(C(=O)O)c2c1CN(CCc1ccc(C)cc1)CC2	ZINC000872166871	EG	On-Demand	Anodyne	ABCG2	31	43
COc1ccc(C(=O)O)c2c1CN(CCn1nc(C)cc1C)CC2	ZINC000872166878	EE	On-Demand	Anodyne	ABCB1B	57	33
COc1ccc(C(=O)O)c2c1CN(CCCCCF)CC2	ZINC000872166880	CF	On-Demand	Anodyne	DRD2	17	41
COc1ccc(C(=O)O)c2c1CN(CCOc1ccccc1C(F)(F)F)CC2	ZINC000872166884	GH	On-Demand	Anodyne	RBP4	49	42
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166889	EF	On-Demand	Anodyne	ACOX1	57	39
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166889	EF	On-Demand	Anodyne	ABCB1	78	49
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166890	EF	On-Demand	Anodyne	ACOX1	57	39
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)Cc2ccccc21	ZINC000872166890	EF	On-Demand	Anodyne	ABCB1	78	49
COc1ccc(C(=O)O)c2c1CN(Cc1nc3ccccc3o1)CC2	ZINC000872166898	EG	On-Demand	Anodyne	ABCB1B	60	35
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000872166901	FG	On-Demand	Anodyne	LTA4H	36	43
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000872166901	FG	On-Demand	Anodyne	HRH3	17	43
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000872166901	FG	On-Demand	Anodyne	HTR5A	25	44
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000872166901	FG	On-Demand	Anodyne	EBP	15	44
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000872166901	FG	On-Demand	Anodyne	PSMB1	41	36
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	DRD2	15	41
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	EDNRB	80	44
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	EDNRA	80	44
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	HRH3	31	43
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	SIGMAR1	17	41
COc1ccc(C(=O)O)c2c1CN(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872166904	GF	On-Demand	Anodyne	ABCB1	15	41
COc1ccc(C(=O)O)c2c1CN(CCc1nc3ccccc3n1C)CC2	ZINC000872166920	FF	On-Demand	Anodyne	HTR5A	30	40
COc1ccc(C(=O)O)c2c1CN(CCc1nc3ccccc3n1C)CC2	ZINC000872166920	FF	On-Demand	Anodyne	ABCB1B	68	39
COc1ccc(C(=O)O)c2c1CN(CCc1nc3ccccc3n1C)CC2	ZINC000872166920	FF	On-Demand	Anodyne	ABCB1	20	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COC(C)(C)C)CC2	ZINC000872166923	ED	On-Demand	Anodyne	ABCB1	41	39
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COC(C)(C)C)CC2	ZINC000872166924	ED	On-Demand	Anodyne	ABCB1	41	39
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C)cc1)CC2	ZINC000872166925	EG	On-Demand	Anodyne	PPARG	18	41
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C)cc1)CC2	ZINC000872166925	EG	On-Demand	Anodyne	ABCB1B	41	36
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C)cc1)CC2	ZINC000872166925	EG	On-Demand	Anodyne	ABCB1	19	48
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(C)cc1)CC2	ZINC000872166925	EG	On-Demand	Anodyne	PSMB1	42	36
COc1ccc(C(=O)O)c2c1CN(CCOc1cc(C)ccc1C)CC2	ZINC000872166932	FG	On-Demand	Anodyne	SLC9A1	40	34
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(Cl)cc1)CC2	ZINC000872166933	GF	On-Demand	Anodyne	ACOX1	55	32
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1ccc(Cl)cc1)CC2	ZINC000872166933	GF	On-Demand	Anodyne	ABCB1	68	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(Cl)cc1)CC2	ZINC000872166934	GF	On-Demand	Anodyne	ACOX1	55	32
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1ccc(Cl)cc1)CC2	ZINC000872166934	GF	On-Demand	Anodyne	ABCB1	68	42
COc1ccc(C(=O)O)c2c1CN(CC[C@@H](O)c1ccccc1)CC2	ZINC000872166936	EF	On-Demand	Anodyne	HTR1A	15	52
COc1ccc(C(=O)O)c2c1CN(CC[C@@H](O)c1ccccc1)CC2	ZINC000872166936	EF	On-Demand	Anodyne	CCR5	17	41
COc1ccc(C(=O)O)c2c1CN(CC[C@H](O)c1ccccc1)CC2	ZINC000872166937	EF	On-Demand	Anodyne	HTR1A	15	52
COc1ccc(C(=O)O)c2c1CN(CC[C@H](O)c1ccccc1)CC2	ZINC000872166937	EF	On-Demand	Anodyne	CCR5	17	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COC(C)C)CC2	ZINC000872166942	DD	On-Demand	Anodyne	ABCB1	45	38
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COC(C)C)CC2	ZINC000872166943	DD	On-Demand	Anodyne	ABCB1	45	38
CNS(=O)(=O)CCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166951	EC	On-Demand	Anodyne	DRD3	21	40
CNS(=O)(=O)CCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166951	EC	On-Demand	Anodyne	HTR7	17	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	HTR1A	24	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	ADRA2A	29	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	DRD2	25	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	DRD4	30	44
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	HTR2A	17	40
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	DRD3	29	44
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	CHRM5	25	41
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	SIGMAR1	23	43
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	HTR5A	19	40
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	ABCB1B	73	45
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	ABCB1	38	55
COc1ccc(C(=O)O)c2c1CN(CCc1ccc3ccccc3c1)CC2	ZINC000872166952	FI	On-Demand	Anodyne	ABCG2	43	45
COc1ccc(C(=O)O)c2c1CN(Cc1ncccn1)CC2	ZINC000872166954	CD	On-Demand	Anodyne	DRD4	15	41
COc1ccc(C(=O)O)c2c1CN(CCCS(=O)(=O)c1ccccc1)CC2	ZINC000872166962	GF	On-Demand	Anodyne	DRD2	26	40
COc1ccc(C(=O)O)c2c1CN(CCCS(=O)(=O)c1ccccc1)CC2	ZINC000872166962	GF	On-Demand	Anodyne	DRD4	17	40
COc1ccc(C(=O)O)c2c1CN(CCCS(=O)(=O)c1ccccc1)CC2	ZINC000872166962	GF	On-Demand	Anodyne	HTR7	31	43
COc1ccc(C(=O)O)c2c1CN(CCCS(=O)(=O)c1ccccc1)CC2	ZINC000872166962	GF	On-Demand	Anodyne	ABCB1B	56	35
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	DRD4	25	40
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	HTR2A	20	43
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	DRD3	39	40
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	SIGMAR1	39	42
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	HTR5A	36	43
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	EBP	17	41
COc1ccc(C(=O)O)c2c1CN(CCCOCCc1ccccc1)CC2	ZINC000872166964	FG	On-Demand	Anodyne	ABCB1	35	40
COc1ccc(C(=O)O)c2c1CN(CCCCF)CC2	ZINC000872166965	CF	On-Demand	Anodyne	HTR1A	16	40
COc1ccc(C(=O)O)c2c1CN(CCCCF)CC2	ZINC000872166965	CF	On-Demand	Anodyne	DRD2	18	41
COc1ccc(C(=O)O)c2c1CN(CCCCF)CC2	ZINC000872166965	CF	On-Demand	Anodyne	DRD3	23	41
COc1ccc(C(=O)O)c2c1CN(CCc1cccnc1)CC2	ZINC000872166966	DE	On-Demand	Anodyne	PTAFR	32	41
COc1ccc(C(=O)O)c2c1CN(CCc1cccnc1)CC2	ZINC000872166966	DE	On-Demand	Anodyne	ABCB1B	40	39
COc1ccc(C(=O)O)c2c1CN(CCc1cccnc1)CC2	ZINC000872166966	DE	On-Demand	Anodyne	ABCB1	24	40
COc1ccc(C(=O)O)c2c1CN(CCc1cccnc1)CC2	ZINC000872166966	DE	On-Demand	Anodyne	ABCG2	31	40
COc1ccc(C(=O)O)c2c1CN(CCc1csc(C)n1)CC2	ZINC000872166968	EF	On-Demand	Anodyne	ABCB1B	52	34
COc1ccc(C(=O)O)c2c1CN(CCOC1CCC1)CC2	ZINC000872166970	DE	On-Demand	Anodyne	SLC6A1	65	34
COc1ccc(C(=O)O)c2c1CN(CCc1c(C)noc1C)CC2	ZINC000872166979	EF	On-Demand	Anodyne	ADRA2A	27	40
COc1ccc(C(=O)O)c2c1CN(CCc1c(C)noc1C)CC2	ZINC000872166979	EF	On-Demand	Anodyne	ADRA2B	31	40
COc1ccc(C(=O)O)c2c1CN(CCc1c(C)noc1C)CC2	ZINC000872166979	EF	On-Demand	Anodyne	ADRA2C	16	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	HTR1A	18	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	DRD2	15	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	PPARA	19	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	LTA4H	19	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	HRH3	15	44
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	ABCB1B	51	35
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	MTNR1B	26	40
COc1cccc(OCCN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872166986	FF	On-Demand	Anodyne	ABCB1	36	44
COc1ccc(C(=O)O)c2c1CN(CCCCCO)CC2	ZINC000872166989	CD	On-Demand	Anodyne	HTR1A	20	40
COc1ccc(C(=O)O)c2c1CN(CCCCCO)CC2	ZINC000872166989	CD	On-Demand	Anodyne	DRD2	17	41
CCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166992	CF	On-Demand	Anodyne	HTR1A	22	49
CCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166992	CF	On-Demand	Anodyne	DRD2	23	49
CCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166992	CF	On-Demand	Anodyne	DRD3	26	42
CCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166992	CF	On-Demand	Anodyne	HTR4	24	43
CCCCN1CCc2c(C(=O)O)ccc(OC)c2C1	ZINC000872166992	CF	On-Demand	Anodyne	SIGMAR1	15	42
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(S(C)(=O)=O)cc1)CC2	ZINC000872166994	GE	On-Demand	Anodyne	DRD4	15	43
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(S(C)(=O)=O)cc1)CC2	ZINC000872166994	GE	On-Demand	Anodyne	NOD2	40	37
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166995	GF	On-Demand	Anodyne	ADRB2	15	45
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166995	GF	On-Demand	Anodyne	ADRB1	20	45
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166995	GF	On-Demand	Anodyne	HTR1A	17	53
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166995	GF	On-Demand	Anodyne	SLC6A4	19	45
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166995	GF	On-Demand	Anodyne	ABCB1	71	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166996	GF	On-Demand	Anodyne	ADRB2	15	45
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166996	GF	On-Demand	Anodyne	ADRB1	20	45
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166996	GF	On-Demand	Anodyne	HTR1A	17	53
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166996	GF	On-Demand	Anodyne	SLC6A4	19	45
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872166996	GF	On-Demand	Anodyne	ABCB1	71	41
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166997	GE	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166997	GE	On-Demand	Anodyne	ACOX1	51	35
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166997	GE	On-Demand	Anodyne	ABCB1	78	53
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166998	GE	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166998	GE	On-Demand	Anodyne	ACOX1	51	35
COc1ccc(C(=O)O)c2c1CN(C[C@@H](O)COc1cccc(C(C)=O)c1)CC2	ZINC000872166998	GE	On-Demand	Anodyne	ABCB1	78	53
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872167004	DG	On-Demand	Anodyne	CCR3	44	46
O=C(O)c1csc(CN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000872167004	DG	On-Demand	Anodyne	LIPG	34	46
COc1cc(C)nc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872167035	EF	On-Demand	Anodyne	ABCB1B	50	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CC1(CC(=O)O)CC1	ZINC000872167047	DI	On-Demand	Anodyne	MDM2	151	39
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccc(C(=O)O)s1	ZINC000872167049	EJ	On-Demand	Anodyne	MDM2	129	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccccc1CC(=O)O	ZINC000872167062	FJ	On-Demand	Anodyne	SIGMAR1	15	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccccc1CC(=O)O	ZINC000872167062	FJ	On-Demand	Anodyne	MDM2	144	36
COc1ccc(C(=O)O)c2c1CN(CCn1ccc3cc(Cl)ccc31)CC2	ZINC000872167064	GI	On-Demand	Anodyne	CPT1A	72	38
COc1ccc(C(=O)O)c2c1CN(CCn1ccc3cc(Cl)ccc31)CC2	ZINC000872167064	GI	On-Demand	Anodyne	CPT2	45	36
COc1ccc(C(=O)O)c2c1CN(CCn1ccc3cc(Cl)ccc31)CC2	ZINC000872167064	GI	On-Demand	Anodyne	ABCB1B	41	33
COc1ccc(C(=O)O)c2c1CN(CCn1ccc3cc(Cl)ccc31)CC2	ZINC000872167064	GI	On-Demand	Anodyne	CPT1B	53	35
C[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167084	FH	On-Demand	Anodyne	MLNR	41	34
C[C@@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167085	FH	On-Demand	Anodyne	MLNR	41	34
C[C@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167086	FH	On-Demand	Anodyne	MLNR	41	34
C[C@H]1CN(Cc2ccc(C(=O)O)c(Cl)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167087	FH	On-Demand	Anodyne	MLNR	41	34
C[C@H]1CN(Cc2ccccc2C(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167088	DF	On-Demand	Anodyne	SLC6A1	53	34
C[C@H]1CN(Cc2ccccc2C(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167089	DF	On-Demand	Anodyne	SLC6A1	53	34
C[C@@H]1CN(Cc2ccccc2C(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167090	DF	On-Demand	Anodyne	SLC6A1	53	34
C[C@@H]1CN(Cc2ccccc2C(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167091	DF	On-Demand	Anodyne	SLC6A1	53	34
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	DRD2	22	47
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	DRD4	51	47
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	ACHE	48	45
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	HRH2	21	49
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	SIGMAR1	51	47
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	SSTR5	47	36
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	CCR3	28	45
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	SLC6A5	20	41
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	MCHR1	37	46
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	CACNA1I	15	42
O=C(O)c1cccc(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167098	DF	On-Demand	Anodyne	CYP2J2	42	29
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	DRD2	22	47
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	DRD4	51	47
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	ACHE	48	45
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	HRH2	21	49
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	SIGMAR1	51	47
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	SSTR5	47	36
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	CCR3	28	45
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	SLC6A5	20	41
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	MCHR1	37	46
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	CACNA1I	15	42
O=C(O)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167099	DF	On-Demand	Anodyne	CYP2J2	42	29
COc1cncc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)c1	ZINC000872167106	EE	On-Demand	Anodyne	DRD4	15	41
CNS(=O)(=O)c1ccc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872167108	GD	On-Demand	Anodyne	DRD4	18	44
CNS(=O)(=O)c1ccc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872167108	GD	On-Demand	Anodyne	CPT1A	40	36
CNS(=O)(=O)c1ccc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872167108	GD	On-Demand	Anodyne	CPT1B	45	36
CNS(=O)(=O)c1ccc(CN2CCc3c(C(=O)O)ccc(OC)c3C2)cc1	ZINC000872167108	GD	On-Demand	Anodyne	NOD2	41	38
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	DRD2	18	43
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	HRH2	15	50
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	SLC6A1	56	34
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	HRH1	28	54
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	LTA4H	31	40
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	HTR7	18	47
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	ABCB1	16	45
O=C(O)c1ccccc1OCCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167109	EE	On-Demand	Anodyne	CYP2J2	46	32
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	DRD2	18	43
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	HRH2	15	50
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	SLC6A1	56	34
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	HRH1	28	54
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	LTA4H	31	40
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	HTR7	18	47
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	ABCB1	16	45
O=C(O)c1ccccc1OCCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167110	EE	On-Demand	Anodyne	CYP2J2	46	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cc(C(=O)O)cs1	ZINC000872167112	EJ	On-Demand	Anodyne	MDM2	141	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccccc1C(=O)O	ZINC000872167122	EJ	On-Demand	Anodyne	MDM2	137	35
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)c(F)c1	ZINC000872167124	DF	On-Demand	Anodyne	SIGMAR1	15	41
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)c(F)c1	ZINC000872167125	DF	On-Demand	Anodyne	SIGMAR1	15	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccsc1C(=O)O	ZINC000872167127	EJ	On-Demand	Anodyne	MDM2	126	33
CN(CCOc1ccccc1C(=O)O)CC(C)(C)S(C)(=O)=O	ZINC000872167133	ED	On-Demand	Anodyne	SLC6A9	22	41
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000872167134	EG	On-Demand	Anodyne	DRD2	17	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000872167134	EG	On-Demand	Anodyne	DRD3	15	40
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167135	GE	On-Demand	Anodyne	ACOX1	56	31
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167135	GE	On-Demand	Anodyne	ABCB1	54	43
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167136	GE	On-Demand	Anodyne	ACOX1	56	31
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167136	GE	On-Demand	Anodyne	ABCB1	54	43
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167137	GE	On-Demand	Anodyne	ACOX1	56	31
C[C@@H]1CN(C[C@@H](O)COc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167137	GE	On-Demand	Anodyne	ABCB1	54	43
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167138	GE	On-Demand	Anodyne	ACOX1	56	31
C[C@@H]1CN(C[C@H](O)COc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167138	GE	On-Demand	Anodyne	ABCB1	54	43
COc1ccc(C(=O)O)c2c1CN(CCn1ccnc1)CC2	ZINC000872167141	DD	On-Demand	Anodyne	TBXAS1	57	41
COc1ccc(C(=O)O)c2c1CN(CCn1ccnc1)CC2	ZINC000872167141	DD	On-Demand	Anodyne	QPCT	26	42
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1C[C@H]1c1ccccc1)CC2	ZINC000872167146	EH	On-Demand	Anodyne	DRD4	17	51
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1C[C@H]1c1ccccc1)CC2	ZINC000872167146	EH	On-Demand	Anodyne	CCR5	18	43
COc1ccc(C(=O)O)c2c1CN(CCc1ncc(C)cc1C)CC2	ZINC000872167165	EG	On-Demand	Anodyne	ABCB1B	60	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ncccc1C(=O)O	ZINC000872167183	EI	On-Demand	Anodyne	MDM2	120	34
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ncccc1C(=O)O	ZINC000872167183	EI	On-Demand	Anodyne	G2YM83_BOTF4	50	30
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1F	ZINC000872167190	DD	On-Demand	Anodyne	ABCB1	62	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1F	ZINC000872167191	DD	On-Demand	Anodyne	ABCB1	62	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1F	ZINC000872167192	DD	On-Demand	Anodyne	ABCB1	62	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1F	ZINC000872167193	DD	On-Demand	Anodyne	ABCB1	62	40
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167206	FG	On-Demand	Anodyne	RBP4	62	40
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000872167207	FG	On-Demand	Anodyne	RBP4	62	40
O=C(O)[C@H](c1ccccc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000872167208	FG	On-Demand	Anodyne	RBP4	62	40
O=C(O)[C@@H](c1ccccc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167209	FG	On-Demand	Anodyne	RBP4	62	40
CCn1c(CN(C)CC(C)(C)S(C)(=O)=O)nc2cc(C(=O)O)ccc21	ZINC000872167221	FE	On-Demand	Anodyne	CNR2	17	40
O=C(O)c1cccc(Cl)c1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167222	EG	On-Demand	Anodyne	SIGMAR1	19	42
O=C(O)c1cccc(Cl)c1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167223	EG	On-Demand	Anodyne	SIGMAR1	19	42
COc1ccc(C(=O)O)c2c1CN(CCCn1ccnc1C)CC2	ZINC000872167244	EE	On-Demand	Anodyne	ABCB1B	41	32
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872167258	FH	On-Demand	Anodyne	HTR1A	22	45
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872167258	FH	On-Demand	Anodyne	DRD2	20	45
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872167258	FH	On-Demand	Anodyne	SIGMAR1	21	46
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872167258	FH	On-Demand	Anodyne	MTNR1B	27	41
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872167258	FH	On-Demand	Anodyne	EBP	33	42
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCc3ccccc31)CC2	ZINC000872167259	FH	On-Demand	Anodyne	HTR1A	22	45
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCc3ccccc31)CC2	ZINC000872167259	FH	On-Demand	Anodyne	DRD2	20	45
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCc3ccccc31)CC2	ZINC000872167259	FH	On-Demand	Anodyne	SIGMAR1	21	46
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCc3ccccc31)CC2	ZINC000872167259	FH	On-Demand	Anodyne	MTNR1B	27	41
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCc3ccccc31)CC2	ZINC000872167259	FH	On-Demand	Anodyne	EBP	33	42
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	DRD2	15	46
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	DRD4	40	44
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	ACHE	33	42
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	SIGMAR1	35	40
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	CCR3	23	41
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167260	DF	On-Demand	Anodyne	CCR2	18	42
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	DRD2	15	46
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	DRD4	40	44
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	ACHE	33	42
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	SIGMAR1	35	40
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	CCR3	23	41
C[C@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167261	DF	On-Demand	Anodyne	CCR2	18	42
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	DRD2	15	46
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	DRD4	40	44
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	SIGMAR1	35	40
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	CCR3	23	41
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872167262	DF	On-Demand	Anodyne	CCR2	18	42
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	DRD2	15	46
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	DRD4	40	44
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	SIGMAR1	35	40
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	CCR3	23	41
C[C@@H]1CN(Cc2cccc(C(=O)O)c2)CC[C@H](C(F)(F)F)O1	ZINC000872167263	DF	On-Demand	Anodyne	CCR2	18	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1noc(CCCC(=O)O)n1	ZINC000872167267	GH	On-Demand	Anodyne	MDM2	94	33
O=C(O)Cc1ccccc1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167268	DE	On-Demand	Anodyne	SIGMAR1	28	42
O=C(O)Cc1ccccc1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167269	DE	On-Demand	Anodyne	SIGMAR1	28	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167280	GG	On-Demand	Anodyne	CHRM1	17	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167280	GG	On-Demand	Anodyne	SLC6A3	58	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167280	GG	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167280	GG	On-Demand	Anodyne	Q8WSF8_APLCA	38	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167281	GG	On-Demand	Anodyne	CHRM1	17	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167281	GG	On-Demand	Anodyne	SLC6A3	58	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167281	GG	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167281	GG	On-Demand	Anodyne	Q8WSF8_APLCA	38	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167282	GG	On-Demand	Anodyne	CHRM1	17	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167282	GG	On-Demand	Anodyne	SLC6A3	58	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167282	GG	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167282	GG	On-Demand	Anodyne	Q8WSF8_APLCA	38	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167283	GG	On-Demand	Anodyne	CHRM1	17	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167283	GG	On-Demand	Anodyne	SLC6A3	58	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167283	GG	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872167283	GG	On-Demand	Anodyne	Q8WSF8_APLCA	38	43
COc1ccc(C(=O)O)c2c1CN(CCc1ccncc1C)CC2	ZINC000872167289	EF	On-Demand	Anodyne	ABCB1B	41	34
O=C(O)c1ccccc1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167294	DF	On-Demand	Anodyne	DRD4	20	40
O=C(O)c1ccccc1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167294	DF	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)c1ccccc1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167295	DF	On-Demand	Anodyne	DRD4	20	40
O=C(O)c1ccccc1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167295	DF	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)c1cc2cc(CN3CCO[C@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167304	EG	On-Demand	Anodyne	DRD4	22	41
O=C(O)c1cc2cc(CN3CCO[C@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167304	EG	On-Demand	Anodyne	CCR3	22	41
O=C(O)c1cc2cc(CN3CCO[C@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167304	EG	On-Demand	Anodyne	MCHR1	26	41
O=C(O)c1cc2cc(CN3CCO[C@@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167305	EG	On-Demand	Anodyne	DRD4	22	41
O=C(O)c1cc2cc(CN3CCO[C@@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167305	EG	On-Demand	Anodyne	CCR3	22	41
O=C(O)c1cc2cc(CN3CCO[C@@H](C(F)(F)F)CC3)ccc2o1	ZINC000872167305	EG	On-Demand	Anodyne	MCHR1	26	41
CCCOc1cccc(CN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872167322	DG	On-Demand	Anodyne	HRH2	49	45
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cccc(C(=O)O)c1	ZINC000872167325	EJ	On-Demand	Anodyne	DRD4	21	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cccc(C(=O)O)c1	ZINC000872167325	EJ	On-Demand	Anodyne	SIGMAR1	18	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cccc(C(=O)O)c1	ZINC000872167325	EJ	On-Demand	Anodyne	MDM2	150	37
COc1ccc(C(=O)O)c2c1CN(CC(=O)NCc1cccnc1)CC2	ZINC000872167330	FD	On-Demand	Anodyne	NAMPT	56	38
COc1ccc(C(=O)O)c2c1CN(CCCC1CC1)CC2	ZINC000872167341	CF	On-Demand	Anodyne	HTR1A	20	44
COc1ccc(C(=O)O)c2c1CN(CCCC1CC1)CC2	ZINC000872167341	CF	On-Demand	Anodyne	HTR4	28	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CC1)CC2	ZINC000872167341	CF	On-Demand	Anodyne	SIGMAR1	16	41
COc1ccc(C(=O)O)c2c1CN(CCCc1ccncc1)CC2	ZINC000872167344	EF	On-Demand	Anodyne	DRD2	15	45
COc1ccc(C(=O)O)c2c1CN(CCCc1ccncc1)CC2	ZINC000872167344	EF	On-Demand	Anodyne	CHRM5	20	40
COc1ccc(C(=O)O)c2c1CN(CCCc1ccncc1)CC2	ZINC000872167344	EF	On-Demand	Anodyne	SIGMAR1	18	45
O=C(O)[C@@H]1CN(Cc2cccc(CN3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872167345	FG	On-Demand	Anodyne	DRD2	19	47
O=C(O)[C@@H]1CN(Cc2cccc(CN3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872167345	FG	On-Demand	Anodyne	HRH2	34	42
O=C(O)[C@@H]1CN(Cc2cccc(CN3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872167345	FG	On-Demand	Anodyne	SLC6A1	66	33
O=C(O)[C@@H]1CN(Cc2cccc(CN3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872167345	FG	On-Demand	Anodyne	HRH3	24	40
O=C(O)[C@@H]1CN(Cc2cccc(CN3CCCCC3)c2)C[C@H]1C(F)(F)F	ZINC000872167345	FG	On-Demand	Anodyne	SIGMAR1	42	42
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872167346	EH	On-Demand	Anodyne	HRH3	26	43
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872167346	EH	On-Demand	Anodyne	SIGMAR1	34	40
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCOCC3)c1)CC2	ZINC000872167358	GF	On-Demand	Anodyne	DRD2	17	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCOCC3)c1)CC2	ZINC000872167358	GF	On-Demand	Anodyne	DRD4	30	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCOCC3)c1)CC2	ZINC000872167358	GF	On-Demand	Anodyne	ACHE	18	43
O=C(O)[C@]12CCC[C@H]1N(C[C@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167367	FF	On-Demand	Anodyne	DRD4	29	41
O=C(O)[C@]12CCC[C@H]1N(C[C@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167367	FF	On-Demand	Anodyne	SIGMAR1	41	39
O=C(O)[C@]12CCC[C@H]1N(C[C@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167367	FF	On-Demand	Anodyne	PDE8B	20	41
O=C(O)[C@]12CCC[C@H]1N(C[C@@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167368	FF	On-Demand	Anodyne	DRD4	29	41
O=C(O)[C@]12CCC[C@H]1N(C[C@@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167368	FF	On-Demand	Anodyne	SIGMAR1	41	39
O=C(O)[C@]12CCC[C@H]1N(C[C@@H]1CN(Cc3ccccc3)CCCO1)CC2	ZINC000872167368	FF	On-Demand	Anodyne	PDE8B	20	41
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(S(=O)(=O)NC3CC3)cc1)CC2	ZINC000872167374	FD	On-Demand	Anodyne	SFRP1	73	31
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(S(=O)(=O)NC3CC3)cc1)CC2	ZINC000872167374	FD	On-Demand	Anodyne	WNT3	45	37
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872167382	EJ	On-Demand	Anodyne	ACHE	15	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872167382	EJ	On-Demand	Anodyne	ADRB3	16	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccc(C(=O)O)cc1	ZINC000872167382	EJ	On-Demand	Anodyne	MDM2	154	37
COc1ccc(C(=O)O)c2c1CN(CCc1cccc(OC(F)(F)F)c1)CC2	ZINC000872167384	GH	On-Demand	Anodyne	HCRTR1	16	41
COc1ccc(C(=O)O)c2c1CN(CCc1cccc(OC(F)(F)F)c1)CC2	ZINC000872167384	GH	On-Demand	Anodyne	HCRTR2	21	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1nc(C(=O)O)cs1	ZINC000872167391	FI	On-Demand	Anodyne	PTGER1	46	45
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1nc(C(=O)O)cs1	ZINC000872167391	FI	On-Demand	Anodyne	MDM2	114	45
CN(Cc1csc(-c2ccc(C(=O)O)cc2)n1)CC(C)(C)S(C)(=O)=O	ZINC000872167393	GF	On-Demand	Anodyne	AVPR1B	15	51
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(OCc3ccccn3)c1)CC2	ZINC000872167436	FG	On-Demand	Anodyne	HRH2	40	38
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(OCc3ccccn3)c1)CC2	ZINC000872167436	FG	On-Demand	Anodyne	PTGIR	16	42
CO[C@@H](Cc1ccccc1)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872167440	DF	On-Demand	Anodyne	ACE	45	36
CO[C@@H](Cc1ccccc1)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872167440	DF	On-Demand	Anodyne	TIMP3	70	38
CO[C@@H](Cc1ccccc1)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872167440	DF	On-Demand	Anodyne	SLC12A5	40	35
O=C(O)[C@@H]1CN(CCCCc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872167447	EH	On-Demand	Anodyne	GRM3	15	47
O=C(O)[C@@H]1CN(CCCCc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC000872167447	EH	On-Demand	Anodyne	SIGMAR1	22	45
O=C(O)[C@@H]1CN(Cc2ccc(-c3ccccn3)nc2)C[C@H]1C(F)(F)F	ZINC000872167470	FF	On-Demand	Anodyne	S1PR1	22	42
O=C(O)c1ccccc1CCN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872167474	DF	On-Demand	Anodyne	CYP2J2	46	32
O=C(O)c1ccccc1CCN1CCO[C@H](C(F)(F)F)CC1	ZINC000872167475	DF	On-Demand	Anodyne	CYP2J2	46	32
O=C(O)[C@]12CCC[C@H]1N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2	ZINC000872167486	GJ	On-Demand	Anodyne	TACR1	65	38
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccc(Cl)c(Cl)c1)CC2	ZINC000872167503	FJ	On-Demand	Anodyne	SIGMAR1	16	42
CO[C@@H](CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1)c1ccc(F)cc1	ZINC000872167506	EF	On-Demand	Anodyne	LEF	32	42
COc1ccc(-c2noc([C@@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167516	GG	On-Demand	Anodyne	S1PR4	22	40
COc1ccc(-c2noc([C@@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167516	GG	On-Demand	Anodyne	S1PR1	24	40
COc1ccc(-c2noc([C@@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167516	GG	On-Demand	Anodyne	S1PR5	43	37
COc1ccc(-c2noc([C@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167517	GG	On-Demand	Anodyne	S1PR4	22	40
COc1ccc(-c2noc([C@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167517	GG	On-Demand	Anodyne	S1PR1	24	40
COc1ccc(-c2noc([C@H](C)N3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872167517	GG	On-Demand	Anodyne	S1PR5	43	37
O=C(O)[C@@H]1CN(Cc2cnc3ccccc3c2)C[C@H]1C(F)(F)F	ZINC000872167521	DF	On-Demand	Anodyne	S1PR1	27	40
O=C(O)[C@@H]1CN(CCCN2CCCCC2)C[C@H]1C(F)(F)F	ZINC000872167523	DE	On-Demand	Anodyne	HRH3	23	40
O=C(O)[C@@H]1CN(C[C@@H]2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872167531	EF	On-Demand	Anodyne	PTGIR	44	34
O=C(O)[C@@H]1CN(C[C@H]2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872167532	EF	On-Demand	Anodyne	PTGIR	44	34
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	HTR1A	36	42
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	DRD2	33	42
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	ACHE	15	40
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	HTR4	24	43
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	HRH3	33	43
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	SIGMAR1	32	42
COc1ccc(C(=O)O)c2c1CN(CCCN1CCCCC1)CC2	ZINC000872167553	EF	On-Demand	Anodyne	EBP	26	42
COc1ccc(C(=O)O)c2c1CN([C@H](C)CN1CCOCC1)CC2	ZINC000872167562	ED	On-Demand	Anodyne	PTGDS	32	43
COc1ccc(C(=O)O)c2c1CN([C@@H](C)CN1CCOCC1)CC2	ZINC000872167563	ED	On-Demand	Anodyne	PTGDS	32	43
C[C@@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167569	GH	On-Demand	Anodyne	PDE8B	58	34
O=C(O)[C@@H]1CN(Cc2ccc(-c3cccs3)cc2)C[C@H]1C(F)(F)F	ZINC000872167571	FI	On-Demand	Anodyne	S1PR1	24	40
O=C(O)[C@@H]1CN(Cc2ccc(-c3cccs3)cc2)C[C@H]1C(F)(F)F	ZINC000872167571	FI	On-Demand	Anodyne	S1PR5	39	40
C[C@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167572	GH	On-Demand	Anodyne	PDE8B	58	34
C[C@@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167575	GH	On-Demand	Anodyne	PDE8B	58	34
C[C@H]1CN(Cc2oc(-c3ccccc3)nc2C(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167577	GH	On-Demand	Anodyne	PDE8B	58	34
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	DRD4	50	44
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	ACHE	40	45
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	LTA4H	29	45
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	SIGMAR1	49	46
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	SSTR5	42	35
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	CCR3	15	42
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	SLC6A5	29	44
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167579	DF	On-Demand	Anodyne	CYP2J2	46	33
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	DRD4	50	44
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	ACHE	40	45
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	LTA4H	29	45
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	SIGMAR1	49	46
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	SSTR5	42	35
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	CCR3	15	42
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	SLC6A5	29	44
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167581	DF	On-Demand	Anodyne	CYP2J2	46	33
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCc1ccccc1C(=O)O	ZINC000872167595	FJ	On-Demand	Anodyne	MDM2	121	34
C/C(=C\CN1CC[C@@H](c2cccc(Cl)c2)C1(C)C)C(=O)O	ZINC000872167599	DH	On-Demand	Anodyne	MDM2	147	37
C/C(=C\CN1CC[C@H](c2cccc(Cl)c2)C1(C)C)C(=O)O	ZINC000872167600	DH	On-Demand	Anodyne	MDM2	147	37
C/C(=C/CN1CC[C@H](c2cccc(Cl)c2)C1(C)C)C(=O)O	ZINC000872167601	DH	On-Demand	Anodyne	MDM2	147	37
C/C(=C/CN1CC[C@@H](c2cccc(Cl)c2)C1(C)C)C(=O)O	ZINC000872167603	DH	On-Demand	Anodyne	MDM2	147	37
C[C@@H]1CN(Cc2ccccc2CC(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167622	EF	On-Demand	Anodyne	SLC6A1	43	32
C[C@H]1CN(Cc2ccccc2CC(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167623	EF	On-Demand	Anodyne	SLC6A1	43	32
C[C@@H]1CN(Cc2ccccc2CC(=O)O)CC[C@@H](C(F)(F)F)O1	ZINC000872167625	EF	On-Demand	Anodyne	SLC6A1	43	32
C[C@H]1CN(Cc2ccccc2CC(=O)O)CC[C@H](C(F)(F)F)O1	ZINC000872167629	EF	On-Demand	Anodyne	SLC6A1	43	32
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872167640	EE	On-Demand	Anodyne	CCR5	19	41
CCOc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-]	ZINC000872167654	FF	On-Demand	Bother	SSTR5	57	36
O=C(O)[C@H]1CN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872167667	FF	On-Demand	Anodyne	LIPG	44	32
O=C(O)[C@H]1CN(C[C@H](O)c2cccc(C(F)(F)F)c2)C[C@@H]1C(F)(F)F	ZINC000872167669	FF	On-Demand	Anodyne	LIPG	44	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCCCCC(=O)O	ZINC000872167670	DJ	On-Demand	Anodyne	PTGER4	23	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCCCCC(=O)O	ZINC000872167670	DJ	On-Demand	Anodyne	MDM2	150	38
COc1ccc(-c2cnc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)o2)cc1	ZINC000872167672	FG	On-Demand	Anodyne	S1PR1	24	42
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1F)CC2	ZINC000872167689	EG	On-Demand	Anodyne	DRD3	21	40
COc1ccc(C(=O)O)c2c1CN(CCc1ccccc1F)CC2	ZINC000872167689	EG	On-Demand	Anodyne	ABCB1	22	40
CC(=O)c1cccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872167698	DF	On-Demand	Anodyne	CHRM3	15	40
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872167699	EF	On-Demand	Bother	HRH3	40	39
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1oncc1C(=O)O	ZINC000872167707	EH	On-Demand	Anodyne	MDM2	119	33
O=C(O)[C@@H]1CN(CCc2ccccc2F)C[C@H]1C(F)(F)F	ZINC000872167708	DF	On-Demand	Anodyne	SLC6A1	43	36
O=C(O)[C@@H]1CN(CCc2ccccc2F)C[C@H]1C(F)(F)F	ZINC000872167708	DF	On-Demand	Anodyne	CACNA1G	16	43
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	DRD4	37	43
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	LTA4H	23	41
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	SIGMAR1	35	41
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	SLC18A3	16	40
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	MLNR	60	39
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	S1PR5	37	40
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167711	DF	On-Demand	Anodyne	CYP2J2	47	34
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	DRD4	37	43
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	LTA4H	23	41
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	SIGMAR1	35	41
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	SLC18A3	16	40
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	MLNR	60	39
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	S1PR5	37	40
C[C@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167714	DF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	DRD4	37	43
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	LTA4H	23	41
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	SIGMAR1	35	41
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	SLC18A3	16	40
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	MLNR	60	39
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	S1PR5	37	40
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000872167716	DF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	DRD4	37	43
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	LTA4H	23	41
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	SIGMAR1	35	41
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	SLC18A3	16	40
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	MLNR	60	39
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	S1PR5	37	40
C[C@@H]1CN(Cc2ccc(C(=O)O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000872167717	DF	On-Demand	Anodyne	CYP2J2	47	34
CN(CCOc1cccc(C(=O)O)c1)CC(C)(C)S(C)(=O)=O	ZINC000872167732	ED	On-Demand	Anodyne	PLA2G4B	49	45
CN(CCOc1cccc(C(=O)O)c1)CC(C)(C)S(C)(=O)=O	ZINC000872167732	ED	On-Demand	Anodyne	SQLE	41	34
CN(CCOc1cccc(C(=O)O)c1)CC(C)(C)S(C)(=O)=O	ZINC000872167732	ED	On-Demand	Anodyne	AKR1C3	40	34
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1Cc3ccccc31)CC2	ZINC000872167738	DG	On-Demand	Anodyne	HTR1A	21	43
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1Cc3ccccc31)CC2	ZINC000872167738	DG	On-Demand	Anodyne	MTNR1A	28	41
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1Cc3ccccc31)CC2	ZINC000872167738	DG	On-Demand	Anodyne	MTNR1B	28	41
COc1ccc(C(=O)O)c2c1CN(C[C@H]1Cc3ccccc31)CC2	ZINC000872167740	DG	On-Demand	Anodyne	HTR1A	21	43
COc1ccc(C(=O)O)c2c1CN(C[C@H]1Cc3ccccc31)CC2	ZINC000872167740	DG	On-Demand	Anodyne	MTNR1A	28	41
COc1ccc(C(=O)O)c2c1CN(C[C@H]1Cc3ccccc31)CC2	ZINC000872167740	DG	On-Demand	Anodyne	MTNR1B	28	41
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	ESR1	42	37
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	DRD2	20	43
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	DRD4	43	32
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	HRH2	37	52
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	HRH1	26	52
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	LTA4H	40	42
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	HRH3	32	45
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	EPHX2	26	44
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1cccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872167763	EE	On-Demand	Anodyne	MEN1	42	33
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	ESR1	42	37
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	DRD2	20	43
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	DRD4	43	32
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	HRH2	37	52
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	HRH1	26	52
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	LTA4H	40	42
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	HRH3	32	45
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	EPHX2	26	44
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)c1cccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872167765	EE	On-Demand	Anodyne	MEN1	42	33
O=C(O)c1cccc(-c2nc(CN3CCO[C@H](C(F)(F)F)CC3)cs2)c1	ZINC000872167766	GH	On-Demand	Anodyne	ETHR	46	33
O=C(O)c1cccc(-c2nc(CN3CCO[C@@H](C(F)(F)F)CC3)cs2)c1	ZINC000872167767	GH	On-Demand	Anodyne	ETHR	46	33
COc1ccccc1[C@@H]1CSCCCN1C/C=C(\C)C(=O)O	ZINC000872167772	DG	On-Demand	Anodyne	ACKR3	43	32
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCc3ccccc3C1)CC2	ZINC000872167773	FH	On-Demand	Anodyne	HTR1A	24	51
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCc3ccccc3C1)CC2	ZINC000872167773	FH	On-Demand	Anodyne	DRD2	21	51
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCc3ccccc3C1)CC2	ZINC000872167773	FH	On-Demand	Anodyne	DRD3	15	40
COc1ccc(C(=O)O)c2c1CN(C[C@H]1CCc3ccccc3C1)CC2	ZINC000872167773	FH	On-Demand	Anodyne	PTGIR	52	39
COc1ccccc1[C@@H]1CSCCCN1C/C=C(/C)C(=O)O	ZINC000872167774	DG	On-Demand	Anodyne	ACKR3	43	32
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCc3ccccc3C1)CC2	ZINC000872167775	FH	On-Demand	Anodyne	HTR1A	24	51
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCc3ccccc3C1)CC2	ZINC000872167775	FH	On-Demand	Anodyne	DRD2	21	51
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCc3ccccc3C1)CC2	ZINC000872167775	FH	On-Demand	Anodyne	DRD3	15	40
COc1ccc(C(=O)O)c2c1CN(C[C@@H]1CCc3ccccc3C1)CC2	ZINC000872167775	FH	On-Demand	Anodyne	PTGIR	52	39
COc1ccc(C(=O)O)c2c1CN(CCCN(C)c1ccccc1)CC2	ZINC000872167777	FG	On-Demand	Anodyne	DRD2	25	41
COc1ccc(C(=O)O)c2c1CN(CCCN(C)c1ccccc1)CC2	ZINC000872167777	FG	On-Demand	Anodyne	HTR7	32	41
COc1ccc(C(=O)O)c2c1CN(CCCN(C)c1ccccc1)CC2	ZINC000872167777	FG	On-Demand	Anodyne	SIGMAR1	15	40
COc1ccc(C(=O)O)c2c1CN(CCCN(C)c1ccccc1)CC2	ZINC000872167777	FG	On-Demand	Anodyne	ABCB1B	53	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CC(=O)N1CCC(C(=O)O)CC1	ZINC000872167781	GG	On-Demand	Anodyne	FDFT1	22	44
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CC(=O)N1CCC(C(=O)O)CC1	ZINC000872167781	GG	On-Demand	Anodyne	MDM2	113	44
O=C(O)[C@@H]1CN(CCCSCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872167822	EH	On-Demand	Anodyne	CACNA2D1	24	42
COCCc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872167824	GD	On-Demand	Anodyne	ADRB1	28	46
COCCc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872167824	GD	On-Demand	Anodyne	ABCB1	61	42
COCCc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872167825	GD	On-Demand	Anodyne	ADRB1	28	46
COCCc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872167825	GD	On-Demand	Anodyne	ABCB1	61	42
O=C(O)[C@@H]1CN(Cc2nc(Cc3cccc(F)c3)no2)C[C@H]1C(F)(F)F	ZINC000872167829	FE	On-Demand	Anodyne	S1PR1	18	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1nc(C(=O)O)co1	ZINC000872167838	EH	On-Demand	Anodyne	MDM2	126	35
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cn2)C[C@H]1C(F)(F)F	ZINC000872167871	EF	On-Demand	Anodyne	LIPG	45	38
COc1ccc(C(=O)O)c2c1CN(Cc1cccnc1N)CC2	ZINC000872167886	DD	On-Demand	Anodyne	DRTS_TOXGO	15	42
COc1ccc(C(=O)O)c2c1CN(Cc1cccnc1N)CC2	ZINC000872167886	DD	On-Demand	Anodyne	SLC9A1	43	29
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1C)CC2	ZINC000872167908	EH	On-Demand	Anodyne	DRD2	30	41
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1C)CC2	ZINC000872167908	EH	On-Demand	Anodyne	CHRM5	19	42
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1C)CC2	ZINC000872167908	EH	On-Demand	Anodyne	SIGMAR1	22	43
COc1ccc(C(=O)O)c2c1CN(CCCc1ccccc1C)CC2	ZINC000872167908	EH	On-Demand	Anodyne	ABCB1B	59	36
COc1ccc(C(=O)O)c2c1CN(CCCc1c(F)cccc1F)CC2	ZINC000872167913	FH	On-Demand	Anodyne	HTR1A	22	40
COc1ccc(C(=O)O)c2c1CN(CCCc1c(F)cccc1F)CC2	ZINC000872167913	FH	On-Demand	Anodyne	DRD2	23	41
COc1ccc(C(=O)O)c2c1CN(CCCc1c(F)cccc1F)CC2	ZINC000872167913	FH	On-Demand	Anodyne	ABCB1B	51	35
COc1ccc(C(=O)O)c2c1CN(CCCN1CCN(C(C)C)CC1)CC2	ZINC000872167932	GE	On-Demand	Anodyne	DRD2	29	41
COc1ccc(C(=O)O)c2c1CN(CCCN1CCN(C(C)C)CC1)CC2	ZINC000872167932	GE	On-Demand	Anodyne	DRD3	39	41
O=C(O)[C@@H]1CN(Cc2nnc(-c3ccccc3)s2)C[C@H]1C(F)(F)F	ZINC000872167935	FF	On-Demand	Anodyne	S1PR3	15	41
O=C(O)[C@@H]1CN(Cc2nnc(-c3ccccc3)s2)C[C@H]1C(F)(F)F	ZINC000872167935	FF	On-Demand	Anodyne	S1PR1	29	41
O=C(O)[C@@H]1CN(Cc2nnc(-c3ccccc3)s2)C[C@H]1C(F)(F)F	ZINC000872167935	FF	On-Demand	Anodyne	S1PR5	24	41
O=C(O)c1ccc(OC[C@@H](O)CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167941	FD	On-Demand	Anodyne	ACOX1	61	32
O=C(O)c1ccc(OC[C@@H](O)CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167941	FD	On-Demand	Anodyne	ABCB1	64	47
O=C(O)c1ccc(OC[C@@H](O)CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167942	FD	On-Demand	Anodyne	ACOX1	61	32
O=C(O)c1ccc(OC[C@@H](O)CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167942	FD	On-Demand	Anodyne	ABCB1	64	47
O=C(O)c1ccc(OC[C@H](O)CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167943	FD	On-Demand	Anodyne	ACOX1	61	32
O=C(O)c1ccc(OC[C@H](O)CN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872167943	FD	On-Demand	Anodyne	ABCB1	64	47
O=C(O)c1ccc(OC[C@H](O)CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167944	FD	On-Demand	Anodyne	ACOX1	61	32
O=C(O)c1ccc(OC[C@H](O)CN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872167944	FD	On-Demand	Anodyne	ABCB1	64	47
COc1ccc(C(=O)O)c2c1CN(CCSC1CCCCC1)CC2	ZINC000872167945	EH	On-Demand	Anodyne	QRFPR	40	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCc1cn(CC(=O)O)nn1	ZINC000872167947	FF	On-Demand	Anodyne	MDM2	98	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C[C@](C)(O)C(=O)O	ZINC000872167963	DF	On-Demand	Anodyne	MDM2	161	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C[C@@](C)(O)C(=O)O	ZINC000872167966	DF	On-Demand	Anodyne	MDM2	161	40
O=C(O)[C@@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167968	GE	On-Demand	Anodyne	DRD4	27	45
O=C(O)[C@@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167968	GE	On-Demand	Anodyne	SLC6A1	43	32
O=C(O)[C@@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167968	GE	On-Demand	Anodyne	FABP4	41	39
O=C(O)[C@@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167968	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)[C@@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167971	GE	On-Demand	Anodyne	DRD4	27	45
O=C(O)[C@@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167971	GE	On-Demand	Anodyne	SLC6A1	43	32
O=C(O)[C@@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167971	GE	On-Demand	Anodyne	FABP4	41	39
O=C(O)[C@@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C[C@H]1C(F)(F)F	ZINC000872167971	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)[C@]12CCC[C@H]1N(Cc1nc3ccccc3s1)CC2	ZINC000872167981	DG	On-Demand	Anodyne	AKR1B1	32	42
O=C(O)[C@@H]1CN(CCOC(c2ccccc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872167989	GH	On-Demand	Anodyne	SLC6A1	34	44
O=C(O)[C@@H]1CN(CCOC(c2ccccc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872167989	GH	On-Demand	Anodyne	SLC6A4	29	51
O=C(O)[C@@H]1CN(CCOC(c2ccccc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872167989	GH	On-Demand	Anodyne	SLC6A3	79	53
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	SLC6A1	45	32
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	HRH3	34	48
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	SIGMAR1	36	42
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	S1PR4	21	41
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	MLNR	42	35
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	S1PR1	29	42
O=C(O)[C@@H]1CN(Cc2ccc(CN3CCCCC3)cc2)C[C@H]1C(F)(F)F	ZINC000872167990	FG	On-Demand	Anodyne	S1PR5	43	41
O=C(O)[C@]12CCC[C@H]1N(Cc1ccccc1OCc1ccccc1)CC2	ZINC000872167993	FI	On-Demand	Anodyne	PTGER1	46	41
O=C(O)[C@]12CCC[C@H]1N(Cc1nc(-c3ccccc3)cs1)CC2	ZINC000872167999	EH	On-Demand	Anodyne	CPT1A	27	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1csc(C(=O)O)c1	ZINC000872168003	EJ	On-Demand	Anodyne	MDM2	117	34
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cc(C(=O)O)co1	ZINC000872168012	EI	On-Demand	Anodyne	MDM2	139	35
CS(=O)(=O)c1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168013	GD	On-Demand	Anodyne	HRH3	15	40
CS(=O)(=O)c1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168013	GD	On-Demand	Anodyne	NR1H3	48	38
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccoc1C(=O)O	ZINC000872168018	EI	On-Demand	Anodyne	MDM2	124	35
Cn1ccnc1COc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168041	GF	On-Demand	Anodyne	S1PR5	29	43
O=C(O)c1nc(-c2ccccc2)oc1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872168042	FG	On-Demand	Anodyne	PDE8B	53	34
O=C(O)c1nc(-c2ccccc2)oc1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872168045	FG	On-Demand	Anodyne	PDE8B	53	34
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc3c(c1)CCC3)CC2	ZINC000872168066	CG	On-Demand	Anodyne	OPRK1	21	40
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	HTR1A	92	50
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	DRD2	55	50
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	DRD4	34	42
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	ADRA1D	19	44
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	HTR2A	57	50
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	HTR2C	24	41
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	ADRA1A	35	44
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	ADRA1B	24	44
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	DRD3	62	45
O=C(O)[C@]12CCC[C@H]1N(CCCN1CCN(c3ccccc3)CC1)CC2	ZINC000872168093	FF	On-Demand	Anodyne	HTR7	95	45
CCCOc1cccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168094	EG	On-Demand	Anodyne	HRH2	40	45
CCCOc1cccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168094	EG	On-Demand	Anodyne	PLA2G4B	44	40
CCCOc1cccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168094	EG	On-Demand	Anodyne	S1PR1	29	43
CCCOc1cccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168094	EG	On-Demand	Anodyne	PDS	44	35
O=C(O)[C@@H]1CN(CCc2cccc(OC(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872168103	FG	On-Demand	Anodyne	SLC6A9	22	42
O=C(O)[C@@H]1CN(CCc2cccc(OC(F)(F)F)c2)C[C@H]1C(F)(F)F	ZINC000872168103	FG	On-Demand	Anodyne	CRTM	46	31
Cc1ccc(-c2cnc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)o2)cc1	ZINC000872168104	FG	On-Demand	Anodyne	S1PR1	15	40
O=C(O)[C@@H]1CN(CC/C=C/c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168106	DG	On-Demand	Anodyne	SLC6A1	53	36
O=C(O)[C@@H]1CN(CC/C=C\c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168107	DG	On-Demand	Anodyne	SLC6A1	53	36
CCOc1ccc(-c2nc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)co2)cc1	ZINC000872168111	GG	On-Demand	Anodyne	S1PR1	27	50
CCOc1ccc(-c2nc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)co2)cc1	ZINC000872168111	GG	On-Demand	Anodyne	S1PR5	35	50
O=C(O)[C@@H]1CN(Cc2ccc(OCc3ccccc3F)nc2)C[C@H]1C(F)(F)F	ZINC000872168112	GG	On-Demand	Anodyne	S1PR1	21	42
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccc(F)cc1)CC2	ZINC000872168122	FG	On-Demand	Anodyne	ABCB1B	48	38
COc1ccc(C(=O)O)c2c1CN(C[C@H](O)c1cccc3ccccc13)CC2	ZINC000872168128	GH	On-Demand	Anodyne	ABCB1B	45	31
O=C(O)[C@]12CCC[C@H]1N(CC1CCC(c3ccccc3)CC1)CC2	ZINC000872168134	EI	On-Demand	Anodyne	OPRM1	76	37
O=C(O)[C@]12CCC[C@H]1N(CC1CCC(c3ccccc3)CC1)CC2	ZINC000872168134	EI	On-Demand	Anodyne	OPRD1	63	37
O=C(O)[C@]12CCC[C@H]1N(CC1CCC(c3ccccc3)CC1)CC2	ZINC000872168134	EI	On-Demand	Anodyne	OPRK1	91	37
CCOc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168144	ED	On-Demand	Anodyne	SLC6A3	27	44
CCOc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168145	ED	On-Demand	Anodyne	SLC6A3	27	44
CCOc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168146	ED	On-Demand	Anodyne	SLC6A3	27	44
CCOc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168148	ED	On-Demand	Anodyne	SLC6A3	27	44
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	CHRM2	15	43
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	DRD2	26	45
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	DRD4	58	46
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	ACHE	38	46
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	DRD3	21	45
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	SIGMAR1	53	44
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	SLC18A3	26	46
COc1ccc(C(=O)O)c2c1CN([C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168149	FG	On-Demand	Anodyne	PDE11A	28	40
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	CHRM2	15	43
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	DRD2	26	45
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	DRD4	58	46
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	ACHE	38	46
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	DRD3	21	45
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	SIGMAR1	53	44
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	SLC18A3	26	46
COc1ccc(C(=O)O)c2c1CN([C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000872168150	FG	On-Demand	Anodyne	PDE11A	28	40
COc1ccc(C(=O)O)c2c1CN(CCOCC1CCC1)CC2	ZINC000872168178	DF	On-Demand	Anodyne	SLC6A1	56	32
COc1ccc(C(=O)O)c2c1CN(CCN1CCc3ccccc31)CC2	ZINC000872168196	FF	On-Demand	Anodyne	HTR1A	41	45
COc1ccc(C(=O)O)c2c1CN(CCN1CCc3ccccc31)CC2	ZINC000872168196	FF	On-Demand	Anodyne	DRD2	32	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCc3ccccc31)CC2	ZINC000872168196	FF	On-Demand	Anodyne	DRD4	20	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCc3ccccc31)CC2	ZINC000872168196	FF	On-Demand	Anodyne	DRD3	40	44
COc1ccc(C(=O)O)c2c1CN(CCN1CCc3ccccc31)CC2	ZINC000872168196	FF	On-Demand	Anodyne	ABCB1B	62	38
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1ccc(C(=O)O)o1	ZINC000872168219	EI	On-Demand	Anodyne	MDM2	126	34
C[C@H](c1nc(-c2cccs2)no1)N1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168235	FG	On-Demand	Anodyne	ETHR	55	44
O=C(O)[C@@H]1CN(Cc2ccc(-c3ccsc3)cc2)C[C@H]1C(F)(F)F	ZINC000872168240	FI	On-Demand	Anodyne	S1PR1	18	41
O=C(O)[C@@H]1CN(Cc2ccc(-c3ccsc3)cc2)C[C@H]1C(F)(F)F	ZINC000872168240	FI	On-Demand	Anodyne	S1PR5	39	41
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168248	EG	On-Demand	Anodyne	DRD4	47	38
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168248	EG	On-Demand	Anodyne	SIGMAR1	35	44
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168248	EG	On-Demand	Anodyne	MCHR1	35	40
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168251	EG	On-Demand	Anodyne	DRD4	47	38
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168251	EG	On-Demand	Anodyne	SIGMAR1	35	44
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1Cl	ZINC000872168251	EG	On-Demand	Anodyne	MCHR1	35	40
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168262	FE	On-Demand	Anodyne	ADRB2	15	48
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168262	FE	On-Demand	Anodyne	ADRB1	20	46
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168262	FE	On-Demand	Anodyne	HTR1A	18	51
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168262	FE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168262	FE	On-Demand	Anodyne	ABCB1	65	38
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168265	FE	On-Demand	Anodyne	ADRB2	15	48
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168265	FE	On-Demand	Anodyne	ADRB1	20	46
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168265	FE	On-Demand	Anodyne	HTR1A	18	51
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168265	FE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)C[C@@H]1C(F)(F)F	ZINC000872168265	FE	On-Demand	Anodyne	ABCB1	65	38
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	ESR1	21	42
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	PPARA	26	41
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	LTA4H	29	42
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	HRH3	23	47
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	MTNR1A	21	43
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	MTNR1B	26	43
COc1cccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168267	EE	On-Demand	Anodyne	CHRNA10	34	41
COc1ccc(C(=O)O)c2c1CN(CCOC1CCOCC1)CC2	ZINC000872168268	ED	On-Demand	Anodyne	LIPG	15	40
COc1ccc(C(=O)O)c2c1CN(CCCCn1ccnc1C)CC2	ZINC000872168270	EF	On-Demand	Anodyne	ABCB1B	51	33
Cc1ccccc1CCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168274	DG	On-Demand	Anodyne	SLC6A1	41	33
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1SC	ZINC000872168278	EG	On-Demand	Anodyne	S1PR1	23	43
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1SC	ZINC000872168278	EG	On-Demand	Anodyne	S1PR5	25	43
Cc1ccc2ccccc2c1CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168311	EH	On-Demand	Anodyne	KCNJ11	55	33
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168332	EH	On-Demand	Anodyne	HRH2	44	42
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168332	EH	On-Demand	Anodyne	HRH3	15	40
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168332	EH	On-Demand	Anodyne	SIGMAR1	41	40
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168332	EH	On-Demand	Anodyne	BDKRB1	41	40
COc1cccc(OC)c1OCCCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168350	GG	On-Demand	Anodyne	HTR1A	47	39
COc1cccc(OC)c1OCCCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168350	GG	On-Demand	Anodyne	DRD2	40	37
COc1cccc(OC)c1OCCCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168350	GG	On-Demand	Anodyne	DRD3	42	37
COc1cccc(OC)c1OCCCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168350	GG	On-Demand	Anodyne	HTR7	42	37
O=C(O)[C@@H]1CN(Cc2cc(-c3ccccc3Cl)on2)C[C@H]1C(F)(F)F	ZINC000872168360	FH	On-Demand	Anodyne	S1PR4	19	40
O=C(O)[C@@H]1CN(Cc2cc(-c3ccccc3Cl)on2)C[C@H]1C(F)(F)F	ZINC000872168360	FH	On-Demand	Anodyne	S1PR1	36	40
O=C(O)[C@@H]1CN(Cc2cc(-c3ccccc3Cl)on2)C[C@H]1C(F)(F)F	ZINC000872168360	FH	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)OCCO3)C[C@H]1C(F)(F)F	ZINC000872168377	EE	On-Demand	Anodyne	MCHR1	20	43
CCOc1ccccc1OCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168381	EF	On-Demand	Anodyne	SLC6A1	40	32
CCOc1ccccc1OCCN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168381	EF	On-Demand	Anodyne	HTR7	19	45
COc1ccccc1[C@@H]1CSCCCN1CCOc1cccc(C(=O)O)c1	ZINC000872168384	GH	On-Demand	Anodyne	ACKR3	63	33
COc1ccccc1[C@@H]1CSCCCN1CCOc1cccc(C(=O)O)c1	ZINC000872168384	GH	On-Demand	Anodyne	CYSK1	42	32
O=C(O)[C@@H]1CN(Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872168391	GI	On-Demand	Anodyne	CCR3	15	42
O=C(O)[C@@H]1CN(Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872168391	GI	On-Demand	Anodyne	MLNR	21	41
O=C(O)[C@@H]1CN(Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872168391	GI	On-Demand	Anodyne	S1PR1	38	49
O=C(O)[C@@H]1CN(Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H]1C(F)(F)F	ZINC000872168391	GI	On-Demand	Anodyne	S1PR5	24	49
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1Cl)CC2	ZINC000872168421	GH	On-Demand	Anodyne	SLC6A1	36	41
COc1ccc(C(=O)O)c2c1CN(CCOc1ccc(F)cc1Cl)CC2	ZINC000872168421	GH	On-Demand	Anodyne	HTR4	37	40
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	HTR1A	15	46
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	DRD2	25	46
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	DRD4	32	45
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	ACHE	29	47
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	HRH2	33	43
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	DRD3	17	42
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	FABP4	38	42
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	SIGMAR1	29	40
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	NOX1	41	37
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(CN3CCCCC3)c1)CC2	ZINC000872168434	GH	On-Demand	Anodyne	NOX5	41	37
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168440	CD	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168440	CD	On-Demand	Anodyne	ABCB1	55	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168440	CD	On-Demand	Anodyne	ACHP_LYMST	24	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168440	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168442	CD	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168442	CD	On-Demand	Anodyne	ABCB1	55	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168442	CD	On-Demand	Anodyne	ACHP_LYMST	24	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1	ZINC000872168442	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168444	CD	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168444	CD	On-Demand	Anodyne	ABCB1	55	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168444	CD	On-Demand	Anodyne	ACHP_LYMST	24	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168444	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168446	CD	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168446	CD	On-Demand	Anodyne	ABCB1	55	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168446	CD	On-Demand	Anodyne	ACHP_LYMST	24	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1	ZINC000872168446	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCOCC(=O)O	ZINC000872168456	DG	On-Demand	Anodyne	MDM2	130	35
CCC(C)(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168459	EI	On-Demand	Anodyne	S1PR4	17	52
CCC(C)(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168459	EI	On-Demand	Anodyne	S1PR1	20	52
CCC(C)(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168459	EI	On-Demand	Anodyne	S1PR5	37	52
CCC(C)(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168459	EI	On-Demand	Anodyne	CACNA1G	31	41
CN(CCOc1ccc(C(=O)O)cc1Cl)CC(C)(C)S(C)(=O)=O	ZINC000872168462	FE	On-Demand	Anodyne	SLC6A9	20	40
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCCN1C)CC2	ZINC000872168471	DE	On-Demand	Anodyne	CHRNA10	56	36
COc1ccc(C(=O)O)c2c1CN(CC[C@H]1CCCN1C)CC2	ZINC000872168471	DE	On-Demand	Anodyne	ACKR3	81	44
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCCN1C)CC2	ZINC000872168473	DE	On-Demand	Anodyne	CHRNA10	56	36
COc1ccc(C(=O)O)c2c1CN(CC[C@@H]1CCCN1C)CC2	ZINC000872168473	DE	On-Demand	Anodyne	ACKR3	81	44
CCOc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872168476	GF	On-Demand	Anodyne	S1PR4	24	44
CCOc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872168476	GF	On-Demand	Anodyne	S1PR1	34	58
CCOc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872168476	GF	On-Demand	Anodyne	S1PR5	41	58
CSc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168482	GE	On-Demand	Anodyne	ABCB1	60	42
CSc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168484	GE	On-Demand	Anodyne	ABCB1	60	42
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1F	ZINC000872168499	DF	On-Demand	Anodyne	SIGMAR1	29	45
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1F	ZINC000872168499	DF	On-Demand	Anodyne	CCR3	27	40
O=C(O)c1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1F	ZINC000872168499	DF	On-Demand	Anodyne	MCHR1	32	40
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1F	ZINC000872168500	DF	On-Demand	Anodyne	SIGMAR1	29	45
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1F	ZINC000872168500	DF	On-Demand	Anodyne	CCR3	27	40
O=C(O)c1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1F	ZINC000872168500	DF	On-Demand	Anodyne	MCHR1	32	40
O=C(O)[C@H]1CN(Cc2ccc(CO)cc2)C[C@@H]1C(F)(F)F	ZINC000872168508	DD	On-Demand	Anodyne	S1PR1	23	42
O=C(O)[C@H]1CN(Cc2ccc(CO)cc2)C[C@@H]1C(F)(F)F	ZINC000872168508	DD	On-Demand	Anodyne	S1PR5	40	42
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	DRD2	29	44
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	DRD3	32	44
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	SIGMAR1	30	45
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	ABCB1B	55	38
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	EBP	24	45
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(C)c1)CC2	ZINC000872168520	EH	On-Demand	Anodyne	ABCB1	33	40
O=C(O)/C=C\c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168521	FF	On-Demand	Anodyne	LTA4H	44	42
O=C(O)/C=C\c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168521	FF	On-Demand	Anodyne	HRH3	21	43
O=C(O)/C=C\c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168521	FF	On-Demand	Anodyne	PSMB1	40	38
O=C(O)/C=C\c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168522	FF	On-Demand	Anodyne	LTA4H	44	42
O=C(O)/C=C\c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168522	FF	On-Demand	Anodyne	HRH3	21	43
O=C(O)/C=C\c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168522	FF	On-Demand	Anodyne	PSMB1	40	38
O=C(O)/C=C/c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168523	FF	On-Demand	Anodyne	LTA4H	44	42
O=C(O)/C=C/c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168523	FF	On-Demand	Anodyne	HRH3	21	43
O=C(O)/C=C/c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000872168523	FF	On-Demand	Anodyne	PSMB1	40	38
O=C(O)/C=C/c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168524	FF	On-Demand	Anodyne	LTA4H	44	42
O=C(O)/C=C/c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168524	FF	On-Demand	Anodyne	HRH3	21	43
O=C(O)/C=C/c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000872168524	FF	On-Demand	Anodyne	PSMB1	40	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872168525	FF	On-Demand	Anodyne	SLC6A3	16	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872168526	FF	On-Demand	Anodyne	SLC6A3	16	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872168527	FF	On-Demand	Anodyne	SLC6A3	16	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872168528	FF	On-Demand	Anodyne	SLC6A3	16	41
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	HTR1A	25	44
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	DRD2	22	40
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	DRD4	19	40
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	ACHE	23	45
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	DRD3	21	40
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	SIGMAR1	26	47
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	ABCB1B	62	39
COc1ccc(C(=O)O)c2c1CN(CCN(C)Cc1ccccc1)CC2	ZINC000872168531	FF	On-Demand	Anodyne	ACKR3	46	32
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCOCC3)cc1)CC2	ZINC000872168537	GF	On-Demand	Anodyne	DRD4	24	46
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCOCC3)cc1)CC2	ZINC000872168537	GF	On-Demand	Anodyne	NOD2	41	38
CS(=O)(=O)c1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168541	GD	On-Demand	Anodyne	HRH3	17	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1occc1C(=O)O	ZINC000872168542	EI	On-Demand	Anodyne	MDM2	124	33
O=C(O)[C@@H]1CN(CCCc2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC000872168545	EG	On-Demand	Anodyne	SLC6A1	40	35
C[C@@H](c1cccc2ccccc12)N1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872168558	EI	On-Demand	Anodyne	KCNJ11	59	34
O=C(O)[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C(F)(F)F	ZINC000872168565	DF	On-Demand	Anodyne	S1PR1	22	40
O=C(O)[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C(F)(F)F	ZINC000872168565	DF	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@H]1C(F)(F)F	ZINC000872168566	FF	On-Demand	Anodyne	S1PR1	16	41
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@H]1C(F)(F)F	ZINC000872168566	FF	On-Demand	Anodyne	S1PR5	38	41
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@H]1C(F)(F)F	ZINC000872168567	FF	On-Demand	Anodyne	S1PR1	16	41
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@H]1C(F)(F)F	ZINC000872168567	FF	On-Demand	Anodyne	S1PR5	38	41
CS(=O)(=O)c1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168570	GE	On-Demand	Anodyne	HRH3	61	46
CS(=O)(=O)c1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168570	GE	On-Demand	Anodyne	MMP13	35	40
CS(=O)(=O)c1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168570	GE	On-Demand	Anodyne	ADAM17	15	40
CS(=O)(=O)c1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168570	GE	On-Demand	Anodyne	MMP9	18	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000872168576	DF	On-Demand	Anodyne	ADRB3	32	43
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)c1cccc(Cl)c1)CC2	ZINC000872168577	DF	On-Demand	Anodyne	ADRB3	32	43
O=C(O)[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1C(F)(F)F	ZINC000872168581	DF	On-Demand	Anodyne	CCR3	22	42
O=C(O)[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1C(F)(F)F	ZINC000872168581	DF	On-Demand	Anodyne	S1PR1	27	40
COc1cccc(S(=O)(=O)CCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872168589	GD	On-Demand	Anodyne	DRD4	42	32
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000872168591	EG	On-Demand	Anodyne	DRD4	29	41
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000872168591	EG	On-Demand	Anodyne	S1PR1	28	45
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000872168591	EG	On-Demand	Anodyne	S1PR5	35	45
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	OPRM1	16	40
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	CYSLTR2	51	34
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	GRM3	20	44
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	SIGMAR1	44	49
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	FAAH	44	39
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	CES1	48	44
O=C(O)[C@@H]1CN(CCCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872168599	DG	On-Demand	Anodyne	CYP2J2	45	34
CO[C@@H](CN1CC[C@]2(C(=O)O)CCC[C@H]12)c1ccc(F)cc1	ZINC000872168600	DF	On-Demand	Anodyne	LEF	25	40
CCCc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168606	DG	On-Demand	Anodyne	S1PR4	23	47
CCCc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168606	DG	On-Demand	Anodyne	S1PR1	27	52
CCCc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872168606	DG	On-Demand	Anodyne	S1PR5	43	52
O=C(O)[C@]12CCC[C@H]1N(CC[C@H]1CCc3ccccc31)CC2	ZINC000872168649	CG	On-Demand	Anodyne	EBP	20	47
O=C(O)[C@]12CCC[C@H]1N(CC[C@@H]1CCc3ccccc31)CC2	ZINC000872168650	CG	On-Demand	Anodyne	EBP	20	47
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	HTR1A	114	56
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	DRD2	74	56
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	DRD4	51	47
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	ADRA1D	22	43
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	HTR2A	68	56
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	HTR2C	26	47
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	ADRA1A	29	43
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	HRH1	18	47
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	ADRA1B	20	43
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	DRD3	80	49
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	DRD5	21	49
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	HTR7	129	48
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	SIGMAR1	32	50
O=C(O)[C@@H]1CN(CCCN2CCN(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872168657	GE	On-Demand	Anodyne	CYP2J2	45	31
CCN(Cc1ccc(Cl)cc1Oc1ccc(Cl)cc1)C[C@](C)(O)C(=O)O	ZINC000872168672	GI	On-Demand	Anodyne	TSPO	39	44
CCN(Cc1ccc(Cl)cc1Oc1ccc(Cl)cc1)C[C@@](C)(O)C(=O)O	ZINC000872168673	GI	On-Demand	Anodyne	TSPO	39	44
COc1ccc(C(=O)O)c2c1CN(CCCc1ccc(C)cc1)CC2	ZINC000872168703	EH	On-Demand	Anodyne	SIGMAR1	20	45
COc1ccc(C(=O)O)c2c1CN(CCCc1ccc(C)cc1)CC2	ZINC000872168703	EH	On-Demand	Anodyne	HTR5A	22	42
COc1ccc(C(=O)O)c2c1CN(CCCc1ccc(C)cc1)CC2	ZINC000872168703	EH	On-Demand	Anodyne	ABCB1B	50	43
COc1ccc(C(=O)O)c2c1CN(CCCc1ccc(C)cc1)CC2	ZINC000872168703	EH	On-Demand	Anodyne	ABCB1	29	43
O=C(O)c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168713	FG	On-Demand	Anodyne	HRH1	19	41
O=C(O)c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168713	FG	On-Demand	Anodyne	UTS2R	18	44
O=C(O)c1ccc(OCCN2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168713	FG	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168714	FG	On-Demand	Anodyne	HRH1	19	41
O=C(O)c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168714	FG	On-Demand	Anodyne	UTS2R	18	44
O=C(O)c1ccc(OCCN2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1	ZINC000872168714	FG	On-Demand	Anodyne	CYP2J2	44	31
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(N)=O)c1)CC2	ZINC000872168719	EE	On-Demand	Anodyne	DRD2	16	46
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(N)=O)c1)CC2	ZINC000872168719	EE	On-Demand	Anodyne	DRD4	25	44
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(N)=O)c1)CC2	ZINC000872168719	EE	On-Demand	Anodyne	ACHE	15	40
COc1ccc(C(=O)O)c2c1CN(Cc1cccc(C(N)=O)c1)CC2	ZINC000872168719	EE	On-Demand	Anodyne	FABP4	19	44
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCCCC(=O)O	ZINC000872168721	DI	On-Demand	Anodyne	MDM2	154	38
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC000872168730	EH	On-Demand	Anodyne	HTR1A	20	40
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC000872168730	EH	On-Demand	Anodyne	DRD2	28	40
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC000872168730	EH	On-Demand	Anodyne	HTR2A	17	41
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC000872168730	EH	On-Demand	Anodyne	SIGMAR1	33	44
COc1ccc(C(=O)O)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC000872168730	EH	On-Demand	Anodyne	EBP	25	44
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CCCC(=O)O	ZINC000872168734	CH	On-Demand	Anodyne	MDM2	154	38
COc1ccc(C(=O)O)c2c1CN(CCC1CCC1)CC2	ZINC000872168735	CF	On-Demand	Anodyne	HTR1A	19	41
COc1ccc(C(=O)O)c2c1CN(CCC1CCC1)CC2	ZINC000872168735	CF	On-Demand	Anodyne	DRD2	22	41
COc1ccc(C(=O)O)c2c1CN(CCC1CCC1)CC2	ZINC000872168735	CF	On-Demand	Anodyne	HTR4	22	40
COc1ccc(C(=O)O)c2c1CN(CCN1CCC(C)CC1)CC2	ZINC000872168751	EE	On-Demand	Anodyne	HTR1A	18	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCC(C)CC1)CC2	ZINC000872168751	EE	On-Demand	Anodyne	DRD2	18	41
COc1ccc(C(=O)O)c2c1CN(CCN1CCC(C)CC1)CC2	ZINC000872168751	EE	On-Demand	Anodyne	HTR4	32	42
COc1ccc(C(=O)O)c2c1CN(CCOCC1CCCC1)CC2	ZINC000872168768	EF	On-Demand	Anodyne	SLC6A1	56	33
COc1ccc(C(=O)O)c2c1CN(CCCC1CCC1)CC2	ZINC000872168779	DG	On-Demand	Anodyne	HTR1A	26	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CCC1)CC2	ZINC000872168779	DG	On-Demand	Anodyne	DRD2	27	40
COc1ccc(C(=O)O)c2c1CN(CCCC1CCC1)CC2	ZINC000872168779	DG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(O)c1ccc(Cl)c(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872168785	EG	On-Demand	Anodyne	ACHE	19	41
O=C(O)c1ccc(Cl)c(CN2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000872168785	EG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1ccc(Cl)c(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872168786	EG	On-Demand	Anodyne	ACHE	19	41
O=C(O)c1ccc(Cl)c(CN2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000872168786	EG	On-Demand	Anodyne	SIGMAR1	19	40
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872168795	GH	On-Demand	Anodyne	DRD4	25	45
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872168795	GH	On-Demand	Anodyne	ACHE	22	49
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872168795	GH	On-Demand	Anodyne	HRH3	19	43
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872168795	GH	On-Demand	Anodyne	ABCB1	19	41
COc1ccc(C(=O)O)c2c1CN(Cc1ccc(CN3CCCCC3)cc1)CC2	ZINC000872168795	GH	On-Demand	Anodyne	NOD2	42	39
COc1ccc(C(=O)O)c2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000872168796	EH	On-Demand	Anodyne	DRD2	16	44
COc1ccc(C(=O)O)c2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000872168796	EH	On-Demand	Anodyne	DRD3	20	41
COc1ccc(C(=O)O)c2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000872168796	EH	On-Demand	Anodyne	ABCB1B	58	37
COc1ccc(C(=O)O)c2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000872168796	EH	On-Demand	Anodyne	ABCB1	21	40
COc1ccc(C(=O)O)c2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000872168796	EH	On-Demand	Anodyne	SLC6A5	30	41
COc1ccc(C(=O)O)c2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000872168797	EH	On-Demand	Anodyne	DRD2	16	44
COc1ccc(C(=O)O)c2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000872168797	EH	On-Demand	Anodyne	DRD3	20	41
COc1ccc(C(=O)O)c2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000872168797	EH	On-Demand	Anodyne	ABCB1B	58	37
COc1ccc(C(=O)O)c2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000872168797	EH	On-Demand	Anodyne	ABCB1	21	40
COc1ccc(C(=O)O)c2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000872168797	EH	On-Demand	Anodyne	SLC6A5	30	41
O=C(O)c1cc(F)ccc1CN1CCO[C@@H](C(F)(F)F)CC1	ZINC000872168802	DF	On-Demand	Anodyne	SIGMAR1	16	43
O=C(O)c1cc(F)ccc1CN1CCO[C@H](C(F)(F)F)CC1	ZINC000872168803	DF	On-Demand	Anodyne	SIGMAR1	16	43
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cnc(C(=O)O)cn1	ZINC000872168814	EH	On-Demand	Anodyne	MDM2	127	45
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1CC1(C(=O)O)CC1	ZINC000872168828	DH	On-Demand	Anodyne	MDM2	129	35
C[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872168829	EG	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872168829	EG	On-Demand	Anodyne	MLNR	48	35
C[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872168830	EG	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872168830	EG	On-Demand	Anodyne	MLNR	48	35
C[C@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872168831	EG	On-Demand	Anodyne	SIGMAR1	17	40
C[C@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000872168831	EG	On-Demand	Anodyne	MLNR	48	35
C[C@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872168832	EG	On-Demand	Anodyne	SIGMAR1	17	40
C[C@H]1CN(Cc2ccc(C(=O)O)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000872168832	EG	On-Demand	Anodyne	MLNR	48	35
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc2ccccc2c1	ZINC000872168842	EF	On-Demand	Anodyne	ACOX1	56	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc2ccccc2c1	ZINC000872168842	EF	On-Demand	Anodyne	ABCB1	47	36
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc2ccccc2c1	ZINC000872168843	EF	On-Demand	Anodyne	ACOX1	56	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc2ccccc2c1	ZINC000872168843	EF	On-Demand	Anodyne	ABCB1	47	36
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc2ccccc2c1	ZINC000872168844	EF	On-Demand	Anodyne	ACOX1	56	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc2ccccc2c1	ZINC000872168844	EF	On-Demand	Anodyne	ABCB1	47	36
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc2ccccc2c1	ZINC000872168845	EF	On-Demand	Anodyne	ACOX1	56	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc2ccccc2c1	ZINC000872168845	EF	On-Demand	Anodyne	ABCB1	47	36
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168847	EI	On-Demand	Anodyne	OPRL1	26	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168847	EI	On-Demand	Anodyne	SLC6A3	44	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168848	EI	On-Demand	Anodyne	OPRL1	26	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168848	EI	On-Demand	Anodyne	SLC6A3	44	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168849	EI	On-Demand	Anodyne	OPRL1	26	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168849	EI	On-Demand	Anodyne	SLC6A3	44	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168850	EI	On-Demand	Anodyne	OPRL1	26	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000872168850	EI	On-Demand	Anodyne	SLC6A3	44	45
CCOc1ccc(-c2nc(CN3[C@H]4CC[C@H]3[C@H](C(=O)O)C4)co2)cc1	ZINC000872168851	EG	On-Demand	Anodyne	S1PR1	15	47
CCOc1ccc(-c2nc(CN3[C@H]4CC[C@H]3[C@@H](C(=O)O)C4)co2)cc1	ZINC000872168852	EG	On-Demand	Anodyne	S1PR1	15	47
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]1c1ccccc1	ZINC000872168853	CF	On-Demand	Anodyne	SLC6A4	25	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]1c1ccccc1	ZINC000872168853	CF	On-Demand	Anodyne	SLC6A3	63	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]1c1ccccc1	ZINC000872168854	CF	On-Demand	Anodyne	SLC6A4	25	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]1c1ccccc1	ZINC000872168854	CF	On-Demand	Anodyne	SLC6A3	63	43
Cc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c(C)c1	ZINC000872168859	FE	On-Demand	Anodyne	ABCB1	66	46
Cc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c(C)c1	ZINC000872168860	FE	On-Demand	Anodyne	ABCB1	66	46
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168866	CE	On-Demand	Anodyne	ACE	44	35
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168866	CE	On-Demand	Anodyne	SLC6A4	26	42
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168866	CE	On-Demand	Anodyne	SLC6A3	65	43
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168866	CE	On-Demand	Anodyne	ACHP_LYMST	24	40
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168866	CE	On-Demand	Anodyne	Q8WSF8_APLCA	37	40
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168867	CE	On-Demand	Anodyne	ACE	44	35
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168867	CE	On-Demand	Anodyne	SLC6A4	26	42
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168867	CE	On-Demand	Anodyne	SLC6A3	65	43
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168867	CE	On-Demand	Anodyne	ACHP_LYMST	24	40
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168867	CE	On-Demand	Anodyne	Q8WSF8_APLCA	37	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168872	EG	On-Demand	Anodyne	KCNH2	37	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168872	EG	On-Demand	Anodyne	GRM3	15	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168872	EG	On-Demand	Anodyne	SLC6A9	22	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168872	EG	On-Demand	Anodyne	ACHP_LYMST	17	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168872	EG	On-Demand	Anodyne	Q8WSF8_APLCA	33	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168873	EG	On-Demand	Anodyne	KCNH2	37	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168873	EG	On-Demand	Anodyne	GRM3	15	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168873	EG	On-Demand	Anodyne	SLC6A9	22	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168873	EG	On-Demand	Anodyne	ACHP_LYMST	17	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1cccc(OC(F)(F)F)c1	ZINC000872168873	EG	On-Demand	Anodyne	Q8WSF8_APLCA	33	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168889	EF	On-Demand	Anodyne	ADRB2	19	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168889	EF	On-Demand	Anodyne	SLC6A4	20	47
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168889	EF	On-Demand	Anodyne	ABCB1	70	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168890	EF	On-Demand	Anodyne	ADRB2	19	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168890	EF	On-Demand	Anodyne	SLC6A4	20	47
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168890	EF	On-Demand	Anodyne	ABCB1	70	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168891	EF	On-Demand	Anodyne	ADRB2	19	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168891	EF	On-Demand	Anodyne	SLC6A4	20	47
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2ccccc12	ZINC000872168891	EF	On-Demand	Anodyne	ABCB1	70	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168892	EF	On-Demand	Anodyne	ADRB2	19	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168892	EF	On-Demand	Anodyne	SLC6A4	20	47
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2ccccc12	ZINC000872168892	EF	On-Demand	Anodyne	ABCB1	70	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	DRD2	18	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	HRH2	30	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	HRH3	18	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	SIGMAR1	40	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	CCR3	24	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168901	EG	On-Demand	Anodyne	L3MBTL3	18	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	DRD2	18	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	HRH2	30	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	HRH3	18	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	SIGMAR1	40	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	CCR3	24	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCCCC2)c1	ZINC000872168902	EG	On-Demand	Anodyne	L3MBTL3	18	45
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168916	GF	On-Demand	Anodyne	ADRB2	21	42
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168916	GF	On-Demand	Anodyne	ADRB1	19	47
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168916	GF	On-Demand	Anodyne	ABCB1	82	44
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168917	GF	On-Demand	Anodyne	ADRB2	21	42
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168917	GF	On-Demand	Anodyne	ADRB1	19	47
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3ccccc23)C[C@@H]1C(F)(F)F	ZINC000872168917	GF	On-Demand	Anodyne	ABCB1	82	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(F)c1	ZINC000872168922	CD	On-Demand	Anodyne	SLC6A3	29	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(F)c1	ZINC000872168922	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(F)c1	ZINC000872168923	CD	On-Demand	Anodyne	SLC6A3	29	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(F)c1	ZINC000872168923	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(F)c1	ZINC000872168924	CD	On-Demand	Anodyne	SLC6A3	29	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(F)c1	ZINC000872168924	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(F)c1	ZINC000872168925	CD	On-Demand	Anodyne	SLC6A3	29	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(F)c1	ZINC000872168925	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168927	CD	On-Demand	Anodyne	ACE	56	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168927	CD	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168927	CD	On-Demand	Anodyne	SLC18A2	61	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168927	CD	On-Demand	Anodyne	ACHP_LYMST	22	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168927	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168928	CD	On-Demand	Anodyne	ACE	56	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168928	CD	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168928	CD	On-Demand	Anodyne	SLC18A2	61	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168928	CD	On-Demand	Anodyne	ACHP_LYMST	22	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168928	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168929	CD	On-Demand	Anodyne	ACE	56	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168929	CD	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168929	CD	On-Demand	Anodyne	SLC18A2	61	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168929	CD	On-Demand	Anodyne	ACHP_LYMST	22	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)CCc1ccccc1	ZINC000872168929	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168930	CD	On-Demand	Anodyne	ACE	56	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168930	CD	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168930	CD	On-Demand	Anodyne	SLC18A2	61	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168930	CD	On-Demand	Anodyne	ACHP_LYMST	22	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)CCc1ccccc1	ZINC000872168930	CD	On-Demand	Anodyne	Q8WSF8_APLCA	38	41
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168931	DD	On-Demand	Anodyne	SLC6A3	32	41
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168931	DD	On-Demand	Anodyne	ACOX1	57	33
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168932	DD	On-Demand	Anodyne	SLC6A3	32	41
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168932	DD	On-Demand	Anodyne	ACOX1	57	33
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168933	DD	On-Demand	Anodyne	SLC6A3	32	41
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872168933	DD	On-Demand	Anodyne	ACOX1	57	33
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168934	DD	On-Demand	Anodyne	SLC6A3	32	41
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872168934	DD	On-Demand	Anodyne	ACOX1	57	33
COCC[C@@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168941	CF	On-Demand	Anodyne	SLC6A4	23	41
COCC[C@@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168941	CF	On-Demand	Anodyne	SLC6A3	71	41
COCC[C@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168942	CF	On-Demand	Anodyne	SLC6A4	23	41
COCC[C@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872168942	CF	On-Demand	Anodyne	SLC6A3	71	41
COCC[C@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168943	CF	On-Demand	Anodyne	SLC6A4	23	41
COCC[C@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168943	CF	On-Demand	Anodyne	SLC6A3	71	41
COCC[C@@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168944	CF	On-Demand	Anodyne	SLC6A4	23	41
COCC[C@@H](c1ccccc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872168944	CF	On-Demand	Anodyne	SLC6A3	71	41
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(OC(F)(F)F)cc1)CC2	ZINC000872168953	EG	On-Demand	Anodyne	EPHX2	42	37
CN(C)S(=O)(=O)c1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872168959	GD	On-Demand	Anodyne	MMP13	42	38
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000872168965	DE	On-Demand	Bother	HRH2	15	42
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000872168965	DE	On-Demand	Bother	CACNA1C	53	38
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000872168965	DE	On-Demand	Bother	CACNA1D	83	38
COc1cccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872168970	DE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872168970	DE	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872168970	DE	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872168970	DE	On-Demand	Anodyne	CHRNA10	46	46
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(-n3cccn3)cc1)CC2	ZINC000872168978	DF	On-Demand	Anodyne	AMP1_PLAFQ	41	33
COc1cccc(OC)c1OC[C@H](O)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872168980	FD	On-Demand	Anodyne	ABCB1	52	39
COc1cccc(OC)c1OC[C@@H](O)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872168981	FD	On-Demand	Anodyne	ABCB1	52	39
Cc1ccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c(C)c1	ZINC000872168985	EE	On-Demand	Anodyne	ABCB1	47	42
Cc1ccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c(C)c1	ZINC000872168986	EE	On-Demand	Anodyne	ABCB1	47	42
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872168988	EF	On-Demand	Anodyne	EDNRB	68	40
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872168988	EF	On-Demand	Anodyne	EDNRA	65	41
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc3c(c1)OCO3)CC2	ZINC000872168988	EF	On-Demand	Anodyne	HRH3	26	43
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc(F)c1)CC2	ZINC000872168990	CF	On-Demand	Anodyne	CHRNA10	58	46
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1ccccc1C(F)(F)F)CC2	ZINC000872168991	FI	On-Demand	Anodyne	GBA2	55	36
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1ccccc1C(F)(F)F)CC2	ZINC000872168991	FI	On-Demand	Anodyne	RBP4	51	36
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc3c(c1)OCCO3)CC2	ZINC000872168995	DE	On-Demand	Anodyne	MCHR1	15	40
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc3ccccc3n1)CC2	ZINC000872169009	CG	On-Demand	Anodyne	ALOX5	21	41
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc3ccccc3n1)CC2	ZINC000872169009	CG	On-Demand	Anodyne	ALOX5AP	40	36
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(Cl)c1)CC2	ZINC000872169014	DG	On-Demand	Anodyne	HRH2	28	40
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(Cl)c1)CC2	ZINC000872169014	DG	On-Demand	Anodyne	AVPR1B	42	38
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(Cl)c1)CC2	ZINC000872169014	DG	On-Demand	Anodyne	HRH3	34	45
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(Cl)c1)CC2	ZINC000872169014	DG	On-Demand	Anodyne	CHRNA10	35	45
O=C(O)[C@]12CCC[C@H]1N(Cc1nc(-c3cccs3)no1)CC2	ZINC000872169033	DF	On-Demand	Anodyne	ETHR	54	46
O=C(O)[C@]12CCC[C@H]1N(Cc1cn(-c3ccccc3)nn1)CC2	ZINC000872169048	DE	On-Demand	Anodyne	AROQ	26	40
O=C(O)[C@]12CCC[C@H]1N(CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872169049	DE	On-Demand	Bother	KCNJ1	32	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169061	EI	On-Demand	Anodyne	OPRK1	17	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169061	EI	On-Demand	Anodyne	SLC6A3	25	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169061	EI	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169061	EI	On-Demand	Anodyne	ARG1	30	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169061	EI	On-Demand	Anodyne	ARG2	30	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169062	EI	On-Demand	Anodyne	OPRK1	17	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169062	EI	On-Demand	Anodyne	SLC6A3	25	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169062	EI	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169062	EI	On-Demand	Anodyne	ARG1	30	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1ccc(Cl)c(Cl)c1	ZINC000872169062	EI	On-Demand	Anodyne	ARG2	30	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(-c2ncco2)cc1F	ZINC000872169067	DF	On-Demand	Anodyne	LTA4H	16	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(-c2ncco2)cc1F	ZINC000872169068	DF	On-Demand	Anodyne	LTA4H	16	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169069	EE	On-Demand	Anodyne	DRD4	32	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169069	EE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169069	EE	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169070	EE	On-Demand	Anodyne	DRD4	32	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169070	EE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169070	EE	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169071	EE	On-Demand	Anodyne	DRD4	32	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169071	EE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169071	EE	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169072	EE	On-Demand	Anodyne	DRD4	32	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169072	EE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000872169072	EE	On-Demand	Anodyne	SIGMAR1	32	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169073	DH	On-Demand	Anodyne	SLC6A4	15	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169073	DH	On-Demand	Anodyne	SLC6A3	37	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169073	DH	On-Demand	Anodyne	KCNH2	18	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169073	DH	On-Demand	Anodyne	GRM3	15	47
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169074	DH	On-Demand	Anodyne	SLC6A4	15	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169074	DH	On-Demand	Anodyne	SLC6A3	37	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169074	DH	On-Demand	Anodyne	KCNH2	18	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCCc1cccc(Cl)c1	ZINC000872169074	DH	On-Demand	Anodyne	GRM3	15	47
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169075	EF	On-Demand	Anodyne	CCR2	42	35
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169075	EF	On-Demand	Anodyne	LIPG	40	31
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169075	EF	On-Demand	Anodyne	Q8WSF8_APLCA	25	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169076	EF	On-Demand	Anodyne	CCR2	42	35
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169076	EF	On-Demand	Anodyne	LIPG	40	31
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169076	EF	On-Demand	Anodyne	Q8WSF8_APLCA	25	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169077	EF	On-Demand	Anodyne	CCR2	42	35
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169077	EF	On-Demand	Anodyne	LIPG	40	31
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169077	EF	On-Demand	Anodyne	Q8WSF8_APLCA	25	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169078	EF	On-Demand	Anodyne	CCR2	42	35
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169078	EF	On-Demand	Anodyne	LIPG	40	31
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872169078	EF	On-Demand	Anodyne	Q8WSF8_APLCA	25	44
COc1cc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)ccn1	ZINC000872169085	CD	On-Demand	Anodyne	SLC6A3	20	40
COc1cc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)ccn1	ZINC000872169086	CD	On-Demand	Anodyne	SLC6A3	20	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCOCC2)c1	ZINC000872169097	ED	On-Demand	Anodyne	CCR3	20	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(CN2CCOCC2)c1	ZINC000872169098	ED	On-Demand	Anodyne	CCR3	20	40
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c(C)c1	ZINC000872169104	DD	On-Demand	Anodyne	ABCB1	45	42
Cc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c(C)c1	ZINC000872169105	DD	On-Demand	Anodyne	ABCB1	45	42
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c(C)c1	ZINC000872169106	DD	On-Demand	Anodyne	ABCB1	45	42
Cc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c(C)c1	ZINC000872169107	DD	On-Demand	Anodyne	ABCB1	45	42
Cc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169112	ED	On-Demand	Anodyne	ACOX1	78	35
Cc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169112	ED	On-Demand	Anodyne	ABCB1	66	44
Cc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169113	ED	On-Demand	Anodyne	ACOX1	78	35
Cc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169113	ED	On-Demand	Anodyne	ABCB1	66	44
C[C@H](c1ccc2c(c1)CCC2)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169114	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@H](c1ccc2c(c1)CCC2)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169115	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](c1ccc2c(c1)CCC2)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169116	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](c1ccc2c(c1)CCC2)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169117	CG	On-Demand	Anodyne	SLC6A3	15	40
O=C(O)[C@@H]1CN(C(c2ccccc2)c2ccccc2)C[C@H]1C(F)(F)F	ZINC000872169118	EH	On-Demand	Anodyne	OPRL1	15	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@H]1c1ccccc1	ZINC000872169131	CE	On-Demand	Anodyne	SLC6A4	28	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@H]1c1ccccc1	ZINC000872169131	CE	On-Demand	Anodyne	SLC6A3	70	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@H]1c1ccccc1	ZINC000872169131	CE	On-Demand	Anodyne	SLC18A3	28	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@@H]1c1ccccc1	ZINC000872169132	CE	On-Demand	Anodyne	SLC6A4	28	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@@H]1c1ccccc1	ZINC000872169132	CE	On-Demand	Anodyne	SLC6A3	70	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@@H]1c1ccccc1	ZINC000872169132	CE	On-Demand	Anodyne	SLC18A3	28	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@@H]1c1ccccc1	ZINC000872169133	CE	On-Demand	Anodyne	SLC6A4	28	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@@H]1c1ccccc1	ZINC000872169133	CE	On-Demand	Anodyne	SLC6A3	70	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@H]1C[C@@H]1c1ccccc1	ZINC000872169133	CE	On-Demand	Anodyne	SLC18A3	28	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@H]1c1ccccc1	ZINC000872169134	CE	On-Demand	Anodyne	SLC6A4	28	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@H]1c1ccccc1	ZINC000872169134	CE	On-Demand	Anodyne	SLC6A3	70	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2[C@@H]1C[C@H]1c1ccccc1	ZINC000872169134	CE	On-Demand	Anodyne	SLC18A3	28	43
O=C(O)[C@H]1CN(C[C@H](O)COc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872169143	ED	On-Demand	Anodyne	ACOX1	58	36
O=C(O)[C@H]1CN(C[C@H](O)COc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872169143	ED	On-Demand	Anodyne	ABCB1	78	48
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872169144	ED	On-Demand	Anodyne	ACOX1	58	36
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872169144	ED	On-Demand	Anodyne	ABCB1	78	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCSCc1ccccc1	ZINC000872169147	DG	On-Demand	Anodyne	CACNA2D1	20	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCSCc1ccccc1	ZINC000872169147	DG	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCSCc1ccccc1	ZINC000872169148	DG	On-Demand	Anodyne	CACNA2D1	20	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCSCc1ccccc1	ZINC000872169148	DG	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872169169	EG	On-Demand	Anodyne	CCR2	56	35
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000872169170	EG	On-Demand	Anodyne	CCR2	56	35
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccccc1Cl)CC2	ZINC000872169174	EE	On-Demand	Anodyne	ABCB1	63	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccccc1Cl)CC2	ZINC000872169175	EE	On-Demand	Anodyne	ABCB1	63	42
O=C(O)[C@]12CCC[C@H]1N(CCOC(c1ccccc1)c1ccccc1)CC2	ZINC000872169182	FI	On-Demand	Anodyne	SLC6A4	22	44
O=C(O)[C@]12CCC[C@H]1N(CCOC(c1ccccc1)c1ccccc1)CC2	ZINC000872169182	FI	On-Demand	Anodyne	SLC6A3	61	47
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000872169184	CE	On-Demand	Bother	CACNA1C	45	37
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000872169184	CE	On-Demand	Bother	CACNA1D	69	37
O=C(O)[C@]12CCC[C@H]1N(Cc1cc(Cl)ccc1OCC1CC1)CC2	ZINC000872169200	EH	On-Demand	Anodyne	PTGER1	37	48
C[C@H](c1nc2ccccc2n1C(F)F)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169211	EH	On-Demand	Anodyne	PDE6D	55	35
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	ACE	27	42
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	OPRM1	29	42
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	OPRD1	27	42
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	OPRK1	23	42
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	SLC18A2	42	41
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	SIGMAR1	37	43
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	PREP	50	39
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	FAAH	46	35
O=C(O)[C@]12CCC[C@H]1N(CCCCc1ccccc1)CC2	ZINC000872169213	CG	On-Demand	Anodyne	CES1	52	34
O=C(O)[C@]12CCC[C@H]1N(Cc1ccccc1Oc1cccnc1)CC2	ZINC000872169223	EH	On-Demand	Anodyne	CCR8	30	46
C[C@H](c1nc(-c2cccs2)no1)N1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169232	EG	On-Demand	Anodyne	ETHR	43	44
O=C(O)[C@]12CCC[C@H]1N(Cc1cc(Cl)ccc1OCc1cccnc1)CC2	ZINC000872169241	GI	On-Demand	Anodyne	PTGER1	81	44
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccccc1)CC2	ZINC000872169246	CF	On-Demand	Anodyne	HRH3	63	41
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccccc1)CC2	ZINC000872169246	CF	On-Demand	Anodyne	CPT1A	40	33
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccccc1)CC2	ZINC000872169246	CF	On-Demand	Anodyne	CHRNA10	43	39
CCOc1ccccc1OCCN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169252	DF	On-Demand	Anodyne	HCN1	58	37
CCOc1ccccc1OCCN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169252	DF	On-Demand	Anodyne	HCN4	47	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccccc1C(F)(F)F)CC2	ZINC000872169254	FF	On-Demand	Anodyne	ABCB1	59	43
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccccc1C(F)(F)F)CC2	ZINC000872169257	FF	On-Demand	Anodyne	ABCB1	59	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)c(Br)c1	ZINC000872169269	FF	On-Demand	Anodyne	SLC6A3	17	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)c(Br)c1	ZINC000872169270	FF	On-Demand	Anodyne	SLC6A3	17	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)c(Br)c1	ZINC000872169272	FF	On-Demand	Anodyne	SLC6A3	17	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)c(Br)c1	ZINC000872169274	FF	On-Demand	Anodyne	SLC6A3	17	42
Cc1oc(-c2ccccc2)nc1CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872169278	FG	On-Demand	Anodyne	PPARG	94	50
Cc1oc(-c2ccccc2)nc1CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872169278	FG	On-Demand	Anodyne	PPARA	101	47
Cc1oc(-c2ccccc2)nc1CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872169278	FG	On-Demand	Anodyne	PDE8B	86	49
CSc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169279	DG	On-Demand	Anodyne	MLNR	45	33
CSc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169279	DG	On-Demand	Anodyne	S1PR1	24	40
CSc1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169279	DG	On-Demand	Anodyne	S1PR5	37	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169292	ED	On-Demand	Anodyne	ADRB1	17	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169292	ED	On-Demand	Anodyne	HTR1A	18	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169292	ED	On-Demand	Anodyne	SLC6A4	23	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169293	ED	On-Demand	Anodyne	ADRB1	17	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169293	ED	On-Demand	Anodyne	HTR1A	18	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc2[nH]ccc12	ZINC000872169293	ED	On-Demand	Anodyne	SLC6A4	23	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169294	ED	On-Demand	Anodyne	ADRB1	17	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169294	ED	On-Demand	Anodyne	HTR1A	18	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169294	ED	On-Demand	Anodyne	SLC6A4	23	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169295	ED	On-Demand	Anodyne	ADRB1	17	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169295	ED	On-Demand	Anodyne	HTR1A	18	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872169295	ED	On-Demand	Anodyne	SLC6A4	23	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCn1ccc2cc(Cl)ccc21	ZINC000872169300	DG	On-Demand	Anodyne	SLC6A3	21	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCn1ccc2cc(Cl)ccc21	ZINC000872169301	DG	On-Demand	Anodyne	SLC6A3	21	40
CO[C@@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)c1ccc(Cl)cc1	ZINC000872169304	DF	On-Demand	Anodyne	SLC6A4	29	43
CO[C@@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)c1ccc(Cl)cc1	ZINC000872169304	DF	On-Demand	Anodyne	SLC6A3	81	43
CO[C@@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)c1ccc(Cl)cc1	ZINC000872169306	DF	On-Demand	Anodyne	SLC6A4	29	43
CO[C@@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)c1ccc(Cl)cc1	ZINC000872169306	DF	On-Demand	Anodyne	SLC6A3	81	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C/C=C\c1ccc(Cl)cc1	ZINC000872169308	CG	On-Demand	Anodyne	SLC6A3	24	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C/C=C/c1ccc(Cl)cc1	ZINC000872169309	CG	On-Demand	Anodyne	SLC6A3	24	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C/C=C\c1ccc(Cl)cc1	ZINC000872169310	CG	On-Demand	Anodyne	SLC6A3	24	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C/C=C/c1ccc(Cl)cc1	ZINC000872169311	CG	On-Demand	Anodyne	SLC6A3	24	46
COc1ccccc1-c1nc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)co1	ZINC000872169312	EF	On-Demand	Anodyne	SLC6A3	15	40
COc1ccccc1-c1nc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)co1	ZINC000872169313	EF	On-Demand	Anodyne	SLC6A3	15	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)cc1	ZINC000872169316	CE	On-Demand	Anodyne	SLC6A3	41	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)cc1	ZINC000872169316	CE	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)cc1	ZINC000872169317	CE	On-Demand	Anodyne	SLC6A3	41	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)cc1	ZINC000872169317	CE	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)cc1	ZINC000872169318	CE	On-Demand	Anodyne	SLC6A3	41	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)cc1	ZINC000872169318	CE	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)cc1	ZINC000872169319	CE	On-Demand	Anodyne	SLC6A3	41	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)cc1	ZINC000872169319	CE	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
CC(=O)c1cccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872169333	GD	On-Demand	Anodyne	ACOX1	73	37
CC(=O)c1cccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872169333	GD	On-Demand	Anodyne	ABCB1	70	56
CC(=O)c1cccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872169334	GD	On-Demand	Anodyne	ACOX1	73	37
CC(=O)c1cccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)c1	ZINC000872169334	GD	On-Demand	Anodyne	ABCB1	70	56
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc3ccccc13)CC2	ZINC000872169340	EH	On-Demand	Anodyne	ALB	24	42
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc3ccccc13)CC2	ZINC000872169340	EH	On-Demand	Anodyne	MCL1	50	47
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1	ZINC000872169357	CE	On-Demand	Anodyne	SLC6A3	27	47
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1	ZINC000872169357	CE	On-Demand	Anodyne	KCNH2	40	45
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1	ZINC000872169357	CE	On-Demand	Anodyne	ACHP_LYMST	22	40
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1	ZINC000872169357	CE	On-Demand	Anodyne	Q8WSF8_APLCA	37	40
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1	ZINC000872169358	CE	On-Demand	Anodyne	SLC6A3	27	47
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1	ZINC000872169358	CE	On-Demand	Anodyne	KCNH2	40	45
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1	ZINC000872169358	CE	On-Demand	Anodyne	ACHP_LYMST	22	40
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1	ZINC000872169358	CE	On-Demand	Anodyne	Q8WSF8_APLCA	37	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1C(F)(F)F	ZINC000872169360	EF	On-Demand	Anodyne	SLC6A3	16	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1C(F)(F)F	ZINC000872169360	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1C(F)(F)F	ZINC000872169362	EF	On-Demand	Anodyne	SLC6A3	16	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1C(F)(F)F	ZINC000872169362	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	41
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc3ccccc3c1)CC2	ZINC000872169366	EH	On-Demand	Anodyne	HRH3	52	40
CCOc1ccc(-c2noc(CN3CC[C@]4(C(=O)O)CCC[C@H]34)n2)cc1	ZINC000872169370	FF	On-Demand	Anodyne	CPT1A	50	41
CCOc1ccc(-c2noc(CN3CC[C@]4(C(=O)O)CCC[C@H]34)n2)cc1	ZINC000872169370	FF	On-Demand	Anodyne	S1PR1	16	46
O=C(O)[C@]12CCC[C@H]1N(Cc1csc(Nc3ccccc3)n1)CC2	ZINC000872169375	EH	On-Demand	Anodyne	SPHK2	45	33
O=C(O)[C@]12CCC[C@H]1N(Cc1csc(Nc3ccccc3)n1)CC2	ZINC000872169375	EH	On-Demand	Anodyne	SPHK1	50	37
O=C(O)[C@]12CCC[C@H]1N(Cc1csc(Nc3ccccc3)n1)CC2	ZINC000872169375	EH	On-Demand	Anodyne	TRPC6	49	35
O=C(O)[C@]12CCC[C@H]1N(Cc1csc(Nc3ccccc3)n1)CC2	ZINC000872169375	EH	On-Demand	Anodyne	TRPC3	48	35
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)CCc1ccccc1)CC2	ZINC000872169381	DE	On-Demand	Anodyne	ACE	54	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)CCc1ccccc1)CC2	ZINC000872169381	DE	On-Demand	Anodyne	SLC18A2	50	39
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)CCc1ccccc1)CC2	ZINC000872169382	DE	On-Demand	Anodyne	ACE	54	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)CCc1ccccc1)CC2	ZINC000872169382	DE	On-Demand	Anodyne	SLC18A2	50	39
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccccc1C(F)(F)F)CC2	ZINC000872169397	EG	On-Demand	Anodyne	RBP4	54	37
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169406	FI	On-Demand	Anodyne	LTA4H	80	48
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169406	FI	On-Demand	Anodyne	CPT1A	58	33
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169406	FI	On-Demand	Anodyne	PSMB1	40	39
Cc1oc(-c2ccccc2)nc1CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169407	EG	On-Demand	Anodyne	PPARG	86	45
Cc1oc(-c2ccccc2)nc1CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169407	EG	On-Demand	Anodyne	PPARA	94	46
Cc1oc(-c2ccccc2)nc1CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169407	EG	On-Demand	Anodyne	PDE8B	73	43
COc1cccc(OC)c1OCCCCN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872169411	FG	On-Demand	Anodyne	DRD2	19	41
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	HRH2	22	43
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	EPHX2	18	44
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	GBA2	52	33
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	CHRNA10	32	48
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	LIPG	41	32
O=C(O)[C@]12CCC[C@H]1N(CCCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169420	FI	On-Demand	Anodyne	PDS	41	40
CS(=O)(=O)c1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169421	FD	On-Demand	Anodyne	MMP13	46	40
CS(=O)(=O)c1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169421	FD	On-Demand	Anodyne	ADAM17	46	40
CS(=O)(=O)c1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169421	FD	On-Demand	Anodyne	MMP9	21	40
CS(=O)(=O)c1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169421	FD	On-Demand	Anodyne	MMP1	30	40
CSc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169426	DG	On-Demand	Anodyne	LTA4H	29	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc(C(F)(F)F)c1)CC2	ZINC000872169431	FF	On-Demand	Anodyne	PDS	45	41
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc(C(F)(F)F)c1)CC2	ZINC000872169432	FF	On-Demand	Anodyne	PDS	45	41
O=C(O)[C@]12CCC[C@H]1N(Cc1nc3ccccc3n1C(F)F)CC2	ZINC000872169437	EG	On-Demand	Anodyne	PDE6D	64	33
C[C@@H](CCN1CC[C@]2(C(=O)O)CCC[C@H]12)OCc1ccccc1	ZINC000872169450	DG	On-Demand	Anodyne	SLC12A5	56	35
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1C(F)(F)F	ZINC000872169451	EF	On-Demand	Anodyne	SLC6A3	16	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1C(F)(F)F	ZINC000872169451	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1C(F)(F)F	ZINC000872169452	EF	On-Demand	Anodyne	SLC6A3	16	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1C(F)(F)F	ZINC000872169452	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	41
COCCc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872169458	ED	On-Demand	Anodyne	ADRB1	29	45
COCCc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872169459	ED	On-Demand	Anodyne	ADRB1	29	45
COCCc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872169460	ED	On-Demand	Anodyne	ADRB1	29	45
COCCc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872169461	ED	On-Demand	Anodyne	ADRB1	29	45
COc1cc(Br)ccc1CCCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169471	FG	On-Demand	Anodyne	SLC6A3	25	43
COc1cc(Br)ccc1CCCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169472	FG	On-Demand	Anodyne	SLC6A3	25	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCSCc1ccccc1	ZINC000872169482	CF	On-Demand	Anodyne	CACNA2D1	24	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCSCc1ccccc1	ZINC000872169483	CF	On-Demand	Anodyne	CACNA2D1	24	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCC2)cc1	ZINC000872169491	CG	On-Demand	Anodyne	SLC6A3	32	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCC2)cc1	ZINC000872169491	CG	On-Demand	Anodyne	S1PR5	20	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCC2)cc1	ZINC000872169492	CG	On-Demand	Anodyne	SLC6A3	32	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCC2)cc1	ZINC000872169492	CG	On-Demand	Anodyne	S1PR5	20	40
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169493	EF	On-Demand	Anodyne	DRD2	16	40
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169493	EF	On-Demand	Anodyne	SLC6A4	20	43
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169493	EF	On-Demand	Anodyne	SLC6A3	47	43
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169494	EF	On-Demand	Anodyne	DRD2	16	40
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169494	EF	On-Demand	Anodyne	SLC6A4	20	43
COc1cccc(OC)c1OCCCCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169494	EF	On-Demand	Anodyne	SLC6A3	47	43
COc1ccccc1COC[C@@H](O)CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872169497	GD	On-Demand	Anodyne	ABCB1	57	37
COc1ccccc1COC[C@H](O)CN1C[C@H](C(=O)O)[C@@H](C(F)(F)F)C1	ZINC000872169498	GD	On-Demand	Anodyne	ABCB1	57	37
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169506	EG	On-Demand	Anodyne	HRH3	27	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169506	EG	On-Demand	Anodyne	SIGMAR1	34	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169506	EG	On-Demand	Anodyne	L3MBTL3	26	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169507	EG	On-Demand	Anodyne	HRH3	27	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169507	EG	On-Demand	Anodyne	SIGMAR1	34	41
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CN2CCCCC2)cc1	ZINC000872169507	EG	On-Demand	Anodyne	L3MBTL3	26	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872169508	GG	On-Demand	Anodyne	ABCB1	46	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872169509	GG	On-Demand	Anodyne	ABCB1	46	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872169510	GG	On-Demand	Anodyne	ABCB1	46	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872169511	GG	On-Demand	Anodyne	ABCB1	46	39
CC(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169516	DH	On-Demand	Anodyne	S1PR1	23	40
CC(C)c1ccc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169516	DH	On-Demand	Anodyne	S1PR5	38	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872169521	FE	On-Demand	Anodyne	ABCB1	61	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872169522	FE	On-Demand	Anodyne	ABCB1	61	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872169523	FE	On-Demand	Anodyne	ABCB1	61	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872169524	FE	On-Demand	Anodyne	ABCB1	61	38
CCOc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169534	GE	On-Demand	Anodyne	ACOX1	52	32
CCOc1ccc(OC[C@@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169534	GE	On-Demand	Anodyne	ABCB1	63	42
CCOc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169535	GE	On-Demand	Anodyne	ACOX1	52	32
CCOc1ccc(OC[C@H](O)CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169535	GE	On-Demand	Anodyne	ABCB1	63	42
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169549	EI	On-Demand	Anodyne	SLC6A3	41	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169549	EI	On-Demand	Anodyne	KCNH2	16	46
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169549	EI	On-Demand	Anodyne	ACACA	23	42
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169549	EI	On-Demand	Anodyne	ACACB	23	42
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2	ZINC000872169549	EI	On-Demand	Anodyne	GLRA1	40	31
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169550	EI	On-Demand	Anodyne	SLC6A3	41	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169550	EI	On-Demand	Anodyne	KCNH2	16	46
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169550	EI	On-Demand	Anodyne	ACACA	23	42
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169550	EI	On-Demand	Anodyne	ACACB	23	42
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2	ZINC000872169550	EI	On-Demand	Anodyne	GLRA1	40	31
O=C(O)[C@]12CCC[C@H]1N(CCc1nc(-c3cccc(Cl)c3)no1)CC2	ZINC000872169560	FG	On-Demand	Anodyne	GRM5	23	47
COc1ccc(-c2noc([C@H](C)N3CC[C@]4(C(=O)O)CCC[C@H]34)n2)cc1	ZINC000872169563	FG	On-Demand	Anodyne	CPT1A	15	40
COc1ccc(-c2noc([C@@H](C)N3CC[C@]4(C(=O)O)CCC[C@H]34)n2)cc1	ZINC000872169564	FG	On-Demand	Anodyne	CPT1A	15	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169567	EE	On-Demand	Anodyne	ADRB1	17	47
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169567	EE	On-Demand	Anodyne	HTR1A	17	52
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169567	EE	On-Demand	Anodyne	SLC6A4	22	48
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169568	EE	On-Demand	Anodyne	ADRB1	17	47
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169568	EE	On-Demand	Anodyne	HTR1A	17	52
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3[nH]ccc13)CC2	ZINC000872169568	EE	On-Demand	Anodyne	SLC6A4	22	48
CCOc1ccc(-c2nc(CN3CC[C@]4(C(=O)O)CCC[C@H]34)cs2)cc1	ZINC000872169577	FI	On-Demand	Anodyne	PPARD	18	42
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc(Cl)cc1)CC2	ZINC000872169588	DG	On-Demand	Anodyne	LTA4H	24	48
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc(Cl)cc1)CC2	ZINC000872169588	DG	On-Demand	Anodyne	HRH3	59	44
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc(Cl)cc1)CC2	ZINC000872169588	DG	On-Demand	Anodyne	EBP	16	44
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc(Cl)cc1)CC2	ZINC000872169588	DG	On-Demand	Anodyne	CHRNA10	18	40
O=C(O)[C@]12CCC[C@H]1N(Cc1ncc(-c3ccc(Cl)cc3)o1)CC2	ZINC000872169601	EH	On-Demand	Anodyne	NPPA	21	41
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc3ccccc13)CC2	ZINC000872169605	EH	On-Demand	Anodyne	MCL1	46	44
CS(=O)(=O)c1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169614	FE	On-Demand	Anodyne	HRH3	48	41
CS(=O)(=O)c1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169614	FE	On-Demand	Anodyne	MMP13	49	41
CS(=O)(=O)c1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169614	FE	On-Demand	Anodyne	ADAM17	47	41
CS(=O)(=O)c1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169614	FE	On-Demand	Anodyne	MMP9	22	41
O=C(O)[C@]12CCC[C@H]1N(CCCc1cccc3ccccc13)CC2	ZINC000872169620	DI	On-Demand	Anodyne	EBP	42	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169623	EE	On-Demand	Anodyne	SLC6A3	18	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169623	EE	On-Demand	Anodyne	SLC18A3	17	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169623	EE	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169624	EE	On-Demand	Anodyne	SLC6A3	18	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169624	EE	On-Demand	Anodyne	SLC18A3	17	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1Br	ZINC000872169624	EE	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169625	EE	On-Demand	Anodyne	SLC6A3	18	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169625	EE	On-Demand	Anodyne	SLC18A3	17	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169625	EE	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169626	EE	On-Demand	Anodyne	SLC6A3	18	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169626	EE	On-Demand	Anodyne	SLC18A3	17	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1Br	ZINC000872169626	EE	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1CN(C[C@H](O)COc2ccccc2F)C[C@@H]1C(F)(F)F	ZINC000872169631	FD	On-Demand	Anodyne	ABCB1	81	45
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccccc2F)C[C@@H]1C(F)(F)F	ZINC000872169632	FD	On-Demand	Anodyne	ABCB1	81	45
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169633	FE	On-Demand	Anodyne	ACOX1	43	30
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169633	FE	On-Demand	Anodyne	EBP	17	41
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169633	FE	On-Demand	Anodyne	ABCB1	54	42
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169637	FE	On-Demand	Anodyne	ACOX1	43	30
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169637	FE	On-Demand	Anodyne	EBP	17	41
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2)C[C@@H]1C(F)(F)F	ZINC000872169637	FE	On-Demand	Anodyne	ABCB1	54	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169648	GH	On-Demand	Anodyne	CPT1A	43	32
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169648	GH	On-Demand	Anodyne	ABCB1	46	41
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169650	GH	On-Demand	Anodyne	CPT1A	43	32
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(Oc3ccccc3)cc1)CC2	ZINC000872169650	GH	On-Demand	Anodyne	ABCB1	46	41
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	HRH3	85	46
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	SIGMAR1	20	40
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	MMP13	30	44
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	PPARD	17	41
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	EBP	28	40
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	PLA2G4B	47	32
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	MMP9	23	44
COc1ccc(OCCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169651	EF	On-Demand	Anodyne	MEN1	43	34
C[C@@H](CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169652	DF	On-Demand	Anodyne	SLC6A4	28	42
C[C@@H](CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169652	DF	On-Demand	Anodyne	SLC6A3	73	42
C[C@@H](CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169652	DF	On-Demand	Anodyne	GLRA1	41	36
C[C@@H](CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169652	DF	On-Demand	Anodyne	ACHP_LYMST	24	41
C[C@@H](CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169652	DF	On-Demand	Anodyne	Q8WSF8_APLCA	37	41
O=C(O)[C@@]12CCC[C@@H]1N(CC[C@@H](O)c1ccccc1)CC2	ZINC000872169653	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
O=C(O)[C@@]12CCC[C@@H]1N(CC[C@H](O)c1ccccc1)CC2	ZINC000872169655	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
C[C@@H](CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169656	DF	On-Demand	Anodyne	SLC6A4	28	42
C[C@@H](CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169656	DF	On-Demand	Anodyne	SLC6A3	73	42
C[C@@H](CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169656	DF	On-Demand	Anodyne	GLRA1	41	36
C[C@@H](CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169656	DF	On-Demand	Anodyne	ACHP_LYMST	24	41
C[C@@H](CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)OCc1ccccc1	ZINC000872169656	DF	On-Demand	Anodyne	Q8WSF8_APLCA	37	41
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169662	CE	On-Demand	Anodyne	CHRM1	15	42
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169662	CE	On-Demand	Anodyne	SLC6A4	19	42
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169662	CE	On-Demand	Anodyne	SLC6A3	48	42
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169662	CE	On-Demand	Anodyne	ACHP_LYMST	23	41
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169662	CE	On-Demand	Anodyne	Q8WSF8_APLCA	32	41
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169664	CE	On-Demand	Anodyne	CHRM1	15	42
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169664	CE	On-Demand	Anodyne	SLC6A4	19	42
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169664	CE	On-Demand	Anodyne	SLC6A3	48	42
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169664	CE	On-Demand	Anodyne	ACHP_LYMST	23	41
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccccc1	ZINC000872169664	CE	On-Demand	Anodyne	Q8WSF8_APLCA	32	41
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	HTR1A	98	53
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	DRD2	51	53
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	DRD4	40	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	HTR2A	57	53
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	HTR2C	18	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	SLC6A4	17	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	ADRA1A	18	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	DRD3	53	45
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	HTR4	20	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	DRD5	19	43
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	HTR7	105	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	SIGMAR1	28	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169671	EE	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	HTR1A	98	53
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	DRD2	51	53
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	DRD4	40	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	HTR2A	57	53
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	HTR2C	18	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	SLC6A4	17	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	ADRA1A	18	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	DRD3	53	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	HTR4	20	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	DRD5	19	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	HTR7	105	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	SIGMAR1	28	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCN1CCN(c2ccccc2)CC1	ZINC000872169677	EE	On-Demand	Anodyne	CYP2J2	43	30
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CF)cc1	ZINC000872169686	CF	On-Demand	Anodyne	SLC6A3	23	44
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872169689	DE	On-Demand	Bother	LTA4H	24	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(CF)cc1	ZINC000872169690	CF	On-Demand	Anodyne	SLC6A3	23	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169692	EE	On-Demand	Anodyne	SLC6A3	15	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169692	EE	On-Demand	Anodyne	SLC18A3	15	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169692	EE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169693	EE	On-Demand	Anodyne	SLC6A3	15	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169693	EE	On-Demand	Anodyne	SLC18A3	15	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169693	EE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169694	EE	On-Demand	Anodyne	SLC6A3	15	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169694	EE	On-Demand	Anodyne	SLC18A3	15	63
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Br)c1	ZINC000872169694	EE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169695	EE	On-Demand	Anodyne	SLC6A3	15	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169695	EE	On-Demand	Anodyne	SLC18A3	15	63
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Br)c1	ZINC000872169695	EE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCc1ccccc1Cl	ZINC000872169708	CG	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCc1ccccc1Cl	ZINC000872169709	CG	On-Demand	Anodyne	SLC6A3	36	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)cc1	ZINC000872169714	CD	On-Demand	Anodyne	SLC6A3	47	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)cc1	ZINC000872169714	CD	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)cc1	ZINC000872169715	CD	On-Demand	Anodyne	SLC6A3	47	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)cc1	ZINC000872169715	CD	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)cc1	ZINC000872169716	CD	On-Demand	Anodyne	SLC6A3	47	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(F)cc1	ZINC000872169716	CD	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)cc1	ZINC000872169717	CD	On-Demand	Anodyne	SLC6A3	47	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(F)cc1	ZINC000872169717	CD	On-Demand	Anodyne	Q8WSF8_APLCA	28	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Br)cc1	ZINC000872169722	EE	On-Demand	Anodyne	SLC6A3	20	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Br)cc1	ZINC000872169722	EE	On-Demand	Anodyne	Q8WSF8_APLCA	29	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Br)cc1	ZINC000872169723	EE	On-Demand	Anodyne	SLC6A3	20	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Br)cc1	ZINC000872169723	EE	On-Demand	Anodyne	Q8WSF8_APLCA	29	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Br)cc1	ZINC000872169724	EE	On-Demand	Anodyne	SLC6A3	20	58
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Br)cc1	ZINC000872169724	EE	On-Demand	Anodyne	Q8WSF8_APLCA	29	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Br)cc1	ZINC000872169725	EE	On-Demand	Anodyne	SLC6A3	20	58
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Br)cc1	ZINC000872169725	EE	On-Demand	Anodyne	Q8WSF8_APLCA	29	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1F	ZINC000872169726	CD	On-Demand	Anodyne	SLC6A3	27	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1F	ZINC000872169726	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1F	ZINC000872169727	CD	On-Demand	Anodyne	SLC6A3	27	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccccc1F	ZINC000872169727	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1F	ZINC000872169728	CD	On-Demand	Anodyne	SLC6A3	27	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1F	ZINC000872169728	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1F	ZINC000872169729	CD	On-Demand	Anodyne	SLC6A3	27	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccccc1F	ZINC000872169729	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169734	CD	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169734	CD	On-Demand	Anodyne	SLC6A3	37	52
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169734	CD	On-Demand	Anodyne	MME	40	36
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169735	CD	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169735	CD	On-Demand	Anodyne	SLC6A3	37	52
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169735	CD	On-Demand	Anodyne	MME	40	36
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169736	CD	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169736	CD	On-Demand	Anodyne	SLC6A3	37	52
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000872169736	CD	On-Demand	Anodyne	MME	40	36
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169737	CD	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169737	CD	On-Demand	Anodyne	SLC6A3	37	52
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)Cc1ccccc1	ZINC000872169737	CD	On-Demand	Anodyne	MME	40	36
CCCc1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1	ZINC000872169738	CG	On-Demand	Anodyne	SLC6A3	28	44
CCCc1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1	ZINC000872169739	CG	On-Demand	Anodyne	SLC6A3	28	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc(Cl)ccc1OCC1CC1	ZINC000872169740	EH	On-Demand	Anodyne	PTGER1	34	48
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cc(Cl)ccc1OCC1CC1	ZINC000872169741	EH	On-Demand	Anodyne	PTGER1	34	48
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc2ccccc12	ZINC000872169750	DF	On-Demand	Anodyne	SLC6A3	16	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc2ccccc12	ZINC000872169750	DF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C(O)[C@]12CCC[C@H]1N(CCCOCCc1ccccc1)CC2	ZINC000872169752	DF	On-Demand	Anodyne	PREP	43	35
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COCc1ccccc1)CC2	ZINC000872169754	DD	On-Demand	Anodyne	SLC12A5	49	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COCc1ccccc1)CC2	ZINC000872169755	DD	On-Demand	Anodyne	SLC12A5	49	37
COc1cc(CN2CC[C@]3(C(=O)O)CCC[C@H]23)ccc1Cl	ZINC000872169758	DG	On-Demand	Anodyne	HTR4	63	38
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872169761	EG	On-Demand	Anodyne	LTA4H	28	45
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(C(F)(F)F)cc1)CC2	ZINC000872169761	EG	On-Demand	Anodyne	PPARD	15	40
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(OCc3cccnc3)cc1)CC2	ZINC000872169762	FG	On-Demand	Anodyne	SLC6A5	16	43
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(OCc3cccnc3)cc1)CC2	ZINC000872169762	FG	On-Demand	Anodyne	VCP	41	33
O=C(O)[C@]12CCC[C@H]1N(Cc1cc3ccccc3o1)CC2	ZINC000872169763	CG	On-Demand	Anodyne	HRH3	16	41
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc3ccccc3c1)CC2	ZINC000872169766	EH	On-Demand	Anodyne	LTA4H	34	40
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc3ccccc3c1)CC2	ZINC000872169766	EH	On-Demand	Anodyne	HRH3	16	40
COCCc1ccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169784	FD	On-Demand	Anodyne	ADRB1	32	46
COCCc1ccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169784	FD	On-Demand	Anodyne	ABCB1	37	40
COCCc1ccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169785	FD	On-Demand	Anodyne	ADRB1	32	46
COCCc1ccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872169785	FD	On-Demand	Anodyne	ABCB1	37	40
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169793	FH	On-Demand	Anodyne	HRH2	22	43
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169793	FH	On-Demand	Anodyne	EPHX2	18	46
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169793	FH	On-Demand	Anodyne	CHRNA10	32	48
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169793	FH	On-Demand	Anodyne	LIPG	41	32
O=C(O)[C@]12CCC[C@H]1N(CCCOc1cccc(C(F)(F)F)c1)CC2	ZINC000872169793	FH	On-Demand	Anodyne	PDS	41	40
O=C(O)[C@]12CCC[C@H]1N(Cc1ccccc1[N+](=O)[O-])CC2	ZINC000872169816	CE	On-Demand	Bother	COLA	55	31
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc2ccccc12	ZINC000872169819	DF	On-Demand	Anodyne	SLC6A3	16	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc2ccccc12	ZINC000872169819	DF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1OC(F)F	ZINC000872169820	FF	On-Demand	Anodyne	S1PR1	19	46
COc1cc(CN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)ccc1OC(F)F	ZINC000872169820	FF	On-Demand	Anodyne	S1PR5	23	46
CCCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169821	FG	On-Demand	Anodyne	LTA4H	42	41
CCCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169821	FG	On-Demand	Anodyne	PLA2G4B	74	35
CCCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169821	FG	On-Demand	Anodyne	PSMB1	42	37
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	PPARG	16	40
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	LTA4H	51	44
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	HRH3	34	40
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	MMP13	28	43
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	MMP9	25	43
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	MMP1	26	43
COc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169826	EE	On-Demand	Anodyne	PSMB1	42	37
CN(CCN1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2)Cc1ccc(F)cc1	ZINC000872169827	DE	On-Demand	Anodyne	SLC6A3	38	42
CN(CCN1[C@H]2CC[C@H]1[C@H](C(=O)O)C2)Cc1ccc(F)cc1	ZINC000872169828	DE	On-Demand	Anodyne	SLC6A3	38	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872169829	CE	On-Demand	Anodyne	SLC6A3	28	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872169829	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Cl)c1	ZINC000872169830	CE	On-Demand	Anodyne	SLC6A3	28	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Cl)c1	ZINC000872169830	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Cl)c1	ZINC000872169831	CE	On-Demand	Anodyne	SLC6A3	28	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1cccc(Cl)c1	ZINC000872169831	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872169832	CE	On-Demand	Anodyne	SLC6A3	28	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1cccc(Cl)c1	ZINC000872169832	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cncn1Cc1ccccc1	ZINC000872169837	DE	On-Demand	Anodyne	SLC6A3	19	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cncn1Cc1ccccc1	ZINC000872169838	DE	On-Demand	Anodyne	SLC6A3	19	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169865	FE	On-Demand	Anodyne	PTGFR	42	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169865	FE	On-Demand	Anodyne	PDS	49	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169866	FE	On-Demand	Anodyne	PTGFR	42	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169866	FE	On-Demand	Anodyne	PDS	49	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169867	FE	On-Demand	Anodyne	PTGFR	42	38
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169867	FE	On-Demand	Anodyne	PDS	49	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169868	FE	On-Demand	Anodyne	PTGFR	42	38
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872169868	FE	On-Demand	Anodyne	PDS	49	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCCc1ccccc1Br	ZINC000872169878	EG	On-Demand	Anodyne	SLC6A3	26	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCCc1ccccc1Br	ZINC000872169879	EG	On-Demand	Anodyne	SLC6A3	26	42
O=C(O)[C@@H]1CN(CCc2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC000872169880	DG	On-Demand	Anodyne	SLC6A1	44	34
O=C(O)[C@H]1CN(C[C@H](O)COc2ccccc2Cl)C[C@@H]1C(F)(F)F	ZINC000872169885	FE	On-Demand	Anodyne	ABCB1	80	44
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccccc2Cl)C[C@@H]1C(F)(F)F	ZINC000872169886	FE	On-Demand	Anodyne	ABCB1	80	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1ccccc1F	ZINC000872169887	CE	On-Demand	Anodyne	SLC6A4	18	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2CCc1ccccc1F	ZINC000872169887	CE	On-Demand	Anodyne	SLC6A3	53	45
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1ccccc1F	ZINC000872169888	CE	On-Demand	Anodyne	SLC6A4	18	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2CCc1ccccc1F	ZINC000872169888	CE	On-Demand	Anodyne	SLC6A3	53	45
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872169891	FD	On-Demand	Anodyne	ABCB1	68	53
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc(F)cc2)C[C@@H]1C(F)(F)F	ZINC000872169892	FD	On-Demand	Anodyne	ABCB1	68	53
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000872169901	EE	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000872169901	EE	On-Demand	Anodyne	ABCB1	62	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000872169902	EE	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000872169902	EE	On-Demand	Anodyne	ABCB1	62	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000872169903	EE	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000872169903	EE	On-Demand	Anodyne	ABCB1	62	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000872169904	EE	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000872169904	EE	On-Demand	Anodyne	ABCB1	62	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(F)cc1	ZINC000872169905	DD	On-Demand	Anodyne	SLC6A3	29	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(F)cc1	ZINC000872169905	DD	On-Demand	Anodyne	ABCB1	23	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(F)cc1	ZINC000872169906	DD	On-Demand	Anodyne	SLC6A3	29	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(F)cc1	ZINC000872169906	DD	On-Demand	Anodyne	ABCB1	23	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(F)cc1	ZINC000872169907	DD	On-Demand	Anodyne	SLC6A3	29	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(F)cc1	ZINC000872169907	DD	On-Demand	Anodyne	ABCB1	23	46
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(F)cc1	ZINC000872169908	DD	On-Demand	Anodyne	SLC6A3	29	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(F)cc1	ZINC000872169908	DD	On-Demand	Anodyne	ABCB1	23	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872169916	EF	On-Demand	Anodyne	Q8WSF8_APLCA	19	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872169917	EF	On-Demand	Anodyne	Q8WSF8_APLCA	19	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872169918	EF	On-Demand	Anodyne	Q8WSF8_APLCA	19	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872169919	EF	On-Demand	Anodyne	Q8WSF8_APLCA	19	42
O=C(O)[C@@H]1CN(Cc2noc(-c3ccsc3)n2)C[C@H]1C(F)(F)F	ZINC000872169922	EE	On-Demand	Anodyne	S1PR1	19	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000872169925	EF	On-Demand	Anodyne	ACHP_LYMST	19	42
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000872169925	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000872169926	EF	On-Demand	Anodyne	ACHP_LYMST	19	42
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000872169926	EF	On-Demand	Anodyne	Q8WSF8_APLCA	27	42
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc3ccccc3c2)C[C@@H]1C(F)(F)F	ZINC000872169928	GF	On-Demand	Anodyne	ACOX1	80	40
O=C(O)[C@H]1CN(C[C@@H](O)COc2ccc3ccccc3c2)C[C@@H]1C(F)(F)F	ZINC000872169928	GF	On-Demand	Anodyne	ABCB1	74	43
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc3ccccc3c2)C[C@@H]1C(F)(F)F	ZINC000872169929	GF	On-Demand	Anodyne	ACOX1	80	40
O=C(O)[C@H]1CN(C[C@H](O)COc2ccc3ccccc3c2)C[C@@H]1C(F)(F)F	ZINC000872169929	GF	On-Demand	Anodyne	ABCB1	74	43
CCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169937	EF	On-Demand	Anodyne	HRH2	18	40
CCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169937	EF	On-Demand	Anodyne	LTA4H	49	44
CCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169937	EF	On-Demand	Anodyne	HRH3	28	40
CCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169937	EF	On-Demand	Anodyne	PLA2G4B	55	33
CCOc1ccc(OCCN2C[C@H](C(=O)O)[C@@H](C(F)(F)F)C2)cc1	ZINC000872169937	EF	On-Demand	Anodyne	PSMB1	42	37
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000872169938	DE	On-Demand	Anodyne	SLC6A3	31	49
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)c(F)c1	ZINC000872169939	DE	On-Demand	Anodyne	SLC6A3	31	49
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)c1ccc(Cl)c(F)c1	ZINC000872169940	DE	On-Demand	Anodyne	SLC6A3	31	49
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000872169941	DE	On-Demand	Anodyne	SLC6A3	31	49
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000872169946	CF	On-Demand	Anodyne	SLC6A3	29	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000872169947	CF	On-Demand	Anodyne	SLC6A3	29	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCCC2)cc1	ZINC000872169948	CH	On-Demand	Anodyne	SLC6A3	32	44
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCCC2)cc1	ZINC000872169948	CH	On-Demand	Anodyne	S1PR5	21	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCCC2)cc1	ZINC000872169949	CH	On-Demand	Anodyne	SLC6A3	32	44
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(C2CCCC2)cc1	ZINC000872169949	CH	On-Demand	Anodyne	S1PR5	21	43
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000872169950	EE	On-Demand	Anodyne	SLC6A3	27	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000872169950	EE	On-Demand	Anodyne	EBP	17	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000872169951	EE	On-Demand	Anodyne	SLC6A3	27	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000872169951	EE	On-Demand	Anodyne	EBP	17	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000872169952	EE	On-Demand	Anodyne	SLC6A3	27	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000872169952	EE	On-Demand	Anodyne	EBP	17	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000872169953	EE	On-Demand	Anodyne	SLC6A3	27	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000872169953	EE	On-Demand	Anodyne	EBP	17	40
C[C@@H](c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1)C(F)(F)F	ZINC000872169954	EH	On-Demand	Anodyne	SLC6A3	36	42
C[C@@H](c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1)C(F)(F)F	ZINC000872169955	EH	On-Demand	Anodyne	SLC6A3	36	42
C[C@H](c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1)C(F)(F)F	ZINC000872169956	EH	On-Demand	Anodyne	SLC6A3	36	42
C[C@H](c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1)C(F)(F)F	ZINC000872169957	EH	On-Demand	Anodyne	SLC6A3	36	42
COc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872169962	FE	On-Demand	Anodyne	S1PR4	30	46
COc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872169962	FE	On-Demand	Anodyne	S1PR1	36	46
COc1ccc(-c2noc(CN3C[C@H](C(=O)O)[C@@H](C(F)(F)F)C3)n2)cc1	ZINC000872169962	FE	On-Demand	Anodyne	S1PR5	47	46
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169963	FG	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169963	FG	On-Demand	Anodyne	ABCB1	44	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169964	FG	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169964	FG	On-Demand	Anodyne	ABCB1	44	39
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169965	FG	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169965	FG	On-Demand	Anodyne	ABCB1	44	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169966	FG	On-Demand	Anodyne	SLC6A3	22	40
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872169966	FG	On-Demand	Anodyne	ABCB1	44	39
O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cc2ccccc2s1	ZINC000872169978	CG	On-Demand	Anodyne	AROQ	24	40
O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc2ccccc2s1	ZINC000872169979	CG	On-Demand	Anodyne	AROQ	24	40
CCNCc1noc(-c2ccc(-c3ccccc3OC)s2)n1	ZINC000872170205	DH	On-Demand	Anodyne	LUCI_PHOPE	31	42
CCNCc1noc(-c2ccc(-c3cnn(C)c3)cc2)n1	ZINC000872170247	CE	On-Demand	Anodyne	ALOX5AP	24	47
CCNCc1noc(-c2ccc(C)c(-c3cnn(C)c3)c2)n1	ZINC000872170271	CF	On-Demand	Anodyne	ALOX5AP	15	40
Fc1c(Cl)cccc1-c1cc(-c2nc(C3CCNCC3)no2)on1	ZINC000872170349	EH	On-Demand	Anodyne	CHRNA4	19	52
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(F)cc1)CC2	ZINC000872170406	DD	On-Demand	Anodyne	ABCB1	30	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000872170407	DD	On-Demand	Anodyne	ABCB1	30	45
Cn1cc(-c2ccc(-c3nc(CC4CCNCC4)no3)cc2)cn1	ZINC000872170415	DF	On-Demand	Anodyne	ALOX5AP	20	43
O=C(O)[C@]12CCC[C@H]1N(C(c1ccccc1)c1ccccc1)CC2	ZINC000872170447	DI	On-Demand	Anodyne	OPRL1	29	47
Cc1ccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872170455	DE	On-Demand	Anodyne	ACOX1	55	34
Cc1ccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872170461	DE	On-Demand	Anodyne	ACOX1	55	34
O=C(O)[C@]12CCC[C@H]1N(CCCOc1ccc(F)cc1)CC2	ZINC000872170467	DF	On-Demand	Anodyne	HRH3	58	44
NCCc1noc(-c2ccc(C3CCOCC3)cc2)n1	ZINC000872170503	CE	On-Demand	Anodyne	S1PR5	27	45
O=C(NCCc1nc(C2CCNCC2)no1)c1cc2ccccc2[nH]1	ZINC000872170525	ED	On-Demand	Anodyne	PYGL	47	36
O=C(NCCc1nc(C2CCNCC2)no1)c1cc2ccccc2[nH]1	ZINC000872170525	ED	On-Demand	Anodyne	PLD2	28	42
O=C(O)[C@]12CCC[C@H]1N(Cc1nc(-c3ccc(Cl)cc3)no1)CC2	ZINC000872170562	EG	On-Demand	Anodyne	CPT1A	20	42
O=C(O)[C@]12CCC[C@H]1N(CCOc1cccc(Cl)c1)CC2	ZINC000872170567	DG	On-Demand	Anodyne	CHRNA10	38	46
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(-c3ccccc3)cc1)CC2	ZINC000872170600	DI	On-Demand	Anodyne	DRD4	15	41
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc(-c3ccccc3)cc1)CC2	ZINC000872170600	DI	On-Demand	Anodyne	SIGMAR1	31	41
NC1CCN(c2ccc(-c3noc([C@@H]4OCCO[C@@H]4C(F)(F)F)n3)cc2)CC1	ZINC000872170657	GF	On-Demand	Anodyne	ETHR	39	40
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc3ccccc3c1)CC2	ZINC000872170690	CH	On-Demand	Anodyne	CCR3	27	40
CCCOc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872170724	EG	On-Demand	Anodyne	LTA4H	35	42
CCCOc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872170724	EG	On-Demand	Anodyne	PLA2G4B	52	33
COCC1(N(C)Cc2nc3ccccc3c(-c3ccccc3)c2C(=O)O)CCC1	ZINC000872170758	GJ	On-Demand	Anodyne	TSPO	23	46
COCc1ccc(-c2nc(-c3ccc(N4CCC(N)CC4)nc3)no2)cc1F	ZINC000872170773	GG	On-Demand	Anodyne	SCARB1	40	33
COCC1(N(C)CCOc2cccc(C(=O)O)c2)CCC1	ZINC000872170795	CE	On-Demand	Anodyne	PLA2G4B	48	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3ccccc13)CC2	ZINC000872170800	FF	On-Demand	Anodyne	ADRB2	18	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3ccccc13)CC2	ZINC000872170800	FF	On-Demand	Anodyne	ADRB1	15	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cccc3ccccc13)CC2	ZINC000872170800	FF	On-Demand	Anodyne	ABCB1	70	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3ccccc13)CC2	ZINC000872170803	FF	On-Demand	Anodyne	ADRB2	18	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3ccccc13)CC2	ZINC000872170803	FF	On-Demand	Anodyne	ADRB1	15	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cccc3ccccc13)CC2	ZINC000872170803	FF	On-Demand	Anodyne	ABCB1	70	45
O=C(O)[C@]12CCC[C@H]1N(Cc1ccccc1Oc1ccccc1)CC2	ZINC000872170813	EI	On-Demand	Anodyne	CCR8	36	46
O=C(O)[C@]12CCC[C@H]1N(Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000872170903	CE	On-Demand	Bother	KCNJ1	24	40
CCNCc1noc(-c2ccc(C3CCOCC3)cc2)n1	ZINC000872170966	CF	On-Demand	Anodyne	S1PR4	24	40
CCNCc1noc(-c2ccc(C3CCOCC3)cc2)n1	ZINC000872170966	CF	On-Demand	Anodyne	S1PR5	32	41
COc1ccc(-c2noc(CN3CC[C@]4(C(=O)O)CCC[C@H]34)n2)cc1	ZINC000872171040	EF	On-Demand	Anodyne	CPT1A	31	45
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COC(c1ccccc1)c1ccccc1)CC2	ZINC000872171051	GG	On-Demand	Anodyne	SLC6A3	28	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COC(c1ccccc1)c1ccccc1)CC2	ZINC000872171054	GG	On-Demand	Anodyne	SLC6A3	28	40
O=C(O)[C@]12CCC[C@H]1N(CCCc1nc(-c3cccs3)no1)CC2	ZINC000872171100	EG	On-Demand	Anodyne	ETHR	47	44
COCC1(N(C)Cc2csc(-c3ccc(C(=O)O)cc3)n2)CCC1	ZINC000872171180	EH	On-Demand	Anodyne	AVPR1B	15	50
COCC1(N(C)Cc2csc(-c3ccc(C(=O)O)cc3)n2)CCC1	ZINC000872171180	EH	On-Demand	Anodyne	RARG	18	42
COCC1(N(C)Cc2csc(-c3ccc(C(=O)O)cc3)n2)CCC1	ZINC000872171180	EH	On-Demand	Anodyne	RARB	31	42
Nc1ccc(Cc2noc(-c3ccc(C4CCOCC4)cc3)n2)cc1	ZINC000872171283	EH	On-Demand	Clean	S1PR4	20	41
Nc1ccc(Cc2noc(-c3ccc(C4CCOCC4)cc3)n2)cc1	ZINC000872171283	EH	On-Demand	Clean	S1PR5	24	41
c1cc(COc2ccc(Cc3nc(C4CCNCC4)no3)cc2)ccn1	ZINC000872171349	FG	On-Demand	Anodyne	TPSAB1	42	33
CCOc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171437	DF	On-Demand	Anodyne	LTA4H	38	42
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872171453	DH	On-Demand	Anodyne	TACR1	47	37
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872171453	DH	On-Demand	Anodyne	CACNA1B	29	40
O=C(O)[C@]12CCC[C@H]1N(Cc1cccc(C(F)(F)F)c1)CC2	ZINC000872171453	DH	On-Demand	Anodyne	CCR2	58	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccccc1F)CC2	ZINC000872171500	DD	On-Demand	Anodyne	ABCB1	62	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccccc1F)CC2	ZINC000872171502	DD	On-Demand	Anodyne	ABCB1	62	42
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Br)cc1)CC2	ZINC000872171521	FG	On-Demand	Anodyne	LTA4H	34	42
COCC1(N(C)CCOc2ccccc2C(=O)O)CCC1	ZINC000872171585	CE	On-Demand	Anodyne	HCN1	75	35
COCC1(N(C)CCOc2ccccc2C(=O)O)CCC1	ZINC000872171585	CE	On-Demand	Anodyne	HCN4	53	35
CCNCc1noc([C@@H]2CCc3cc(OC)ccc32)n1	ZINC000872171604	CE	On-Demand	Anodyne	PPARD	44	40
CCNCc1noc([C@H]2CCc3cc(OC)ccc32)n1	ZINC000872171606	CE	On-Demand	Anodyne	PPARD	44	40
CCNCc1noc([C@H](OCC)C2CCCC2)n1	ZINC000872171628	CE	On-Demand	Anodyne	BMP1	30	48
CCNCc1noc([C@@H](OCC)C2CCCC2)n1	ZINC000872171629	CE	On-Demand	Anodyne	BMP1	30	48
O=C(O)[C@]12CCC[C@H]1N(Cc1nc(-c3cccc(Cl)c3)no1)CC2	ZINC000872171704	EG	On-Demand	Anodyne	GRM5	25	49
c1cc(C2CCOCC2)ccc1-c1nc(C2CCNCC2)no1	ZINC000872171711	DG	On-Demand	Anodyne	S1PR5	20	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171712	GG	On-Demand	Anodyne	ADRB2	16	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171712	GG	On-Demand	Anodyne	ACOX1	43	38
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171712	GG	On-Demand	Anodyne	ABCB1	51	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171716	GG	On-Demand	Anodyne	ADRB2	16	40
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171716	GG	On-Demand	Anodyne	ACOX1	43	38
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(-c3ccccc3)cc1)CC2	ZINC000872171716	GG	On-Demand	Anodyne	ABCB1	51	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc3ccccc3c1)CC2	ZINC000872171729	FF	On-Demand	Anodyne	ACOX1	61	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc3ccccc3c1)CC2	ZINC000872171729	FF	On-Demand	Anodyne	ABCB1	45	38
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc3ccccc3c1)CC2	ZINC000872171733	FF	On-Demand	Anodyne	ACOX1	61	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc3ccccc3c1)CC2	ZINC000872171733	FF	On-Demand	Anodyne	ABCB1	45	38
O=C(NCCc1nc(CC2CCNCC2)no1)c1cc2ccccc2[nH]1	ZINC000872171741	FE	On-Demand	Anodyne	PLD2	31	43
NC1CCN(c2ccc(-c3noc(C4C[C@@H]5CCCC[C@H](C4)C5=O)n3)cc2)CC1	ZINC000872171762	GH	On-Demand	Anodyne	GRM5	17	43
O=C(O)[C@]12CCC[C@H]1N([C@@H](c1ccccc1)c1ccc(Cl)cc1)CC2	ZINC000872171817	FJ	On-Demand	Anodyne	OPRL1	26	46
O=C(O)[C@]12CCC[C@H]1N([C@H](c1ccccc1)c1ccc(Cl)cc1)CC2	ZINC000872171833	FJ	On-Demand	Anodyne	OPRL1	26	46
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccccc1F)CC2	ZINC000872171885	CF	On-Demand	Anodyne	CHRNA10	16	43
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	HRH3	72	42
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	SIGMAR1	18	43
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	MMP13	25	43
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	ADAM17	15	40
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	MMP9	23	43
COc1ccc(OCCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872171895	DF	On-Demand	Anodyne	MMP1	25	40
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171911	FE	On-Demand	Anodyne	PRCP	27	43
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171911	FE	On-Demand	Anodyne	CPT1A	53	51
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171911	FE	On-Demand	Anodyne	GRM5	18	48
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171911	FE	On-Demand	Anodyne	SPHK1	18	49
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171912	FE	On-Demand	Anodyne	PRCP	27	43
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171912	FE	On-Demand	Anodyne	CPT1A	53	51
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171912	FE	On-Demand	Anodyne	GRM5	18	48
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(N3CCC(N)CC3)cc2)no1	ZINC000872171912	FE	On-Demand	Anodyne	SPHK1	18	49
COc1ccccc1COC[C@H](O)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872171957	ED	On-Demand	Anodyne	MBTPS1	49	33
COc1ccccc1COC[C@@H](O)CN1CC[C@]2(C(=O)O)CCC[C@H]12	ZINC000872171961	ED	On-Demand	Anodyne	MBTPS1	49	33
FC(F)(F)[C@@H]1OCCO[C@@H]1c1nc(C2CCNCC2)no1	ZINC000872171964	DD	On-Demand	Anodyne	ETHR	16	40
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Cl)cc1)CC2	ZINC000872171970	DG	On-Demand	Anodyne	LTA4H	39	45
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Cl)cc1)CC2	ZINC000872171970	DG	On-Demand	Anodyne	HRH3	29	43
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Cl)cc1)CC2	ZINC000872171970	DG	On-Demand	Anodyne	EBP	16	43
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(Cl)cc1)CC2	ZINC000872171970	DG	On-Demand	Anodyne	CHRNA10	19	41
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1cc(Cl)ccc1Cl)CC2	ZINC000872171980	FG	On-Demand	Anodyne	CCR1	40	37
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1cc(Cl)ccc1Cl)CC2	ZINC000872171984	FG	On-Demand	Anodyne	CCR1	40	37
O=C(O)[C@]12CCC[C@H]1N(CCOc1ccc(F)cc1)CC2	ZINC000872172035	CF	On-Demand	Anodyne	LTA4H	41	42
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccccc1)CC2	ZINC000872172074	DD	On-Demand	Anodyne	ADRB2	18	44
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccccc1)CC2	ZINC000872172074	DD	On-Demand	Anodyne	ABCB1	55	41
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccccc1)CC2	ZINC000872172076	DD	On-Demand	Anodyne	ADRB2	18	44
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccccc1)CC2	ZINC000872172076	DD	On-Demand	Anodyne	ABCB1	55	41
CCNCc1noc(Cc2ccc(OCc3ccncc3)cc2)n1	ZINC000872172088	DF	On-Demand	Anodyne	TPSAB1	56	35
O=C(O)[C@@]12CCC[C@@H]1N(C[C@@H](O)COc1ccc(Cl)cc1Cl)CC2	ZINC000872172112	FG	On-Demand	Anodyne	CCR1	42	37
Cn1cc(-c2ccc(-c3nc(C4CCNCC4)no3)cc2)cn1	ZINC000872172113	DF	On-Demand	Anodyne	ALOX5AP	21	48
O=C(O)[C@@]12CCC[C@@H]1N(C[C@H](O)COc1ccc(Cl)cc1Cl)CC2	ZINC000872172114	FG	On-Demand	Anodyne	CCR1	42	37
COc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872172142	DE	On-Demand	Anodyne	LTA4H	40	44
COc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872172142	DE	On-Demand	Anodyne	MMP13	25	42
COc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872172142	DE	On-Demand	Anodyne	MMP9	23	42
COc1ccc(OCCN2CC[C@]3(C(=O)O)CCC[C@H]23)cc1	ZINC000872172142	DE	On-Demand	Anodyne	MMP1	23	42
CC(=O)c1cccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872172150	ED	On-Demand	Anodyne	ACOX1	41	34
CC(=O)c1cccc(OC[C@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872172150	ED	On-Demand	Anodyne	ABCB1	42	51
CC(=O)c1cccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872172153	ED	On-Demand	Anodyne	ACOX1	41	34
CC(=O)c1cccc(OC[C@@H](O)CN2CC[C@]3(C(=O)O)CCC[C@H]23)c1	ZINC000872172153	ED	On-Demand	Anodyne	ABCB1	42	51
COCc1ccc(-c2nc(-c3ccc(N4CCC(N)CC4)cc3)no2)cc1F	ZINC000872172170	GH	On-Demand	Anodyne	SCARB1	40	33
O=C(O)CCc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872172264	EE	On-Demand	Anodyne	S1PR4	31	41
O=C(O)CCc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872172264	EE	On-Demand	Anodyne	S1PR1	26	43
O=C(O)CCc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872172264	EE	On-Demand	Anodyne	SPHK1	22	41
O=C(O)CCc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872172264	EE	On-Demand	Anodyne	S1PR5	52	43
Cc1oc(-c2ccccc2)nc1Cc1noc([C@]23CCC[C@H]2CNC3)n1	ZINC000872172301	FG	On-Demand	Anodyne	PPARG	51	38
Cc1oc(-c2ccccc2)nc1Cc1noc([C@]23CCC[C@H]2CNC3)n1	ZINC000872172301	FG	On-Demand	Anodyne	PPARA	53	36
Cc1oc(-c2ccccc2)nc1Cc1noc([C@]23CCC[C@H]2CNC3)n1	ZINC000872172301	FG	On-Demand	Anodyne	PDE8B	43	33
O=C(O)COc1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872172339	ED	On-Demand	Anodyne	FABP4	48	38
O=C(O)COc1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872172339	ED	On-Demand	Anodyne	CPT1A	87	50
O=C(O)COc1cccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)c1	ZINC000872172345	EE	On-Demand	Anodyne	FABP4	47	37
O=C(O)COc1cccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)c1	ZINC000872172345	EE	On-Demand	Anodyne	CPT1A	78	49
O=C(O)COc1cccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)c1	ZINC000872172346	EE	On-Demand	Anodyne	FABP4	47	37
O=C(O)COc1cccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)c1	ZINC000872172346	EE	On-Demand	Anodyne	CPT1A	78	49
O=C(O)COc1cccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)c1	ZINC000872172347	EE	On-Demand	Anodyne	FABP4	47	37
O=C(O)COc1cccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)c1	ZINC000872172347	EE	On-Demand	Anodyne	CPT1A	78	49
O=C(O)COc1cccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)c1	ZINC000872172348	EE	On-Demand	Anodyne	FABP4	47	37
O=C(O)COc1cccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)c1	ZINC000872172348	EE	On-Demand	Anodyne	CPT1A	78	49
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(N3CCOCC3)nc2)no1	ZINC000872172352	EE	On-Demand	Mild	ADK	51	40
C=C(Cl)C[C@H](N)c1nc(-c2ccc(N3CCOCC3)nc2)no1	ZINC000872172353	EE	On-Demand	Mild	ADK	51	40
COC[C@]1(c2nc(-c3ccccc3C(F)(F)F)no2)CCCCN1	ZINC000872172379	EG	On-Demand	Anodyne	HSD11B1	19	45
COC[C@]1(c2nc(-c3ccccc3C(F)(F)F)no2)CCCCN1	ZINC000872172379	EG	On-Demand	Anodyne	HSD11B2	20	45
O=C(O)c1cccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)c1	ZINC000872172402	CE	On-Demand	Anodyne	CPT1A	16	40
O=C(O)c1cccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)c1	ZINC000872172403	CE	On-Demand	Anodyne	CPT1A	16	40
O=C(O)c1cccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)c1	ZINC000872172404	CE	On-Demand	Anodyne	CPT1A	16	40
O=C(O)c1cccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)c1	ZINC000872172405	CE	On-Demand	Anodyne	CPT1A	16	40
NCc1ncc(-c2nc(-c3ccc(CN4CCCC4)cc3)no2)cn1	ZINC000872172446	EE	On-Demand	Anodyne	HRH3	16	44
NCc1ncc(-c2nc(-c3ccc(CN4CCCC4)cc3)no2)cn1	ZINC000872172446	EE	On-Demand	Anodyne	S1PR4	27	47
NCc1ncc(-c2nc(-c3ccc(CN4CCCC4)cc3)no2)cn1	ZINC000872172446	EE	On-Demand	Anodyne	S1PR1	16	47
NCc1ncc(-c2nc(-c3ccc(CN4CCCC4)cc3)no2)cn1	ZINC000872172446	EE	On-Demand	Anodyne	S1PR5	43	46
COC[C@]1(c2nc(-c3ccc(OC(C)C)c(OC)c3)no2)CCCCN1	ZINC000872172447	FG	On-Demand	Anodyne	S1PR1	21	40
COC[C@]1(c2nc(-c3ccc(CCC(=O)O)cc3)no2)CCCCN1	ZINC000872172480	EE	On-Demand	Anodyne	SPHK1	26	42
COC[C@]1(c2nc(-c3ccc(CCC(=O)O)cc3)no2)CCCCN1	ZINC000872172480	EE	On-Demand	Anodyne	S1PR5	53	38
COC[C@]1(c2nc(-c3ccc(CCC(=O)O)cc3)no2)CCCCN1	ZINC000872172480	EE	On-Demand	Anodyne	FFAR4	41	36
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(OC(C)C)c(OC)c2)no1	ZINC000872172489	EH	On-Demand	Mild	S1PR5	17	44
C=C(Cl)C[C@H](N)c1nc(-c2ccc(OC(C)C)c(OC)c2)no1	ZINC000872172490	EH	On-Demand	Mild	S1PR5	17	44
C=C(Cl)C[C@H](N)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000872172499	EF	On-Demand	Mild	ESRRG	43	32
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000872172500	EF	On-Demand	Mild	ESRRG	43	32
NC1(Cc2nc(Cc3cc(F)cc(F)c3)no2)CCN(Cc2ccccc2)CC1	ZINC000872172563	GG	On-Demand	Anodyne	SIGMAR1	41	37
O=C(O)COc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872172600	ED	On-Demand	Anodyne	CPT1A	81	41
NC1(Cc2nc(Cc3ccccc3F)no2)CCN(Cc2ccccc2)CC1	ZINC000872172671	GG	On-Demand	Anodyne	SIGMAR1	42	40
COC[C@]1(c2nc(-c3ccc(C(=O)NC4CC4)cc3)no2)CCCCN1	ZINC000872172682	FE	On-Demand	Anodyne	SPHK1	26	41
NC[C@]1(c2nc(-c3cccc(Cn4ccnc4)c3)no2)CCCOC1	ZINC000872172781	ED	On-Demand	Anodyne	CYP11B1	25	44
NC[C@@]1(c2nc(-c3cccc(Cn4ccnc4)c3)no2)CCCOC1	ZINC000872172782	ED	On-Demand	Anodyne	CYP11B1	25	44
O=C(O)CCc1ccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)cc1	ZINC000872172818	EF	On-Demand	Anodyne	S1PR5	48	39
O=C(O)CCc1ccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)cc1	ZINC000872172819	EF	On-Demand	Anodyne	S1PR5	48	39
O=C(O)CCc1ccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)cc1	ZINC000872172820	EF	On-Demand	Anodyne	S1PR5	48	39
O=C(O)CCc1ccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)cc1	ZINC000872172821	EF	On-Demand	Anodyne	S1PR5	48	39
COC[C@]1(c2nc(-c3cccc(C(=O)O)c3)no2)CCCCN1	ZINC000872172822	DE	On-Demand	Anodyne	CPT1A	44	43
COc1ccccc1Cc1noc(/C=C\[C@H]2CCCNC2)n1	ZINC000872172837	CF	On-Demand	Anodyne	MBTPS1	51	33
COc1ccccc1Cc1noc(/C=C/[C@H]2CCCNC2)n1	ZINC000872172838	CF	On-Demand	Anodyne	MBTPS1	51	33
COc1ccccc1Cc1noc(/C=C/[C@@H]2CCCNC2)n1	ZINC000872172839	CF	On-Demand	Anodyne	MBTPS1	51	33
COc1ccccc1Cc1noc(/C=C\[C@@H]2CCCNC2)n1	ZINC000872172840	CF	On-Demand	Anodyne	MBTPS1	51	33
C=C(Cl)C[C@H](N)c1nc(-c2ccc(CN3CCCC3)cc2)no1	ZINC000872172882	EG	On-Demand	Mild	S1PR4	17	40
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(CN3CCCC3)cc2)no1	ZINC000872172883	EG	On-Demand	Mild	S1PR4	17	40
NC1(Cc2nc(-c3cc(F)cc(F)c3)no2)CCN(Cc2ccccc2)CC1	ZINC000872172919	GH	On-Demand	Anodyne	SIGMAR1	52	40
O=C(O)COc1ccccc1-c1noc(/C=C/[C@H]2CCCNC2)n1	ZINC000872172995	EE	On-Demand	Anodyne	PTGIR	52	33
O=C(O)COc1ccccc1-c1noc(/C=C/[C@@H]2CCCNC2)n1	ZINC000872172996	EE	On-Demand	Anodyne	PTGIR	52	33
O=C(O)COc1ccccc1-c1noc(/C=C\[C@@H]2CCCNC2)n1	ZINC000872172997	EE	On-Demand	Anodyne	PTGIR	52	33
O=C(O)COc1ccccc1-c1noc(/C=C\[C@H]2CCCNC2)n1	ZINC000872172998	EE	On-Demand	Anodyne	PTGIR	52	33
COC[C@]1(c2nc(-c3ccc(CC(=O)O)cc3)no2)CCCCN1	ZINC000872173025	ED	On-Demand	Anodyne	SPHK1	21	42
COC[C@]1(c2nc(-c3ccc(CC(=O)O)cc3)no2)CCCCN1	ZINC000872173025	ED	On-Demand	Anodyne	S1PR5	45	36
C(=C\[C@H]1CCCNC1)\c1nc(-c2cccc(Cn3ccnc3)c2)no1	ZINC000872173110	EF	On-Demand	Anodyne	CYP11B1	23	43
C(=C/[C@@H]1CCCNC1)\c1nc(-c2cccc(Cn3ccnc3)c2)no1	ZINC000872173111	EF	On-Demand	Anodyne	CYP11B1	23	43
C(=C/[C@H]1CCCNC1)\c1nc(-c2cccc(Cn3ccnc3)c2)no1	ZINC000872173112	EF	On-Demand	Anodyne	CYP11B1	23	43
C(=C\[C@@H]1CCCNC1)\c1nc(-c2cccc(Cn3ccnc3)c2)no1	ZINC000872173113	EF	On-Demand	Anodyne	CYP11B1	23	43
NC1(Cc2nc(Cc3ccc(F)cc3F)no2)CCN(Cc2ccccc2)CC1	ZINC000872173193	GG	On-Demand	Anodyne	SIGMAR1	37	44
N[C@@H](Cc1noc(-c2ccc(C3CCOCC3)cc2)n1)c1ccccc1	ZINC000872173198	EH	On-Demand	Anodyne	S1PR5	24	41
N[C@H](Cc1noc(-c2ccc(C3CCOCC3)cc2)n1)c1ccccc1	ZINC000872173199	EH	On-Demand	Anodyne	S1PR5	24	41
CCCOc1ccc(-c2noc(-c3oc(CN)cc3C)n2)cc1OC	ZINC000872173202	EH	On-Demand	Anodyne	DCK	44	41
COC[C@]1(c2nc(Cc3nc(-c4ccccc4)oc3C)no2)CCCCN1	ZINC000872173206	FG	On-Demand	Anodyne	PPARG	57	38
COC[C@]1(c2nc(Cc3nc(-c4ccccc4)oc3C)no2)CCCCN1	ZINC000872173206	FG	On-Demand	Anodyne	PPARA	58	38
Cc1oc(-c2ccccc2)nc1Cc1noc([C@@]2(C)CNCCO2)n1	ZINC000872173248	EE	On-Demand	Anodyne	PPARG	36	40
Cc1oc(-c2ccccc2)nc1Cc1noc([C@@]2(C)CNCCO2)n1	ZINC000872173248	EE	On-Demand	Anodyne	PPARA	40	38
Cc1oc(-c2ccccc2)nc1Cc1noc([C@]2(C)CNCCO2)n1	ZINC000872173249	EE	On-Demand	Anodyne	PPARG	36	40
Cc1oc(-c2ccccc2)nc1Cc1noc([C@]2(C)CNCCO2)n1	ZINC000872173249	EE	On-Demand	Anodyne	PPARA	40	38
CC[C@@H](NC(C)=O)c1nc(C[C@@H](N)c2ccccc2)no1	ZINC000872173283	CD	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(C)=O)c1nc(C[C@H](N)c2ccccc2)no1	ZINC000872173285	CD	On-Demand	Anodyne	TACR3	43	37
c1cc(-c2noc([C@]34CCC[C@H]3CNC4)n2)ccc1CN1CCCC1	ZINC000872173399	EF	On-Demand	Anodyne	S1PR4	29	42
c1cc(-c2noc([C@]34CCC[C@H]3CNC4)n2)ccc1CN1CCCC1	ZINC000872173399	EF	On-Demand	Anodyne	S1PR5	39	42
O=C(O)Cc1ccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)cc1	ZINC000872173469	DE	On-Demand	Anodyne	SPHK1	26	41
c1cc(Cn2ccnc2)cc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872173545	EF	On-Demand	Anodyne	CYP11B1	23	43
COc1ccccc1Cc1noc(-c2c(C)cnn2[C@H]2CCCNC2)n1	ZINC000872173621	FF	On-Demand	Anodyne	MBTPS1	43	33
COc1ccccc1Cc1noc(-c2c(C)cnn2[C@@H]2CCCNC2)n1	ZINC000872173622	FF	On-Demand	Anodyne	MBTPS1	43	33
O=C(O)COc1ccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)cc1	ZINC000872173636	EE	On-Demand	Anodyne	CPT1A	51	40
O=C(O)COc1ccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)cc1	ZINC000872173637	EE	On-Demand	Anodyne	CPT1A	51	40
O=C(O)COc1ccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)cc1	ZINC000872173638	EE	On-Demand	Anodyne	CPT1A	51	40
O=C(O)COc1ccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)cc1	ZINC000872173639	EE	On-Demand	Anodyne	CPT1A	51	40
Cc1oc(-c2ccccc2)nc1Cc1noc([C@@H](N)CN(C)C)n1	ZINC000872173640	EE	On-Demand	Anodyne	PPARG	49	39
Cc1oc(-c2ccccc2)nc1Cc1noc([C@@H](N)CN(C)C)n1	ZINC000872173640	EE	On-Demand	Anodyne	PPARA	50	38
CCOc1ccccc1-c1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872173785	GH	On-Demand	Anodyne	DRD4	17	44
CCOc1ccccc1-c1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872173785	GH	On-Demand	Anodyne	SIGMAR1	50	38
O=C(O)c1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872173801	CE	On-Demand	Anodyne	CPT1A	27	42
CCOc1ccccc1-c1noc(-c2oc(CN)cc2C)n1	ZINC000872173907	CG	On-Demand	Anodyne	LUCI_PHOPE	29	41
COC[C@]1(c2nc(-c3cccc(Cn4ccnc4)c3)no2)CCCCN1	ZINC000872173980	FF	On-Demand	Anodyne	CYP11B1	34	42
COC[C@]1(c2nc(-c3cccc(Cn4ccnc4)c3)no2)CCCCN1	ZINC000872173980	FF	On-Demand	Anodyne	CYP11B2	18	42
NC1(Cc2nc(C3Cc4ccccc4C3)no2)CCN(Cc2ccccc2)CC1	ZINC000872174023	GG	On-Demand	Anodyne	SIGMAR1	58	44
NC1(Cc2nc([C@H]3CCc4ccccc43)no2)CCN(Cc2ccccc2)CC1	ZINC000872174199	GH	On-Demand	Anodyne	SIGMAR1	55	41
NC1(Cc2nc([C@@H]3CCc4ccccc43)no2)CCN(Cc2ccccc2)CC1	ZINC000872174200	GH	On-Demand	Anodyne	SIGMAR1	55	41
CC(=O)NCCc1noc([C@@H](N)CN(C)Cc2ccccc2)n1	ZINC000872174429	DC	On-Demand	Anodyne	MTNR1A	47	38
CC(=O)NCCc1noc([C@@H](N)CN(C)Cc2ccccc2)n1	ZINC000872174429	DC	On-Demand	Anodyne	MTNR1B	42	37
CC(=O)NCCc1noc([C@H](N)CN(C)Cc2ccccc2)n1	ZINC000872174430	DC	On-Demand	Anodyne	MTNR1A	47	38
CC(=O)NCCc1noc([C@H](N)CN(C)Cc2ccccc2)n1	ZINC000872174430	DC	On-Demand	Anodyne	MTNR1B	42	37
CN1C[C@@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)CC1=O	ZINC000872174439	FD	On-Demand	Anodyne	SIGMAR1	48	36
CN1C[C@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)CC1=O	ZINC000872174440	FD	On-Demand	Anodyne	SIGMAR1	48	36
NC1(Cc2nc(-c3ccc4nc[nH]c4c3)no2)CCN(Cc2ccccc2)CC1	ZINC000872174617	GG	On-Demand	Anodyne	QPCT	26	41
NC1(Cc2nc(-c3cncc4ccccc34)no2)CCN(Cc2ccccc2)CC1	ZINC000872174662	GH	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)N1CCC[C@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174700	GE	On-Demand	Anodyne	SIGMAR1	40	37
CC(=O)N1CCC[C@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174700	GE	On-Demand	Anodyne	NPFFR1	40	33
CC(=O)N1CCC[C@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174700	GE	On-Demand	Anodyne	SLC12A5	44	32
CC(=O)N1CCC[C@@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174701	GE	On-Demand	Anodyne	SIGMAR1	40	37
CC(=O)N1CCC[C@@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174701	GE	On-Demand	Anodyne	NPFFR1	40	33
CC(=O)N1CCC[C@@H](c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)C1	ZINC000872174701	GE	On-Demand	Anodyne	SLC12A5	44	32
NC1(Cc2nc(CC3CCOCC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872175055	FF	On-Demand	Anodyne	SIGMAR1	46	36
COCCOc1cccc(-c2noc(-c3c(C)cnn3[C@H]3CCCNC3)n2)c1	ZINC000872175185	GF	On-Demand	Anodyne	CPT1A	43	36
COCCOc1cccc(-c2noc(-c3c(C)cnn3[C@@H]3CCCNC3)n2)c1	ZINC000872175188	GF	On-Demand	Anodyne	CPT1A	43	36
NC(=O)Nc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)c1	ZINC000872175201	JJ	On-Demand	Anodyne	KCNK3	78	46
NC(=O)Nc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)c1	ZINC000872175201	JJ	On-Demand	Anodyne	KCNK9	69	46
C=C(Cl)C[C@@H](N)c1nc(CCC2CCCCC2)no1	ZINC000872175611	CH	On-Demand	Mild	BMP1	77	42
C=C(Cl)C[C@H](N)c1nc(CCC2CCCCC2)no1	ZINC000872175612	CH	On-Demand	Mild	BMP1	77	42
NC1(Cc2nc(-c3cccc4cnccc34)no2)CCN(Cc2ccccc2)CC1	ZINC000872175639	GH	On-Demand	Anodyne	SIGMAR1	23	42
NC[C@@]1(c2nc(-c3cccc4[nH]ccc34)no2)CCCOC1	ZINC000872175672	CE	On-Demand	Anodyne	ATR	42	38
NC[C@]1(c2nc(-c3cccc4[nH]ccc34)no2)CCCOC1	ZINC000872175673	CE	On-Demand	Anodyne	ATR	42	38
CC(=O)NCCc1noc([C@H](N)c2cccc(C(F)(F)F)c2)n1	ZINC000872175735	ED	On-Demand	Anodyne	MTNR1A	28	41
CC(=O)NCCc1noc([C@H](N)c2cccc(C(F)(F)F)c2)n1	ZINC000872175735	ED	On-Demand	Anodyne	MTNR1B	25	41
CC(=O)NCCc1noc([C@@H](N)c2cccc(C(F)(F)F)c2)n1	ZINC000872175736	ED	On-Demand	Anodyne	MTNR1A	28	41
CC(=O)NCCc1noc([C@@H](N)c2cccc(C(F)(F)F)c2)n1	ZINC000872175736	ED	On-Demand	Anodyne	MTNR1B	25	41
C[C@@H](Oc1ccccc1)c1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872175971	GH	On-Demand	Anodyne	SIGMAR1	41	38
COc1cccc([C@H](C)c2noc([C@@H](N)CN(C)C)n2)c1	ZINC000872176213	CD	On-Demand	Anodyne	AOC3	15	44
COCCCCc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872176694	FF	On-Demand	Anodyne	SIGMAR1	46	39
C=C(Cl)C[C@@H](N)c1nc(CC2CCCCC2)no1	ZINC000872176725	CG	On-Demand	Mild	BMP1	42	35
C=C(Cl)C[C@H](N)c1nc(CC2CCCCC2)no1	ZINC000872176726	CG	On-Demand	Mild	BMP1	42	35
COCc1ccc(-c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)cc1	ZINC000872176740	GG	On-Demand	Anodyne	SIGMAR1	43	40
O=C1CCCN1c1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872176745	EF	On-Demand	Anodyne	CPT1A	15	48
C[C@@H](CNC(=O)c1ccccc1)c1noc([C@@H](N)CN(C)C)n1	ZINC000872176780	DD	On-Demand	Anodyne	ITGAV	43	37
NC(=O)c1cccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)c1	ZINC000872176895	CD	On-Demand	Anodyne	CHEK1	19	41
NC(=O)c1cccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)c1	ZINC000872176896	CD	On-Demand	Anodyne	CHEK1	19	41
NC(=O)c1cccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)c1	ZINC000872176897	CD	On-Demand	Anodyne	CHEK1	19	41
NC(=O)c1cccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)c1	ZINC000872176898	CD	On-Demand	Anodyne	CHEK1	19	41
CCc1nc2ccccc2n1Cc1noc(/C=C/[C@H]2CCCNC2)n1	ZINC000872177142	EG	On-Demand	Anodyne	HRH1	19	42
CCc1nc2ccccc2n1Cc1noc(/C=C\[C@H]2CCCNC2)n1	ZINC000872177143	EG	On-Demand	Anodyne	HRH1	19	42
CCc1nc2ccccc2n1Cc1noc(/C=C\[C@@H]2CCCNC2)n1	ZINC000872177144	EG	On-Demand	Anodyne	HRH1	19	42
CCc1nc2ccccc2n1Cc1noc(/C=C/[C@@H]2CCCNC2)n1	ZINC000872177145	EG	On-Demand	Anodyne	HRH1	19	42
NCc1ncc(-c2nc(C3(c4ccccc4)CCC3)no2)cn1	ZINC000872177210	DE	On-Demand	Anodyne	ALOX5AP	41	65
C=C(Cl)C[C@@H](N)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000872177218	DH	On-Demand	Mild	ALOX5AP	21	41
C=C(Cl)C[C@H](N)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000872177219	DH	On-Demand	Mild	ALOX5AP	21	41
O=C(c1ccccc1)N(Cc1noc(/C=C/[C@H]2CCCNC2)n1)C1CC1	ZINC000872177268	FF	On-Demand	Anodyne	MBTPS1	54	31
O=C(c1ccccc1)N(Cc1noc(/C=C\[C@H]2CCCNC2)n1)C1CC1	ZINC000872177269	FF	On-Demand	Anodyne	MBTPS1	54	31
O=C(c1ccccc1)N(Cc1noc(/C=C\[C@@H]2CCCNC2)n1)C1CC1	ZINC000872177270	FF	On-Demand	Anodyne	MBTPS1	54	31
O=C(c1ccccc1)N(Cc1noc(/C=C/[C@@H]2CCCNC2)n1)C1CC1	ZINC000872177271	FF	On-Demand	Anodyne	MBTPS1	54	31
NCc1ncc(-c2nc(-c3ccccc3OCC3CCCC3)no2)cn1	ZINC000872177370	FG	On-Demand	Anodyne	LUCI_PHOPE	35	43
NC[C@@]1(c2nc(C3(c4ccccc4)CCC3)no2)CCCOC1	ZINC000872177396	DF	On-Demand	Anodyne	ALOX5AP	24	40
NC[C@]1(c2nc(C3(c4ccccc4)CCC3)no2)CCCOC1	ZINC000872177397	DF	On-Demand	Anodyne	ALOX5AP	24	40
CN1CCN(c2ccnc(-c3noc(-c4cc(N)ccc4Cl)n3)c2)CC1	ZINC000872177399	FF	On-Demand	Anodyne	HRH4	24	42
O=C(Nc1cccc(-c2noc(/C=C\[C@@H]3CCCNC3)n2)c1)c1ccco1	ZINC000872177481	FH	On-Demand	Anodyne	KISS1R	45	39
O=C(Nc1cccc(-c2noc(/C=C/[C@H]3CCCNC3)n2)c1)c1ccco1	ZINC000872177482	FH	On-Demand	Anodyne	KISS1R	45	39
O=C(Nc1cccc(-c2noc(/C=C\[C@H]3CCCNC3)n2)c1)c1ccco1	ZINC000872177483	FH	On-Demand	Anodyne	KISS1R	45	39
O=C(Nc1cccc(-c2noc(/C=C/[C@@H]3CCCNC3)n2)c1)c1ccco1	ZINC000872177485	FH	On-Demand	Anodyne	KISS1R	45	39
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177526	DE	On-Demand	Anodyne	HRH3	18	41
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177526	DE	On-Demand	Anodyne	PRCP	48	40
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177526	DE	On-Demand	Anodyne	CPT1A	71	47
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177527	DE	On-Demand	Anodyne	HRH3	18	41
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177527	DE	On-Demand	Anodyne	PRCP	48	40
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(CN)cc2F)no1	ZINC000872177527	DE	On-Demand	Anodyne	CPT1A	71	47
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(N3CCOCC3)c(F)c2)no1	ZINC000872177622	FF	On-Demand	Mild	NPY2R	16	43
C=C(Cl)C[C@H](N)c1nc(-c2ccc(N3CCOCC3)c(F)c2)no1	ZINC000872177624	FF	On-Demand	Mild	NPY2R	16	43
Nc1ccc(Cl)c(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1	ZINC000872177645	FH	On-Demand	Anodyne	DRD4	21	42
Nc1ccc(Cl)c(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1	ZINC000872177646	FH	On-Demand	Anodyne	DRD4	21	42
CC(=O)N1CCN(c2cc(-c3noc(/C=C/[C@@H]4CCCNC4)n3)ccn2)CC1	ZINC000872177662	GD	On-Demand	Anodyne	PRKD1	40	34
CC(=O)N1CCN(c2cc(-c3noc(/C=C\[C@@H]4CCCNC4)n3)ccn2)CC1	ZINC000872177663	GD	On-Demand	Anodyne	PRKD1	40	34
CC(=O)N1CCN(c2cc(-c3noc(/C=C/[C@H]4CCCNC4)n3)ccn2)CC1	ZINC000872177664	GD	On-Demand	Anodyne	PRKD1	40	34
CC(=O)N1CCN(c2cc(-c3noc(/C=C\[C@H]4CCCNC4)n3)ccn2)CC1	ZINC000872177665	GD	On-Demand	Anodyne	PRKD1	40	34
CN1CCN(C(=O)c2ccc(-c3noc([C@]45CCC[C@H]4CNC5)n3)cc2)CC1	ZINC000872177812	GD	On-Demand	Anodyne	L3MBTL3	45	40
CCC[C@H](NC(=O)c1ccccc1)c1noc([C@@H](N)CN(C)C)n1	ZINC000872177828	ED	On-Demand	Anodyne	UTS2	67	38
CCC[C@@H](NC(=O)c1ccccc1)c1noc([C@@H](N)CN(C)C)n1	ZINC000872177830	ED	On-Demand	Anodyne	UTS2	67	38
CC(=O)N1CCN(c2cc(-c3noc([C@@]4(C)CNCCO4)n3)ccn2)CC1	ZINC000872177831	FC	On-Demand	Anodyne	PRKD1	44	33
CC(=O)N1CCN(c2cc(-c3noc([C@@]4(C)CNCCO4)n3)ccn2)CC1	ZINC000872177831	FC	On-Demand	Anodyne	KARS	49	35
CC(=O)N1CCN(c2cc(-c3noc([C@]4(C)CNCCO4)n3)ccn2)CC1	ZINC000872177838	FC	On-Demand	Anodyne	PRKD1	44	33
CC(=O)N1CCN(c2cc(-c3noc([C@]4(C)CNCCO4)n3)ccn2)CC1	ZINC000872177838	FC	On-Demand	Anodyne	KARS	49	35
O=C(Nc1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1)c1ccco1	ZINC000872177842	FG	On-Demand	Anodyne	KISS1R	43	38
CC(=O)N1CCN(c2cc(-c3noc([C@]45CCC[C@H]4CNC5)n3)ccn2)CC1	ZINC000872177992	GD	On-Demand	Anodyne	PRKD1	48	35
CC(=O)N1CCN(c2cc(-c3noc([C@]45CCC[C@H]4CNC5)n3)ccn2)CC1	ZINC000872177992	GD	On-Demand	Anodyne	KARS	46	38
CCC[C@H](NC(=O)c1ccccc1)c1noc([C@@]2(COC)CCCCN2)n1	ZINC000872178273	FF	On-Demand	Anodyne	NPPA	44	39
CCC[C@H](NC(=O)c1ccccc1)c1noc([C@]2(COC)CCCCN2)n1	ZINC000872178275	FF	On-Demand	Anodyne	NPPA	44	39
CCC[C@@H](NC(=O)c1ccccc1)c1noc([C@]2(COC)CCCCN2)n1	ZINC000872178277	FF	On-Demand	Anodyne	NPPA	44	39
CCC[C@@H](NC(=O)c1ccccc1)c1noc([C@@]2(COC)CCCCN2)n1	ZINC000872178279	FF	On-Demand	Anodyne	NPPA	44	39
COC[C@]1(c2nc(CN(C(=O)c3ccccc3)C3CC3)no2)CCCCN1	ZINC000872178562	FE	On-Demand	Anodyne	MBTPS1	44	32
C=C(Cl)C[C@H](N)c1nc(-c2ccc(N3CCN(CC)CC3)c(F)c2)no1	ZINC000872178642	GG	On-Demand	Mild	NPY2R	27	47
C=C(Cl)C[C@@H](N)c1nc(-c2ccc(N3CCN(CC)CC3)c(F)c2)no1	ZINC000872178643	GG	On-Demand	Mild	NPY2R	27	47
CN1CCN(C(=O)c2ccc(-c3noc(/C=C\[C@@H]4CCCNC4)n3)cc2)CC1	ZINC000872178807	GE	On-Demand	Anodyne	L3MBTL3	48	40
CN1CCN(C(=O)c2ccc(-c3noc(/C=C/[C@@H]4CCCNC4)n3)cc2)CC1	ZINC000872178808	GE	On-Demand	Anodyne	L3MBTL3	48	40
CN1CCN(C(=O)c2ccc(-c3noc(/C=C\[C@H]4CCCNC4)n3)cc2)CC1	ZINC000872178809	GE	On-Demand	Anodyne	L3MBTL3	48	40
CN1CCN(C(=O)c2ccc(-c3noc(/C=C/[C@H]4CCCNC4)n3)cc2)CC1	ZINC000872178810	GE	On-Demand	Anodyne	L3MBTL3	48	40
Cc1ccc(-c2nc(-c3ccc(CN)cc3F)no2)cc1N1CCOCC1	ZINC000872178915	FG	On-Demand	Anodyne	SCARB1	46	34
CN1CCN(C(=O)c2ccc(-c3noc(-c4cc(N)ccc4Cl)n3)cc2)CC1	ZINC000872178982	GG	On-Demand	Anodyne	HRH4	27	43
NC1(Cc2nc(-c3ccc(Cl)o3)no2)CCN(Cc2ccccc2)CC1	ZINC000872179383	FH	On-Demand	Anodyne	SIGMAR1	46	41
COC[C@]1(c2nc(CC(=O)NCc3ccc(F)cc3F)no2)CCCCN1	ZINC000872179585	GD	On-Demand	Anodyne	P2RX7	35	47
CN(C(=O)Cc1noc([C@@H](N)c2ccc(C(F)(F)F)cc2)n1)C1CCCCC1	ZINC000872179610	GG	On-Demand	Anodyne	BMP1	45	37
CN(C(=O)Cc1noc([C@H](N)c2ccc(C(F)(F)F)cc2)n1)C1CCCCC1	ZINC000872179611	GG	On-Demand	Anodyne	BMP1	45	37
O=C(Cc1noc(/C=C\[C@H]2CCCNC2)n1)NCc1ccc(F)cc1F	ZINC000872179621	FE	On-Demand	Anodyne	P2RX7	31	46
O=C(Cc1noc(/C=C/[C@H]2CCCNC2)n1)NCc1ccc(F)cc1F	ZINC000872179622	FE	On-Demand	Anodyne	P2RX7	31	46
O=C(Cc1noc(/C=C\[C@@H]2CCCNC2)n1)NCc1ccc(F)cc1F	ZINC000872179623	FE	On-Demand	Anodyne	P2RX7	31	46
O=C(Cc1noc(/C=C/[C@@H]2CCCNC2)n1)NCc1ccc(F)cc1F	ZINC000872179624	FE	On-Demand	Anodyne	P2RX7	31	46
C=C(Cl)C[C@H](N)c1nc(CC(=O)N[C@@H](CC)c2ccccc2)no1	ZINC000872179634	EG	On-Demand	Mild	TACR3	43	37
C=C(Cl)C[C@@H](N)c1nc(CC(=O)N[C@@H](CC)c2ccccc2)no1	ZINC000872179635	EG	On-Demand	Mild	TACR3	43	37
C=C(Cl)C[C@H](N)c1nc(CC(=O)N[C@H](CC)c2ccccc2)no1	ZINC000872179636	EG	On-Demand	Mild	TACR3	43	37
NCc1ncc(-c2nc(C3(c4cccc(C(F)(F)F)c4)CCC3)no2)cn1	ZINC000872179643	GG	On-Demand	Anodyne	ALOX5AP	28	48
O=C(Cc1noc([C@]23CCC[C@H]2CNC3)n1)Nc1ccc(F)c(Cl)c1	ZINC000872179731	FF	On-Demand	Anodyne	ERBB4	49	33
O=C(Cc1noc([C@]23CCC[C@H]2CNC3)n1)Nc1ccc(F)c(Cl)c1	ZINC000872179731	FF	On-Demand	Anodyne	MCHR1	23	40
CCCCCNC(=O)Cc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872179916	GE	On-Demand	Anodyne	ACHE	16	40
CCCCCNC(=O)Cc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872179916	GE	On-Demand	Anodyne	NPFFR2	36	40
CCCCCNC(=O)Cc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872179916	GE	On-Demand	Anodyne	NPFFR1	48	40
C=C(Cl)C[C@H](N)c1nc(CC(=O)N2CCN(c3ccccc3F)CC2)no1	ZINC000872179923	GE	On-Demand	Mild	DPP4	21	42
C=C(Cl)C[C@@H](N)c1nc(CC(=O)N2CCN(c3ccccc3F)CC2)no1	ZINC000872179924	GE	On-Demand	Mild	DPP4	21	42
Cc1cccc(NC(=O)Cc2noc([C@@H](N)CN(C)C)n2)c1	ZINC000872180249	DD	On-Demand	Anodyne	KCNK3	47	34
COC[C@]1(c2nc(CC(=O)Nc3ccc(OC)c(Cl)c3)no2)CCCCN1	ZINC000872180268	GF	On-Demand	Anodyne	ENPP1	68	33
C=C(Cl)C[C@@H](N)c1nc(CC(=O)NCCc2ccccc2)no1	ZINC000872180335	EE	On-Demand	Mild	CA5B	17	41
C=C(Cl)C[C@@H](N)c1nc(CC(=O)NCCc2ccccc2)no1	ZINC000872180335	EE	On-Demand	Mild	CA5A	15	41
C=C(Cl)C[C@H](N)c1nc(CC(=O)NCCc2ccccc2)no1	ZINC000872180336	EE	On-Demand	Mild	CA5B	17	41
C=C(Cl)C[C@H](N)c1nc(CC(=O)NCCc2ccccc2)no1	ZINC000872180336	EE	On-Demand	Mild	CA5A	15	41
CC[C@H](NC(=O)Cc1noc([C@@H](N)CN(C)C)n1)c1ccccc1	ZINC000872180410	ED	On-Demand	Anodyne	TACR3	48	40
CC[C@@H](NC(=O)Cc1noc([C@@H](N)CN(C)C)n1)c1ccccc1	ZINC000872180411	ED	On-Demand	Anodyne	TACR3	48	40
CCC1(c2noc(-c3cnc(CN)nc3)n2)CCCC1	ZINC000872180437	CE	On-Demand	Anodyne	ALOX5AP	26	40
C=C(Cl)C[C@@H](N)c1nc(CC(=O)NCc2ccc(F)cc2F)no1	ZINC000872180523	FE	On-Demand	Mild	P2RX7	39	48
C=C(Cl)C[C@H](N)c1nc(CC(=O)NCc2ccc(F)cc2F)no1	ZINC000872180524	FE	On-Demand	Mild	P2RX7	39	48
N[C@H](c1cccc(C(F)(F)F)c1)c1nc(CC(=O)NC2CC2)no1	ZINC000872180532	ED	On-Demand	Anodyne	CCR2	61	42
N[C@@H](c1cccc(C(F)(F)F)c1)c1nc(CC(=O)NC2CC2)no1	ZINC000872180533	ED	On-Demand	Anodyne	CCR2	61	42
C=C(Cl)C[C@@H](N)c1nc(CC(=O)Nc2cccc(C)c2)no1	ZINC000872180534	DF	On-Demand	Mild	KCNK3	40	34
C=C(Cl)C[C@H](N)c1nc(CC(=O)Nc2cccc(C)c2)no1	ZINC000872180536	DF	On-Demand	Mild	KCNK3	40	34
O=C(Cc1noc([C@]23CCC[C@H]2CNC3)n1)NCc1ccc(F)cc1F	ZINC000872180537	FD	On-Demand	Anodyne	P2RX7	24	43
C=CCNC(=O)Cc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872180667	FD	On-Demand	Mild	NPFFR1	46	39
NC1(Cc2nc(CC(=O)NC3CC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180682	FD	On-Demand	Anodyne	DRD4	26	42
NC1(Cc2nc(CC(=O)NC3CC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180682	FD	On-Demand	Anodyne	SIGMAR1	56	53
NC1(Cc2nc(CC(=O)NC3CC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180682	FD	On-Demand	Anodyne	MCHR1	22	42
NC1(Cc2nc(CC(=O)NC3CC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180682	FD	On-Demand	Anodyne	NPFFR1	45	39
CC[C@H](NC(=O)Cc1noc([C@@]2(C)CNCCO2)n1)c1ccccc1	ZINC000872180723	ED	On-Demand	Anodyne	TACR3	40	35
CC[C@@H](NC(=O)Cc1noc([C@]2(C)CNCCO2)n1)c1ccccc1	ZINC000872180727	ED	On-Demand	Anodyne	TACR3	40	35
CC[C@H](NC(=O)Cc1noc([C@]2(C)CNCCO2)n1)c1ccccc1	ZINC000872180729	ED	On-Demand	Anodyne	TACR3	40	35
CC[C@@H](NC(=O)Cc1noc([C@@]2(C)CNCCO2)n1)c1ccccc1	ZINC000872180731	ED	On-Demand	Anodyne	TACR3	40	35
NC1(Cc2nc(CC(=O)N3CCCC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180777	GD	On-Demand	Anodyne	SIGMAR1	43	37
NC1(Cc2nc(CC(=O)N3CCCC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872180777	GD	On-Demand	Anodyne	NPFFR1	43	37
CC[C@@H](NC(=O)c1ccccc1)c1noc([C@@H](N)CN(C)C)n1	ZINC000872181002	DD	On-Demand	Anodyne	TACR3	42	37
CC[C@@H](NC(=O)c1ccccc1)c1noc([C@@H](N)CN(C)C)n1	ZINC000872181002	DD	On-Demand	Anodyne	UTS2	65	37
NCc1ncc(-c2nc(C3(c4ccc(F)cc4)CCCCC3)no2)cn1	ZINC000872181290	FG	On-Demand	Anodyne	ALOX5AP	33	54
COc1cccc(C2(c3noc(-c4cnc(CN)nc4)n3)CC2)c1	ZINC000872181361	DE	On-Demand	Anodyne	ALOX5AP	28	42
NCc1ncc(-c2nc(C3(c4cccc(Br)c4)CC3)no2)cn1	ZINC000872181564	FF	On-Demand	Anodyne	ALOX5AP	27	45
NCc1ncc(-c2nc(C3(c4ccccc4Br)CC3)no2)cn1	ZINC000872181648	FF	On-Demand	Anodyne	ALOX5AP	25	44
NCc1ncc(-c2nc(C3(c4ccc(F)cc4F)CCCC3)no2)cn1	ZINC000872181832	FG	On-Demand	Anodyne	ALOX5AP	28	46
NCc1ncc(-c2nc(C3(c4ccc(Br)s4)CCC3)no2)cn1	ZINC000872181853	GG	On-Demand	Anodyne	ALOX5AP	27	46
NCc1ncc(-c2nc(C3(c4cccc(C(F)(F)F)c4)CC3)no2)cn1	ZINC000872181894	FG	On-Demand	Anodyne	ALOX5AP	25	42
COc1cccc(C2(c3noc(-c4cnc(CN)nc4)n3)CCC2)c1	ZINC000872181920	EE	On-Demand	Anodyne	ALOX5AP	34	48
NCc1ncc(-c2nc(C3(c4ccccc4)CCOCC3)no2)cn1	ZINC000872182083	EE	On-Demand	Anodyne	ALOX5AP	31	54
COC[C@]1(c2nc(-c3cccc(N4CCC4=O)c3)no2)CCCCN1	ZINC000872182126	EE	On-Demand	Anodyne	CPT1A	19	44
NCc1ncc(-c2nc(C3(c4ccccc4F)CCCC3)no2)cn1	ZINC000872182307	EF	On-Demand	Anodyne	ALOX5AP	27	47
NC1(Cc2nc(-c3cccc4ncccc34)no2)CCN(Cc2ccccc2)CC1	ZINC000872182394	GH	On-Demand	Anodyne	SIGMAR1	22	40
O=C1CCN1c1cccc(-c2noc([C@]34CCC[C@H]3CNC4)n2)c1	ZINC000872182399	DE	On-Demand	Anodyne	CPT1A	15	43
COc1cc(C)ccc1-c1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872182412	GH	On-Demand	Anodyne	DRD4	19	41
COc1cc(C)ccc1-c1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872182412	GH	On-Demand	Anodyne	SIGMAR1	36	40
NCc1ncc(-c2nc(C3(c4c(F)cccc4F)CCCC3)no2)cn1	ZINC000872182425	FG	On-Demand	Anodyne	ALOX5AP	27	46
NC1(Cc2nc(-c3ccc(F)cc3F)no2)CCN(Cc2ccccc2)CC1	ZINC000872182752	GH	On-Demand	Anodyne	SIGMAR1	41	39
NCc1ncc(-c2nc(C3(c4ccc(F)cc4F)CCCCC3)no2)cn1	ZINC000872182760	FH	On-Demand	Anodyne	ALOX5AP	27	45
C=CCCc1noc(CC2(N)CCN(Cc3ccccc3)CC2)n1	ZINC000872182826	EF	On-Demand	Mild	SIGMAR1	40	42
NC1(Cc2nc(CCC3CCOCC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872182979	GF	On-Demand	Anodyne	ACHE	33	44
NC1(Cc2nc(CCC3CCOCC3)no2)CCN(Cc2ccccc2)CC1	ZINC000872182979	GF	On-Demand	Anodyne	SIGMAR1	45	37
NC1(Cc2nc(CCCF)no2)CCN(Cc2ccccc2)CC1	ZINC000872182988	EF	On-Demand	Anodyne	SIGMAR1	52	41
NCc1ncc(-c2nc(C3(c4cccc(Cl)c4)CCCCC3)no2)cn1	ZINC000872183037	FH	On-Demand	Anodyne	ALOX5AP	28	47
Cn1cc(-c2ccc(-c3nc(N4CCNCC4)no3)cc2)cn1	ZINC000872183319	DD	On-Demand	Anodyne	ALOX5AP	17	45
COCC1(c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)CCCC1	ZINC000872183406	GG	On-Demand	Anodyne	SIGMAR1	41	40
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)c1ccc(-n2cccn2)nc1	ZINC000872183438	IE	On-Demand	Anodyne	NAMPT	55	44
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872183439	EC	On-Demand	Anodyne	PRSS2	56	32
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872183439	EC	On-Demand	Anodyne	MLNR	33	46
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872183439	EC	On-Demand	Anodyne	EPHX2	20	51
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872183439	EC	On-Demand	Anodyne	LIPG	16	41
CC(=O)C1CCN(C(=O)C(=O)N2CCC[C@@H](C(=O)O)C2)CC1	ZINC000872183455	DC	On-Demand	Anodyne	SLC6A1	54	32
CC(=O)C1CCN(C(=O)C(=O)N2CCC[C@H](C(=O)O)C2)CC1	ZINC000872183456	DC	On-Demand	Anodyne	SLC6A1	54	32
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183461	ED	On-Demand	Anodyne	OXTR	42	37
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183461	ED	On-Demand	Anodyne	SLC18A3	18	43
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183462	ED	On-Demand	Anodyne	OXTR	42	37
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183462	ED	On-Demand	Anodyne	SLC18A3	18	43
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183463	ED	On-Demand	Anodyne	OXTR	42	37
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183463	ED	On-Demand	Anodyne	SLC18A3	18	43
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183464	ED	On-Demand	Anodyne	OXTR	42	37
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183464	ED	On-Demand	Anodyne	SLC18A3	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C(=O)O)C2)C1	ZINC000872183468	DC	On-Demand	Anodyne	SLC6A1	82	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C(=O)O)C2)C1	ZINC000872183469	DC	On-Demand	Anodyne	SLC6A1	82	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C(=O)O)C2)C1	ZINC000872183470	DC	On-Demand	Anodyne	SLC6A1	82	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C(=O)O)C2)C1	ZINC000872183471	DC	On-Demand	Anodyne	SLC6A1	82	35
NCc1ncc(-c2nc(C3(c4ccccc4F)CC3)no2)cn1	ZINC000872183568	DE	On-Demand	Anodyne	ALOX5AP	25	43
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183648	FC	On-Demand	Anodyne	MLNR	16	45
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183648	FC	On-Demand	Anodyne	EPHX2	22	45
O=C(O)[C@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183648	FC	On-Demand	Anodyne	LIPG	23	49
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183649	FC	On-Demand	Anodyne	MLNR	16	45
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183649	FC	On-Demand	Anodyne	EPHX2	22	45
O=C(O)[C@@H]1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183649	FC	On-Demand	Anodyne	LIPG	23	49
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA2	99	44
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA1	90	45
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA7	42	41
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA5B	61	37
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA4	86	44
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA5A	66	37
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA14	31	41
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA12	71	48
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	CA9	78	48
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	NCE103	39	44
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	MTCA1	54	48
C=CCNC(=O)Nc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	ZINC000872183727	JF	On-Demand	Mild	P96878_MYCTU	70	48
c1ccc(OCc2nc(Cc3nc(C[C@H]4CCCN4)no3)cs2)cc1	ZINC000872183753	FF	On-Demand	Anodyne	CHRNA10	33	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC(c3ccccc3C(=O)O)CC2)C1	ZINC000872183755	GD	On-Demand	Anodyne	SLC6A1	81	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC(c3ccccc3C(=O)O)CC2)C1	ZINC000872183755	GD	On-Demand	Anodyne	RBP4	49	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC(c3ccccc3C(=O)O)CC2)C1	ZINC000872183756	GD	On-Demand	Anodyne	SLC6A1	81	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC(c3ccccc3C(=O)O)CC2)C1	ZINC000872183756	GD	On-Demand	Anodyne	RBP4	49	47
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183769	FD	On-Demand	Anodyne	OXTR	50	38
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183769	FD	On-Demand	Anodyne	GHRHR	17	40
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183769	FD	On-Demand	Anodyne	SLC18A3	15	40
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183774	FD	On-Demand	Anodyne	OXTR	50	38
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183774	FD	On-Demand	Anodyne	GHRHR	17	40
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183774	FD	On-Demand	Anodyne	SLC18A3	15	40
O=C(NCCc1nc(N2CCNCC2)no1)c1cc2ccccc2[nH]1	ZINC000872183791	EC	On-Demand	Anodyne	PLD2	32	42
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183804	FD	On-Demand	Anodyne	MLNR	17	45
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872183804	FD	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCc1nc(C[C@H]2CCCN2)no1)c1cc2ccccc2[nH]1	ZINC000872183823	ED	On-Demand	Anodyne	PLD2	21	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183936	FD	On-Demand	Anodyne	OXTR	43	37
O=C(O)C[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183937	FD	On-Demand	Anodyne	OXTR	43	37
O=C(O)C[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872183938	FD	On-Demand	Anodyne	OXTR	43	37
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872183939	FD	On-Demand	Anodyne	OXTR	43	37
O=C(O)[C@@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000872183980	FC	On-Demand	Anodyne	EPHX2	15	42
O=C(O)[C@@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000872183980	FC	On-Demand	Anodyne	LIPG	15	45
O=C(O)[C@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000872183982	FC	On-Demand	Anodyne	EPHX2	15	42
O=C(O)[C@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000872183982	FC	On-Demand	Anodyne	LIPG	15	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@H](C(=O)O)C2)C1	ZINC000872184032	CB	On-Demand	Anodyne	SLC6A1	63	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](C(=O)O)C2)C1	ZINC000872184034	CB	On-Demand	Anodyne	SLC6A1	63	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](C(=O)O)C2)C1	ZINC000872184035	CB	On-Demand	Anodyne	SLC6A1	63	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@H](C(=O)O)C2)C1	ZINC000872184037	CB	On-Demand	Anodyne	SLC6A1	63	34
Cc1cc(C)cc(C2(c3noc(-c4cnc(CN)nc4)n3)CC2)c1	ZINC000872184150	DF	On-Demand	Anodyne	ALOX5AP	27	45
C[C@]1(C(=O)O)CCN(C(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)C1	ZINC000872184182	GD	On-Demand	Anodyne	SIGMAR1	49	37
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872184187	FD	On-Demand	Anodyne	OXTR	48	38
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872184187	FD	On-Demand	Anodyne	SLC18A3	21	44
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872184188	FD	On-Demand	Anodyne	OXTR	48	38
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872184188	FD	On-Demand	Anodyne	SLC18A3	21	44
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184204	FF	On-Demand	Anodyne	PRCP	39	44
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184204	FF	On-Demand	Anodyne	CPT1A	60	49
CC(=O)N1CCC[C@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184204	FF	On-Demand	Anodyne	GRM5	21	52
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184205	FF	On-Demand	Anodyne	PRCP	39	44
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184205	FF	On-Demand	Anodyne	CPT1A	60	49
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(OC3CCNCC3)c(F)c2)no1	ZINC000872184205	FF	On-Demand	Anodyne	GRM5	21	52
O=C(O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184238	FD	On-Demand	Anodyne	SLC6A1	128	38
O=C(O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184238	FD	On-Demand	Anodyne	EPHX2	19	43
O=C(O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184238	FD	On-Demand	Anodyne	LIPG	18	47
O=C(O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184239	FD	On-Demand	Anodyne	SLC6A1	128	38
O=C(O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184239	FD	On-Demand	Anodyne	EPHX2	19	43
O=C(O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184239	FD	On-Demand	Anodyne	LIPG	18	47
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872184248	FC	On-Demand	Anodyne	PRSS2	55	32
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872184248	FC	On-Demand	Anodyne	MLNR	20	43
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)C(=O)O	ZINC000872184248	FC	On-Demand	Anodyne	EPHX2	16	41
Cn1cc(-c2ccc(-c3nc(C[C@@H]4CC[C@H](N)C4)no3)cc2)cn1	ZINC000872184334	DF	On-Demand	Anodyne	ALOX5AP	22	47
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872184398	ED	On-Demand	Anodyne	OXTR	47	39
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872184398	ED	On-Demand	Anodyne	GHRHR	35	42
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872184400	ED	On-Demand	Anodyne	OXTR	47	39
CN(CCC(=O)O)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872184400	ED	On-Demand	Anodyne	GHRHR	35	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184484	GD	On-Demand	Anodyne	EPHX2	19	45
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184484	GD	On-Demand	Anodyne	LIPG	16	42
O=C(O)C[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184485	GD	On-Demand	Anodyne	EPHX2	19	45
O=C(O)C[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872184485	GD	On-Demand	Anodyne	LIPG	16	42
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872184520	ED	On-Demand	Anodyne	OXTR	41	36
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872184520	ED	On-Demand	Anodyne	GHRHR	27	41
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872184521	ED	On-Demand	Anodyne	OXTR	41	36
C[C@@H](CN(C)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(=O)O	ZINC000872184521	ED	On-Demand	Anodyne	GHRHR	27	41
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ccc(C(=O)N(C)C)cc2)c1	ZINC000872184528	JE	On-Demand	Anodyne	CA2	17	40
O=C(O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872184539	FD	On-Demand	Anodyne	SLC6A1	119	36
O=C(O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872184540	FD	On-Demand	Anodyne	SLC6A1	119	36
O=C(O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872184541	FD	On-Demand	Anodyne	SLC6A1	119	36
O=C(O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872184542	FD	On-Demand	Anodyne	SLC6A1	119	36
Cn1cc(-c2ccc(-c3nc(C[C@H]4CCCN4)no3)cc2)cn1	ZINC000872184574	DE	On-Demand	Anodyne	ALOX5AP	20	44
COc1ccc2c(c1)CC[C@H]2c1nc(C[C@H]2CCCN2)no1	ZINC000872184619	CE	On-Demand	Anodyne	CHRNA10	36	44
Cc1nn(-c2cccnc2)nc1-c1nc(N2CCNCC2)no1	ZINC000872184623	DC	On-Demand	Anodyne	CHRNA4	20	44
O=C(c1ccc(-n2cccn2)nc1)N1CCN(C(=O)N2CCCCC2)CC1	ZINC000872184637	FD	On-Demand	Anodyne	L3MBTL3	47	40
Cn1ncc(-c2noc(CC3(N)CCN(Cc4ccccc4)CC3)n2)c1Cl	ZINC000872184663	GF	On-Demand	Anodyne	SIGMAR1	33	45
CC(=O)C1CCN(C(=O)C(=O)N2CCC(c3ccccc3C(=O)O)CC2)CC1	ZINC000872184672	GD	On-Demand	Anodyne	RBP4	58	50
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184685	FD	On-Demand	Anodyne	MLNR	16	45
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184685	FD	On-Demand	Anodyne	EPHX2	21	45
O=C(O)C1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184685	FD	On-Demand	Anodyne	LIPG	26	49
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872184743	GD	On-Demand	Anodyne	DRD4	24	48
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872184743	GD	On-Demand	Anodyne	LSS	20	50
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872184743	GD	On-Demand	Anodyne	CACNA1G	15	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccn2)CC1	ZINC000872184788	EC	On-Demand	Anodyne	DRD4	25	42
Fc1c(Cl)cccc1-c1cc(-c2nc(N3CCNCC3)no2)on1	ZINC000872184855	EF	On-Demand	Anodyne	CHRNA4	20	40
NC[C@H]1CN(C(=O)C(=O)N2CCc3ccccc3C2)C[C@@H]1C(F)(F)F	ZINC000872184882	FD	On-Demand	Anodyne	DPP8	22	43
NC[C@@H]1CN(C(=O)C(=O)N2CCc3ccccc3C2)C[C@@H]1C(F)(F)F	ZINC000872184883	FD	On-Demand	Anodyne	DPP8	22	43
NC[C@H]1CN(C(=O)C(=O)N2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872184884	FD	On-Demand	Anodyne	DPP8	22	43
NC[C@@H]1CN(C(=O)C(=O)N2CCc3ccccc3C2)C[C@H]1C(F)(F)F	ZINC000872184885	FD	On-Demand	Anodyne	DPP8	22	43
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872184886	GD	On-Demand	Mild	MLNR	20	42
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184901	GD	On-Demand	Anodyne	HRH1	15	41
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184901	GD	On-Demand	Anodyne	CCR3	24	41
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184901	GD	On-Demand	Anodyne	MLNR	18	44
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184901	GD	On-Demand	Anodyne	EPHX2	20	51
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000872184901	GD	On-Demand	Anodyne	LIPG	39	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(C(=O)O)CC1)CC2	ZINC000872184905	GD	On-Demand	Anodyne	SLC18A2	49	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(C(=O)O)CC1)CC2	ZINC000872184905	GD	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(C(=O)O)CC1)CC2	ZINC000872184906	GD	On-Demand	Anodyne	SLC18A2	49	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(C(=O)O)CC1)CC2	ZINC000872184906	GD	On-Demand	Anodyne	MTNR1B	15	45
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1	ZINC000872184935	DD	On-Demand	Anodyne	TSPO	29	45
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1	ZINC000872184935	DD	On-Demand	Anodyne	KLK3	55	31
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1	ZINC000872184935	DD	On-Demand	Anodyne	POLG_WNV	47	31
CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872184961	FC	On-Demand	Anodyne	NOS2	51	32
C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872185084	FD	On-Demand	Anodyne	OXTR	47	37
C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872185084	FD	On-Demand	Anodyne	GHRHR	27	40
C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872185086	FD	On-Demand	Anodyne	OXTR	47	37
C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872185086	FD	On-Demand	Anodyne	GHRHR	27	40
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872185105	GE	On-Demand	Anodyne	OXTR	49	40
O=C(O)CCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872185106	GE	On-Demand	Anodyne	OXTR	49	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1nc2ccccc2s1	ZINC000872185125	GF	On-Demand	Anodyne	TRY1_BOVIN	38	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1nc2ccccc2s1	ZINC000872185126	GF	On-Demand	Anodyne	TRY1_BOVIN	38	40
COc1ccc(CN(C)C(=O)C(=O)N(C)CCCCCCN)cc1	ZINC000872185161	ED	On-Demand	Anodyne	AOC3	15	41
COC[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185216	GC	On-Demand	Anodyne	MLNR	15	42
COC[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185216	GC	On-Demand	Anodyne	EPHX2	15	41
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000872185240	EE	On-Demand	Anodyne	CXCR4	55	43
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000872185241	EE	On-Demand	Anodyne	CXCR4	55	43
N[C@H](C[C@H]1CCCN(C(=O)C(=O)N2CCCC2)C1)C1CCCC1	ZINC000872185258	DD	On-Demand	Anodyne	DPP7	19	42
N[C@H](C[C@@H]1CCCN(C(=O)C(=O)N2CCCC2)C1)C1CCCC1	ZINC000872185259	DD	On-Demand	Anodyne	DPP7	19	42
N[C@@H](C[C@@H]1CCCN(C(=O)C(=O)N2CCCC2)C1)C1CCCC1	ZINC000872185260	DD	On-Demand	Anodyne	DPP7	19	42
N[C@@H](C[C@H]1CCCN(C(=O)C(=O)N2CCCC2)C1)C1CCCC1	ZINC000872185261	DD	On-Demand	Anodyne	DPP7	19	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](C(=O)O)C1)CC2	ZINC000872185265	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](C(=O)O)C1)CC2	ZINC000872185265	GD	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@H](C(=O)O)C1)CC2	ZINC000872185266	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@H](C(=O)O)C1)CC2	ZINC000872185266	GD	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](C(=O)O)C1)CC2	ZINC000872185267	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](C(=O)O)C1)CC2	ZINC000872185267	GD	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@H](C(=O)O)C1)CC2	ZINC000872185268	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@H](C(=O)O)C1)CC2	ZINC000872185268	GD	On-Demand	Anodyne	MTNR1B	15	45
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185302	GE	On-Demand	Anodyne	GRIN2B	83	42
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185302	GE	On-Demand	Anodyne	SIGMAR1	18	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185303	GE	On-Demand	Anodyne	GRIN2B	83	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185303	GE	On-Demand	Anodyne	SIGMAR1	18	40
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185304	GE	On-Demand	Anodyne	GRIN2B	83	42
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185304	GE	On-Demand	Anodyne	SIGMAR1	18	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185305	GE	On-Demand	Anodyne	GRIN2B	83	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185305	GE	On-Demand	Anodyne	SIGMAR1	18	40
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@H]1C(=O)O	ZINC000872185306	FD	On-Demand	Anodyne	OXTR	55	39
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H]1C(=O)O	ZINC000872185307	FD	On-Demand	Anodyne	OXTR	55	39
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@H]1C(=O)O	ZINC000872185308	FD	On-Demand	Anodyne	OXTR	55	39
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H]1C(=O)O	ZINC000872185309	FD	On-Demand	Anodyne	OXTR	55	39
COC[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872185322	GD	On-Demand	Anodyne	GHRHR	16	40
COC[C@]1(C(=O)O)CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872185323	GD	On-Demand	Anodyne	GHRHR	16	40
CN(Cc1ccc(Cl)cc1)C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872185331	GD	On-Demand	Anodyne	DPP7	23	41
CN(Cc1ccc(Cl)cc1)C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872185332	GD	On-Demand	Anodyne	DPP7	23	41
CN(Cc1ccc(Cl)cc1)C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872185333	GD	On-Demand	Anodyne	DPP7	23	41
CN(Cc1ccc(Cl)cc1)C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872185334	GD	On-Demand	Anodyne	DPP7	23	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCC(=O)O)CC2	ZINC000872185337	FD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCC(=O)O)CC2	ZINC000872185337	FD	On-Demand	Anodyne	MTNR1B	15	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCC(=O)O)CC2	ZINC000872185338	FD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCC(=O)O)CC2	ZINC000872185338	FD	On-Demand	Anodyne	MTNR1B	15	46
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(Cl)cc1	ZINC000872185382	EE	On-Demand	Anodyne	TSPO	17	41
CN(CCCCCCN)C(=O)C(=O)N1CCc2ccccc2C1	ZINC000872185400	DD	On-Demand	Anodyne	DPP8	21	44
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	HTR1A	84	44
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	DRD2	59	44
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	ADRA1D	66	40
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	ADRA1A	60	40
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	ADRA1B	55	40
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	DRD3	61	40
COc1ccccc1N1CCN(C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)CC1	ZINC000872185449	FC	On-Demand	Anodyne	HTR7	51	44
C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872185517	GE	On-Demand	Anodyne	TACR1	29	40
C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872185519	GE	On-Demand	Anodyne	TACR1	29	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(C#N)c1	ZINC000872185545	ED	On-Demand	Mild	HSD17B2	16	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(CCc2ccccc2)CC1	ZINC000872185629	FD	On-Demand	Anodyne	SIGMAR1	41	52
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1Cc1ccccc1	ZINC000872185632	EE	On-Demand	Anodyne	ACE	29	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1Cc1ccccc1	ZINC000872185632	EE	On-Demand	Anodyne	PREP	64	36
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1Cc1ccccc1	ZINC000872185633	EE	On-Demand	Anodyne	ACE	29	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1Cc1ccccc1	ZINC000872185633	EE	On-Demand	Anodyne	PREP	64	36
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccc2C#N)CC1	ZINC000872185635	FD	On-Demand	Mild	SSTR1	40	51
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccc2)CC1	ZINC000872185663	ED	On-Demand	Anodyne	HTR1A	17	41
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccc2)CC1	ZINC000872185663	ED	On-Demand	Anodyne	HTR7	30	43
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccc2)CC1	ZINC000872185663	ED	On-Demand	Anodyne	SSTR1	44	42
O=C(O)CC[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185690	GD	On-Demand	Anodyne	EPHX2	16	48
O=C(O)CC[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185690	GD	On-Demand	Anodyne	LIPG	19	43
O=C(O)CC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185691	GD	On-Demand	Anodyne	EPHX2	16	48
O=C(O)CC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872185691	GD	On-Demand	Anodyne	LIPG	19	43
CN(CCCCCCN)C(=O)C(=O)N(Cc1ccccn1)C1CC1	ZINC000872185696	ED	On-Demand	Anodyne	CXCR4	42	44
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccnc1	ZINC000872185705	DD	On-Demand	Anodyne	TBXAS1	33	45
N[C@@H](C[C@H]1CCCN(C(=O)C(=O)N2CCCCCC2)C1)C1CCCC1	ZINC000872185719	EF	On-Demand	Anodyne	DPP7	27	44
N[C@H](C[C@@H]1CCCN(C(=O)C(=O)N2CCCCCC2)C1)C1CCCC1	ZINC000872185720	EF	On-Demand	Anodyne	DPP7	27	44
N[C@H](C[C@H]1CCCN(C(=O)C(=O)N2CCCCCC2)C1)C1CCCC1	ZINC000872185721	EF	On-Demand	Anodyne	DPP7	27	44
N[C@@H](C[C@@H]1CCCN(C(=O)C(=O)N2CCCCCC2)C1)C1CCCC1	ZINC000872185722	EF	On-Demand	Anodyne	DPP7	27	44
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185726	GE	On-Demand	Anodyne	FKBP1A	52	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185726	GE	On-Demand	Anodyne	SLC18A2	42	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185726	GE	On-Demand	Anodyne	PREP	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185727	GE	On-Demand	Anodyne	FKBP1A	52	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185727	GE	On-Demand	Anodyne	SLC18A2	42	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185727	GE	On-Demand	Anodyne	PREP	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185728	GE	On-Demand	Anodyne	FKBP1A	52	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185728	GE	On-Demand	Anodyne	SLC18A2	42	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872185728	GE	On-Demand	Anodyne	PREP	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185729	GE	On-Demand	Anodyne	FKBP1A	52	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185729	GE	On-Demand	Anodyne	SLC18A2	42	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2CCc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872185729	GE	On-Demand	Anodyne	PREP	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872185733	GD	On-Demand	Anodyne	SSTR4	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872185733	GD	On-Demand	Anodyne	SSTR5	43	36
NC[C@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872185734	GD	On-Demand	Anodyne	SSTR4	53	36
NC[C@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872185734	GD	On-Demand	Anodyne	SSTR5	43	36
NC[C@@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872185735	GD	On-Demand	Anodyne	SSTR4	53	36
NC[C@@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H]1C(F)(F)F	ZINC000872185735	GD	On-Demand	Anodyne	SSTR5	43	36
NC[C@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872185736	GD	On-Demand	Anodyne	SSTR4	53	36
NC[C@H]1CN(C(=O)C(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H]1C(F)(F)F	ZINC000872185736	GD	On-Demand	Anodyne	SSTR5	43	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185745	GD	On-Demand	Anodyne	SLC18A3	52	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185745	GD	On-Demand	Anodyne	RBP4	31	43
NC[C@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185746	GD	On-Demand	Anodyne	SLC18A3	52	43
NC[C@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872185746	GD	On-Demand	Anodyne	RBP4	31	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185747	GD	On-Demand	Anodyne	SLC18A3	52	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185747	GD	On-Demand	Anodyne	RBP4	31	43
NC[C@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185748	GD	On-Demand	Anodyne	SLC18A3	52	43
NC[C@H]1CN(C(=O)C(=O)N2CCC(c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872185748	GD	On-Demand	Anodyne	RBP4	31	43
CCN(Cc1ccc(Cl)cc1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872185771	ED	On-Demand	Anodyne	FFAR2	44	40
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N(C)CCCCCCN	ZINC000872185805	FF	On-Demand	Anodyne	TSPO	26	42
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N(C)CCCCCCN	ZINC000872185805	FF	On-Demand	Anodyne	PDS	20	43
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	HTR1D	28	41
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	HTR1B	23	41
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	SSTR2	109	36
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	HTR1F	60	37
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	SSTR4	40	33
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	SSTR5	44	35
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872185845	GF	On-Demand	Anodyne	CCR2	30	43
CN(CCCCCCN)C(=O)C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872185888	GD	On-Demand	Anodyne	MLNR	43	38
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872185921	FE	On-Demand	Anodyne	OPRK1	21	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(F)cc1	ZINC000872185938	DD	On-Demand	Anodyne	TSPO	15	43
N[C@H](C[C@H]1CCCN(C(=O)C(=O)N(Cc2cccnc2)C2CC2)C1)C1CCCC1	ZINC000872185994	GF	On-Demand	Anodyne	C3AR1	39	40
N[C@H](C[C@@H]1CCCN(C(=O)C(=O)N(Cc2cccnc2)C2CC2)C1)C1CCCC1	ZINC000872185995	GF	On-Demand	Anodyne	C3AR1	39	40
N[C@@H](C[C@H]1CCCN(C(=O)C(=O)N(Cc2cccnc2)C2CC2)C1)C1CCCC1	ZINC000872185996	GF	On-Demand	Anodyne	C3AR1	39	40
N[C@@H](C[C@@H]1CCCN(C(=O)C(=O)N(Cc2cccnc2)C2CC2)C1)C1CCCC1	ZINC000872185997	GF	On-Demand	Anodyne	C3AR1	39	40
CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N(C)CCCCCCN	ZINC000872186009	FD	On-Demand	Anodyne	BMP1	52	36
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	SSTR2	60	44
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	DRD5	20	40
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	SSTR4	67	41
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	TSPO	23	40
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	SSTR5	48	40
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	SSTR1	22	40
CN(CCCCCCN)C(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000872186023	FE	On-Demand	Anodyne	SSTR3	21	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000872186054	ED	On-Demand	Anodyne	Q8WSF8_APLCA	15	46
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000872186054	ED	On-Demand	Anodyne	NACHRBETA2	25	46
CN(CCCCCCN)C(=O)C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872186055	GD	On-Demand	Anodyne	LSS	15	49
CN(CCCCCCN)C(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872186094	GD	On-Demand	Anodyne	DRD4	18	43
CN(CCCCCCN)C(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872186094	GD	On-Demand	Anodyne	MCHR1	21	41
CN(CCCCCCN)C(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872186094	GD	On-Demand	Anodyne	CCR8	44	35
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000872186119	FF	On-Demand	Anodyne	POLG_WNV	40	32
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(F)c1	ZINC000872186167	DD	On-Demand	Anodyne	HSD17B2	22	41
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	HTR1A	100	48
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	DRD2	70	48
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	DRD1	19	42
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	DRD4	40	45
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	ADRA1D	75	45
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	HTR1B	15	42
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	HTR2A	24	48
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	ADRA1A	69	45
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	ADRA1B	59	43
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	DRD3	75	43
COc1ccccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872186170	GD	On-Demand	Anodyne	HTR7	68	47
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccncc2)CC1	ZINC000872186189	EC	On-Demand	Anodyne	SSTR1	33	45
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872186196	GD	On-Demand	Anodyne	DRD4	21	41
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872186196	GD	On-Demand	Anodyne	SIGMAR1	17	47
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872186196	GD	On-Demand	Anodyne	FAAH	26	48
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000872186210	FE	On-Demand	Anodyne	TMPRSS6	45	35
NC[C@H]1CN(C(=O)C(=O)N2CCC(N3CCCCC3)CC2)C[C@H]1C(F)(F)F	ZINC000872186288	GD	On-Demand	Anodyne	L3MBTL3	89	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(N3CCCCC3)CC2)C[C@@H]1C(F)(F)F	ZINC000872186289	GD	On-Demand	Anodyne	L3MBTL3	89	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(N3CCCCC3)CC2)C[C@H]1C(F)(F)F	ZINC000872186290	GD	On-Demand	Anodyne	L3MBTL3	89	42
NC[C@H]1CN(C(=O)C(=O)N2CCC(N3CCCCC3)CC2)C[C@@H]1C(F)(F)F	ZINC000872186291	GD	On-Demand	Anodyne	L3MBTL3	89	42
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872186420	FE	On-Demand	Anodyne	GRIN2B	84	43
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872186420	FE	On-Demand	Anodyne	SIGMAR1	19	44
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872186420	FE	On-Demand	Anodyne	CCR3	31	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc2c(c1)OCO2	ZINC000872186475	ED	On-Demand	Anodyne	BMP1	63	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186483	FD	On-Demand	Anodyne	SLC6A1	69	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186483	FD	On-Demand	Anodyne	CCR5	21	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186483	FD	On-Demand	Anodyne	PREP	23	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186484	FD	On-Demand	Anodyne	SLC6A1	69	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186484	FD	On-Demand	Anodyne	CCR5	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)C1	ZINC000872186484	FD	On-Demand	Anodyne	PREP	23	41
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000872186486	FD	On-Demand	Anodyne	SSTR1	34	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186491	GD	On-Demand	Anodyne	SLC6A1	63	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186491	GD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186491	GD	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186492	GD	On-Demand	Anodyne	SLC6A1	63	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186492	GD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186492	GD	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186495	GD	On-Demand	Anodyne	SLC6A1	63	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186495	GD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](C(=O)O)C1)CC2	ZINC000872186495	GD	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186498	GD	On-Demand	Anodyne	SLC6A1	63	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186498	GD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1)CC2	ZINC000872186498	GD	On-Demand	Anodyne	MTNR1B	15	48
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000872186503	FF	On-Demand	Anodyne	CCR1	18	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000872186504	FF	On-Demand	Anodyne	CCR1	18	40
O=C(O)CC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872186667	GE	On-Demand	Anodyne	OXTR	40	38
O=C(O)CC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872186669	GE	On-Demand	Anodyne	OXTR	40	38
O=C(O)CC[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872186672	GE	On-Demand	Anodyne	OXTR	40	38
O=C(O)CC[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872186674	GE	On-Demand	Anodyne	OXTR	40	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)C[C@@H](C)C(=O)O)CC2	ZINC000872186677	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)C[C@H](C)C(=O)O)CC2	ZINC000872186679	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)C[C@H](C)C(=O)O)CC2	ZINC000872186681	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)C[C@@H](C)C(=O)O)CC2	ZINC000872186683	GD	On-Demand	Anodyne	SLC18A2	53	39
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1ccccn1	ZINC000872186699	ED	On-Demand	Anodyne	CXCR4	44	38
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1ccccn1	ZINC000872186699	ED	On-Demand	Anodyne	CPT1A	50	36
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1ccccn1	ZINC000872186700	ED	On-Demand	Anodyne	CXCR4	44	38
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1ccccn1	ZINC000872186700	ED	On-Demand	Anodyne	CPT1A	50	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H](C)[C@H](C(=O)O)C1)CC2	ZINC000872186712	GD	On-Demand	Anodyne	SLC18A2	49	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H](C)[C@H](C(=O)O)C1)CC2	ZINC000872186713	GD	On-Demand	Anodyne	SLC18A2	49	38
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCC(C(=O)O)CC1	ZINC000872186724	GF	On-Demand	Anodyne	MDM2	96	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccccc2F)CC1	ZINC000872186744	FD	On-Demand	Anodyne	SSTR1	35	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(Cl)c1	ZINC000872186841	EE	On-Demand	Anodyne	TSPO	18	40
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2ccccc2)CC1	ZINC000872186896	EE	On-Demand	Anodyne	SLC18A3	57	42
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1N1CCCC1	ZINC000872186905	FE	On-Demand	Anodyne	KCNQ2	68	36
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872186982	GE	On-Demand	Anodyne	SLC6A9	16	40
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872186984	GE	On-Demand	Anodyne	SLC6A9	16	40
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872186985	GE	On-Demand	Anodyne	SLC6A9	16	40
CCN(Cc1cccc(Cl)c1)C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872186986	GE	On-Demand	Anodyne	SLC6A9	16	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872187032	GC	On-Demand	Anodyne	L3MBTL3	40	37
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872187033	GC	On-Demand	Anodyne	L3MBTL3	40	37
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872187034	GC	On-Demand	Anodyne	L3MBTL3	40	37
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872187035	GC	On-Demand	Anodyne	L3MBTL3	40	37
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(O)cc1	ZINC000872187057	DD	On-Demand	Anodyne	GRIA1	55	36
CN(CCCCCCN)C(=O)C(=O)N(Cc1ccccc1)C1CCCCC1	ZINC000872187072	FG	On-Demand	Anodyne	ACE	46	34
CN(CCCCCCN)C(=O)C(=O)N(Cc1ccccc1)C1CCCCC1	ZINC000872187072	FG	On-Demand	Anodyne	AMY2	50	37
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](c2ccccn2)C1	ZINC000872187073	ED	On-Demand	Anodyne	CXCR4	46	38
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](c2ccccn2)C1	ZINC000872187074	ED	On-Demand	Anodyne	CXCR4	46	38
COc1ccc([C@@H]2CCCN2C(=O)C(=O)N(C)CCCCCCN)cc1OC	ZINC000872187078	GE	On-Demand	Anodyne	ACKR3	40	33
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872187098	GE	On-Demand	Anodyne	ACHE	25	44
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872187098	GE	On-Demand	Anodyne	SLC6A1	70	38
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872187098	GE	On-Demand	Anodyne	SIGMAR1	43	46
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872187099	GE	On-Demand	Anodyne	ACHE	25	44
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872187099	GE	On-Demand	Anodyne	SLC6A1	70	38
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872187099	GE	On-Demand	Anodyne	SIGMAR1	43	46
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000872187111	FF	On-Demand	Anodyne	ACE	36	41
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000872187111	FF	On-Demand	Anodyne	FKBP1A	57	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000872187111	FF	On-Demand	Anodyne	SLC18A2	46	46
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000872187111	FF	On-Demand	Anodyne	PREP	60	37
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000872187112	FF	On-Demand	Anodyne	ACE	36	41
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000872187112	FF	On-Demand	Anodyne	FKBP1A	57	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000872187112	FF	On-Demand	Anodyne	SLC18A2	46	46
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000872187112	FF	On-Demand	Anodyne	PREP	60	37
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(O)c1	ZINC000872187199	DD	On-Demand	Anodyne	HSD17B2	32	49
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872187239	FD	On-Demand	Anodyne	ACHE	34	47
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872187239	FD	On-Demand	Anodyne	SIGMAR1	55	49
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872187239	FD	On-Demand	Anodyne	CCR5	31	40
CN(CCCCCCN)C(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872187239	FD	On-Demand	Anodyne	MLNR	40	35
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872187240	FD	On-Demand	Anodyne	ACHE	34	47
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872187240	FD	On-Demand	Anodyne	SIGMAR1	55	49
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872187240	FD	On-Demand	Anodyne	CCR5	31	40
CN(CCCCCCN)C(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872187240	FD	On-Demand	Anodyne	MLNR	40	35
CN(CCCCCCN)C(=O)C(=O)N1CCC(CCc2ccc(O)cc2)CC1	ZINC000872187338	GF	On-Demand	Anodyne	GRIN2B	15	40
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](c2ccccc2)C1	ZINC000872187342	ED	On-Demand	Anodyne	SLC18A3	45	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](c2ccccc2)C1	ZINC000872187342	ED	On-Demand	Anodyne	ADAM10	19	42
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](c2ccccc2)C1	ZINC000872187344	ED	On-Demand	Anodyne	SLC18A3	45	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](c2ccccc2)C1	ZINC000872187344	ED	On-Demand	Anodyne	ADAM10	19	42
CCN(Cc1ccc(Cl)cc1)C(=O)C(=O)N(C)CCCCCCN	ZINC000872187400	FF	On-Demand	Anodyne	TSPO	28	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872187401	GD	On-Demand	Anodyne	FKBP1A	39	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872187401	GD	On-Demand	Anodyne	PREP	52	35
CNC(=O)[C@@H]1CCCN1C(=O)C(=O)N1CCC[C@H](C[C@@H](N)C2CCCC2)C1	ZINC000872187469	GC	On-Demand	Anodyne	F2	21	41
CNC(=O)[C@@H]1CCCN1C(=O)C(=O)N1CCC[C@H](C[C@H](N)C2CCCC2)C1	ZINC000872187470	GC	On-Demand	Anodyne	F2	21	41
CNC(=O)[C@@H]1CCCN1C(=O)C(=O)N1CCC[C@@H](C[C@@H](N)C2CCCC2)C1	ZINC000872187471	GC	On-Demand	Anodyne	F2	21	41
CNC(=O)[C@@H]1CCCN1C(=O)C(=O)N1CCC[C@@H](C[C@H](N)C2CCCC2)C1	ZINC000872187472	GC	On-Demand	Anodyne	F2	21	41
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1)CC2	ZINC000872187506	GD	On-Demand	Anodyne	DRD5	18	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1)CC2	ZINC000872187506	GD	On-Demand	Anodyne	HDAC6	30	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1)CC2	ZINC000872187507	GD	On-Demand	Anodyne	DRD5	18	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1)CC2	ZINC000872187507	GD	On-Demand	Anodyne	HDAC6	30	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1)CC2	ZINC000872187508	GD	On-Demand	Anodyne	DRD5	18	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1)CC2	ZINC000872187508	GD	On-Demand	Anodyne	HDAC6	30	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1)CC2	ZINC000872187509	GD	On-Demand	Anodyne	DRD5	18	40
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1)CC2	ZINC000872187509	GD	On-Demand	Anodyne	HDAC6	30	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872187526	GD	On-Demand	Anodyne	FKBP1A	39	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872187526	GD	On-Demand	Anodyne	PREP	52	35
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872187527	GD	On-Demand	Anodyne	FKBP1A	39	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872187527	GD	On-Demand	Anodyne	PREP	52	35
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872187528	GD	On-Demand	Anodyne	FKBP1A	39	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872187528	GD	On-Demand	Anodyne	PREP	52	35
CN(CCCCCCN)C(=O)C(=O)N1CCC(N2CCCCC2)CC1	ZINC000872187630	FD	On-Demand	Anodyne	L3MBTL3	78	40
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872187635	FF	On-Demand	Anodyne	UTS2	45	36
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872187637	FF	On-Demand	Anodyne	UTS2	45	36
CCN(C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872187736	GD	On-Demand	Anodyne	CCR5	36	40
CCN(C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872187737	GD	On-Demand	Anodyne	CCR5	36	40
CN(CCCCCCN)C(=O)C(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000872187748	FD	On-Demand	Anodyne	ACHE	15	42
CN(CCCCCCN)C(=O)C(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000872187748	FD	On-Demand	Anodyne	SIGMAR1	39	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187761	FD	On-Demand	Anodyne	CCR5	15	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187761	FD	On-Demand	Anodyne	RBP4	28	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187761	FD	On-Demand	Anodyne	ADAM10	19	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187762	FD	On-Demand	Anodyne	CCR5	15	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187762	FD	On-Demand	Anodyne	RBP4	28	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187762	FD	On-Demand	Anodyne	ADAM10	19	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187763	FD	On-Demand	Anodyne	CCR5	15	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187763	FD	On-Demand	Anodyne	RBP4	28	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872187763	FD	On-Demand	Anodyne	ADAM10	19	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187764	FD	On-Demand	Anodyne	CCR5	15	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187764	FD	On-Demand	Anodyne	RBP4	28	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872187764	FD	On-Demand	Anodyne	ADAM10	19	41
CN(CCCCCCN)C(=O)C(=O)N(C1CC1)[C@H]1CCCc2ccccc21	ZINC000872187826	FG	On-Demand	Anodyne	CXCR4	48	41
CN(CCCCCCN)C(=O)C(=O)N(C1CC1)[C@@H]1CCCc2ccccc21	ZINC000872187827	FG	On-Demand	Anodyne	CXCR4	48	41
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000872187857	GE	On-Demand	Anodyne	HTR1F	52	34
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000872187857	GE	On-Demand	Anodyne	CCR2	20	44
CN(CCCCCCN)C(=O)C(=O)N1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000872187858	GD	On-Demand	Mild	PRSS2	58	33
COc1ccccc1C[C@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872187954	GE	On-Demand	Anodyne	MBTPS1	44	36
COc1ccccc1C[C@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872187954	GE	On-Demand	Anodyne	ACKR3	66	33
COc1ccccc1C[C@@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872187955	GE	On-Demand	Anodyne	MBTPS1	44	36
COc1ccccc1C[C@@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872187955	GE	On-Demand	Anodyne	ACKR3	66	33
COc1ccc2c(c1)CN(C(=O)C(=O)N(C)CCCCCCN)CC2	ZINC000872187984	ED	On-Demand	Anodyne	HDAC6	27	41
CN(CCCCCCN)C(=O)C(=O)N1CCCN(c2ccccc2)CC1	ZINC000872187985	FD	On-Demand	Anodyne	HTR7	23	40
CN(CCCCCCN)C(=O)C(=O)N1CCCN(c2ccccc2)CC1	ZINC000872187985	FD	On-Demand	Anodyne	SSTR1	41	39
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000872187986	GG	On-Demand	Anodyne	TSPO	26	43
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000872187986	GG	On-Demand	Anodyne	KLK3	46	32
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000872187986	GG	On-Demand	Anodyne	POLG_WNV	42	31
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccc(C#N)cc2F)CC1	ZINC000872187987	GD	On-Demand	Mild	SLC6A9	24	46
CN(CCCCCCN)C(=O)C(=O)N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872188003	GD	On-Demand	Mild	PRSS2	55	32
COc1ccc2c(c1)CN(C(=O)C(=O)N1C[C@@H]3CNC[C@]3(C)C1)CC2	ZINC000872188217	EC	On-Demand	Anodyne	HDAC6	30	40
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccccn1	ZINC000872188468	DD	On-Demand	Anodyne	CXCR4	37	42
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000872188613	FF	On-Demand	Anodyne	TACR1	24	41
COc1ccccc1C[C@H]1CCCN1C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872188697	FD	On-Demand	Anodyne	MBTPS1	50	37
COc1ccccc1C[C@@H]1CCCN1C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872188698	FD	On-Demand	Anodyne	MBTPS1	50	37
COc1cccc(C[C@@H]2CCCN2C(=O)C(=O)N(C)CCCCCCN)c1	ZINC000872188706	GE	On-Demand	Anodyne	ACKR3	57	33
CN(CCCCCCN)C(=O)C(=O)N1CCc2cc(Cl)ccc2C1	ZINC000872188857	FE	On-Demand	Anodyne	QRFPR	16	42
COc1cnccc1N1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872188870	GC	On-Demand	Anodyne	HTR1A	22	40
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872189087	FE	On-Demand	Anodyne	GRIN2B	37	40
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872189087	FE	On-Demand	Anodyne	CCR3	96	36
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872189088	FE	On-Demand	Anodyne	GRIN2B	37	40
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872189088	FE	On-Demand	Anodyne	CCR3	96	36
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccncc2)C1	ZINC000872189124	ED	On-Demand	Anodyne	PRSS2	43	30
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872189144	ED	On-Demand	Anodyne	GRIA1	63	43
CN(Cc1ccc(F)cc1Cl)C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1	ZINC000872189146	GE	On-Demand	Anodyne	P2RX7	45	37
CN(Cc1ccc(F)cc1Cl)C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872189147	GE	On-Demand	Anodyne	P2RX7	45	37
CN(Cc1ccc(F)cc1Cl)C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1	ZINC000872189148	GE	On-Demand	Anodyne	P2RX7	45	37
CN(Cc1ccc(F)cc1Cl)C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1	ZINC000872189149	GE	On-Demand	Anodyne	P2RX7	45	37
N[C@H](C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)C1)C1CCCC1	ZINC000872189151	GD	On-Demand	Anodyne	L3MBTL3	52	38
N[C@H](C[C@H]1CCCN(C(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)C1)C1CCCC1	ZINC000872189152	GD	On-Demand	Anodyne	L3MBTL3	52	38
N[C@H](C[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](N3CCCC3)C2)C1)C1CCCC1	ZINC000872189153	GD	On-Demand	Anodyne	L3MBTL3	52	38
N[C@H](C[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](N3CCCC3)C2)C1)C1CCCC1	ZINC000872189154	GD	On-Demand	Anodyne	L3MBTL3	52	38
COc1ccccc1[C@@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872189165	FE	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872189165	FE	On-Demand	Anodyne	ACKR3	60	31
COc1ccccc1[C@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872189166	FE	On-Demand	Anodyne	HTR1A	17	40
COc1ccccc1[C@H]1CCCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872189166	FE	On-Demand	Anodyne	ACKR3	60	31
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872189173	GE	On-Demand	Anodyne	FKBP1A	47	40
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872189174	GE	On-Demand	Anodyne	FKBP1A	47	40
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@H]2Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000872189175	GE	On-Demand	Anodyne	FKBP1A	47	40
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@@H]2Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000872189176	GE	On-Demand	Anodyne	FKBP1A	47	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872189280	GD	On-Demand	Anodyne	NACHRBETA2	41	38
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000872189367	ED	On-Demand	Anodyne	L3MBTL3	56	38
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000872189368	ED	On-Demand	Anodyne	L3MBTL3	56	38
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872189428	GD	On-Demand	Anodyne	L3MBTL3	40	36
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872189430	GD	On-Demand	Anodyne	L3MBTL3	40	36
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872189432	GD	On-Demand	Anodyne	L3MBTL3	40	36
NC[C@@H]1CN(C(=O)C(=O)N2CCCC[C@@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872189434	GD	On-Demand	Anodyne	L3MBTL3	40	36
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000872189558	DC	On-Demand	Anodyne	L3MBTL3	62	39
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000872189559	DC	On-Demand	Anodyne	L3MBTL3	62	39
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872189581	GD	On-Demand	Anodyne	ACHE	26	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](N3CCCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872189665	GC	On-Demand	Anodyne	L3MBTL3	75	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](N3CCCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872189667	GC	On-Demand	Anodyne	L3MBTL3	75	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](N3CCCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872189668	GC	On-Demand	Anodyne	L3MBTL3	75	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](N3CCCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872189669	GC	On-Demand	Anodyne	L3MBTL3	75	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](N3CCCC3)CC2)C[C@@H]1C(F)(F)F	ZINC000872189720	GD	On-Demand	Anodyne	L3MBTL3	83	44
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](N3CCCC3)CC2)C[C@@H]1C(F)(F)F	ZINC000872189721	GD	On-Demand	Anodyne	L3MBTL3	83	44
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](N3CCCC3)CC2)C[C@H]1C(F)(F)F	ZINC000872189722	GD	On-Demand	Anodyne	L3MBTL3	83	44
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](N3CCCC3)CC2)C[C@H]1C(F)(F)F	ZINC000872189723	GD	On-Demand	Anodyne	L3MBTL3	83	44
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3F)C2)C[C@@H]1C(F)(F)F	ZINC000872189734	GD	On-Demand	Anodyne	RBP4	40	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3F)C2)C[C@H]1C(F)(F)F	ZINC000872189735	GD	On-Demand	Anodyne	RBP4	40	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](c3ccccc3F)C2)C[C@@H]1C(F)(F)F	ZINC000872189736	GD	On-Demand	Anodyne	RBP4	40	40
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](c3ccccc3F)C2)C[C@H]1C(F)(F)F	ZINC000872189737	GD	On-Demand	Anodyne	RBP4	40	40
Cc1ccc(C[C@@H](C)N(C)C(=O)C(=O)N(C)CCCCCCN)cc1	ZINC000872189875	EE	On-Demand	Anodyne	GRIA1	42	34
CN(CCCCCCN)C(=O)C(=O)N1CCCc2ccccc2C1	ZINC000872190068	ED	On-Demand	Anodyne	DPP8	20	43
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	CHRM2	19	44
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	DRD2	18	42
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	DRD4	43	42
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	ACHE	46	51
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	HRH3	15	41
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	SIGMAR1	68	56
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	CCR5	22	41
CN(CCCCCCN)C(=O)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000872190213	GE	On-Demand	Anodyne	CACNA1G	21	41
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@H]1CCc1ccccc1	ZINC000872190219	FF	On-Demand	Anodyne	FKBP1A	68	42
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@H]1CCc1ccccc1	ZINC000872190219	FF	On-Demand	Anodyne	SLC18A2	44	46
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@H]1CCc1ccccc1	ZINC000872190219	FF	On-Demand	Anodyne	PREP	51	36
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@@H]1CCc1ccccc1	ZINC000872190220	FF	On-Demand	Anodyne	FKBP1A	68	42
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@@H]1CCc1ccccc1	ZINC000872190220	FF	On-Demand	Anodyne	SLC18A2	44	46
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@@H]1CCc1ccccc1	ZINC000872190220	FF	On-Demand	Anodyne	PREP	51	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190431	GD	On-Demand	Anodyne	FKBP1A	15	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190431	GD	On-Demand	Anodyne	GRIN2B	45	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190431	GD	On-Demand	Anodyne	CHRNA7	44	36
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190432	GD	On-Demand	Anodyne	FKBP1A	15	40
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190432	GD	On-Demand	Anodyne	GRIN2B	45	42
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190432	GD	On-Demand	Anodyne	CHRNA7	44	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190433	GD	On-Demand	Anodyne	FKBP1A	15	40
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190433	GD	On-Demand	Anodyne	GRIN2B	45	42
NC[C@@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190433	GD	On-Demand	Anodyne	CHRNA7	44	36
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190434	GD	On-Demand	Anodyne	FKBP1A	15	40
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190434	GD	On-Demand	Anodyne	GRIN2B	45	42
NC[C@H]1CN(C(=O)C(=O)N2CCC(Cc3cccnc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190434	GD	On-Demand	Anodyne	CHRNA7	44	36
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000872190545	GE	On-Demand	Anodyne	EDNRA	47	39
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000872190545	GE	On-Demand	Anodyne	PDE11A	63	35
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000872190547	GE	On-Demand	Anodyne	EDNRA	47	39
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000872190547	GE	On-Demand	Anodyne	PDE11A	63	35
CN(CCCCCCN)C(=O)C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000872190553	FF	On-Demand	Anodyne	CCR1	29	41
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Cc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872190554	GE	On-Demand	Anodyne	GRIN2B	41	34
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Cc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872190555	GE	On-Demand	Anodyne	GRIN2B	41	34
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Cc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872190556	GE	On-Demand	Anodyne	GRIN2B	41	34
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Cc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872190557	GE	On-Demand	Anodyne	GRIN2B	41	34
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000872190691	GF	On-Demand	Anodyne	CACNA1B	47	36
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000872190691	GF	On-Demand	Anodyne	CCR2	41	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000872190692	GF	On-Demand	Anodyne	CACNA1B	47	36
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000872190692	GF	On-Demand	Anodyne	CCR2	41	41
C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872190749	FF	On-Demand	Anodyne	GRIA1	44	34
CN(CCCCCCN)C(=O)C(=O)N1CCc2ccc(F)cc2C1	ZINC000872190843	ED	On-Demand	Anodyne	HDAC6	35	41
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000872190871	FF	On-Demand	Anodyne	SLC18A3	52	39
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000872190873	FF	On-Demand	Anodyne	SLC18A3	52	39
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000872190888	GF	On-Demand	Anodyne	GRIN2B	49	45
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000872190888	GF	On-Demand	Anodyne	CCR3	65	45
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190916	GE	On-Demand	Anodyne	SLC18A3	45	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190916	GE	On-Demand	Anodyne	RBP4	24	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190916	GE	On-Demand	Anodyne	SFRP1	55	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190916	GE	On-Demand	Anodyne	WNT3	47	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190917	GE	On-Demand	Anodyne	SLC18A3	45	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190917	GE	On-Demand	Anodyne	RBP4	24	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190917	GE	On-Demand	Anodyne	SFRP1	55	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190917	GE	On-Demand	Anodyne	WNT3	47	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190918	GE	On-Demand	Anodyne	SLC18A3	45	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190918	GE	On-Demand	Anodyne	RBP4	24	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190918	GE	On-Demand	Anodyne	SFRP1	55	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872190918	GE	On-Demand	Anodyne	WNT3	47	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190919	GE	On-Demand	Anodyne	SLC18A3	45	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190919	GE	On-Demand	Anodyne	RBP4	24	43
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190919	GE	On-Demand	Anodyne	SFRP1	55	32
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872190919	GE	On-Demand	Anodyne	WNT3	47	32
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000872191063	FF	On-Demand	Anodyne	GHRHR	40	33
CN(CCCCCCN)C(=O)C(=O)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000872191064	FF	On-Demand	Anodyne	GHRHR	40	33
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872191127	GC	On-Demand	Anodyne	HTR1A	27	41
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872191127	GC	On-Demand	Anodyne	DRD2	15	41
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872191127	GC	On-Demand	Anodyne	HTR7	42	42
CN(CCCCCCN)C(=O)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000872191218	EE	On-Demand	Anodyne	KCNA3	15	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2cccc(F)c2)C1	ZINC000872191338	FD	On-Demand	Anodyne	MLNR	23	47
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000872191339	FD	On-Demand	Anodyne	MLNR	23	47
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872191376	GE	On-Demand	Anodyne	SCD1	29	42
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872191376	GE	On-Demand	Anodyne	SCD	23	44
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872191378	GE	On-Demand	Anodyne	SCD1	29	42
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872191378	GE	On-Demand	Anodyne	SCD	23	44
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872191379	FD	On-Demand	Anodyne	GRIN2B	52	40
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872191379	FD	On-Demand	Anodyne	CHRNA7	45	37
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872191379	FD	On-Demand	Anodyne	C3AR1	39	40
C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191429	GH	On-Demand	Anodyne	TSPO	15	41
C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191429	GH	On-Demand	Anodyne	KLK3	40	31
C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191429	GH	On-Demand	Anodyne	UTS2	70	39
C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191431	GH	On-Demand	Anodyne	TSPO	15	41
C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191431	GH	On-Demand	Anodyne	KLK3	40	31
C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872191431	GH	On-Demand	Anodyne	UTS2	70	39
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000872191432	FD	On-Demand	Anodyne	L3MBTL3	69	41
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000872191434	FD	On-Demand	Anodyne	L3MBTL3	69	41
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)C(=O)N(C)CCCCCCN	ZINC000872191553	FD	On-Demand	Anodyne	CCR1	21	41
CCN(C(=O)C(=O)N(C)CCCCCCN)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000872191600	GD	On-Demand	Anodyne	AMY2	45	32
CCN(C(=O)C(=O)N(C)CCCCCCN)[C@H]1CCN(c2ccccc2)C1=O	ZINC000872191601	GD	On-Demand	Anodyne	AMY2	45	32
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872191602	FC	On-Demand	Anodyne	L3MBTL3	76	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872191603	FC	On-Demand	Anodyne	L3MBTL3	76	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)C[C@H]1C(F)(F)F	ZINC000872191604	FC	On-Demand	Anodyne	L3MBTL3	76	42
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)C[C@@H]1C(F)(F)F	ZINC000872191605	FC	On-Demand	Anodyne	L3MBTL3	76	42
COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872191628	GC	On-Demand	Anodyne	BMP1	50	34
COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872191628	GC	On-Demand	Anodyne	NOS2	45	33
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1cccc(N(C)C)c1	ZINC000872191679	ED	On-Demand	Anodyne	HSD17B2	21	44
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000872191705	FF	On-Demand	Anodyne	FKBP1A	54	41
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000872191705	FF	On-Demand	Anodyne	PREP	45	36
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000872191706	FF	On-Demand	Anodyne	FKBP1A	54	41
CN(CCCCCCN)C(=O)C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000872191706	FF	On-Demand	Anodyne	PREP	45	36
CN(CCCCCCN)C(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	ZINC000872191749	GD	On-Demand	Anodyne	KLK3	42	29
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000872191841	FC	On-Demand	Anodyne	SLC27A1	41	43
CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ncc(-c2ccccc2)[nH]1	ZINC000872191983	FE	On-Demand	Anodyne	TSPO	19	42
CN(CCCCCCN)C(=O)C(=O)N(C)CC[C@@H]1CCCCN1C	ZINC000872191988	ED	On-Demand	Anodyne	ACKR3	51	32
CN(CCCCCCN)C(=O)C(=O)N(C)CC[C@H]1CCCCN1C	ZINC000872191989	ED	On-Demand	Anodyne	ACKR3	51	32
CN(CCCCCCN)C(=O)C(=O)N1CCC(N2CCc3ccccc32)CC1	ZINC000872191994	GE	On-Demand	Anodyne	AVPR1A	15	45
C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872192012	GG	On-Demand	Anodyne	UTS2	41	33
C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872192013	GG	On-Demand	Anodyne	UTS2	41	33
C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872192014	GG	On-Demand	Anodyne	UTS2	41	33
C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)C(=O)N(C)CCCCCCN	ZINC000872192015	GG	On-Demand	Anodyne	UTS2	41	33
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192064	GC	On-Demand	Anodyne	ACHE	34	40
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192064	GC	On-Demand	Anodyne	SIGMAR1	55	42
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192064	GC	On-Demand	Anodyne	FAAH	15	43
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192064	GC	On-Demand	Anodyne	CACNA1G	19	40
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192065	GC	On-Demand	Anodyne	ACHE	34	40
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192065	GC	On-Demand	Anodyne	SIGMAR1	55	42
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192065	GC	On-Demand	Anodyne	FAAH	15	43
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@@H]1C(F)(F)F	ZINC000872192065	GC	On-Demand	Anodyne	CACNA1G	19	40
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192066	GC	On-Demand	Anodyne	ACHE	34	40
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192066	GC	On-Demand	Anodyne	SIGMAR1	55	42
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192066	GC	On-Demand	Anodyne	FAAH	15	43
NC[C@@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192066	GC	On-Demand	Anodyne	CACNA1G	19	40
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192067	GC	On-Demand	Anodyne	ACHE	34	40
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192067	GC	On-Demand	Anodyne	SIGMAR1	55	42
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192067	GC	On-Demand	Anodyne	FAAH	15	43
NC[C@H]1CN(C(=O)C(=O)N2CCN(Cc3ccccc3)CC2)C[C@H]1C(F)(F)F	ZINC000872192067	GC	On-Demand	Anodyne	CACNA1G	19	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@]2(CCCc3ccccc32)C1	ZINC000872192263	GF	On-Demand	Anodyne	EBP	16	40
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@]2(CCCc3ccccc32)C1	ZINC000872192264	GF	On-Demand	Anodyne	EBP	16	40
CN(CCCCCCN)C(=O)C(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000872192378	GD	On-Demand	Anodyne	P2RX7	27	44
N[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192438	DC	On-Demand	Anodyne	OXTR	46	37
N[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192438	DC	On-Demand	Anodyne	SLC18A3	16	42
N[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192440	DC	On-Demand	Anodyne	OXTR	46	37
N[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192440	DC	On-Demand	Anodyne	SLC18A3	16	42
N[C@@H]1CC[C@@H]2CN(C(=O)C(=O)N3CC[C@@]4(CCc5ccccc54)C3)C[C@@H]21	ZINC000872192534	FD	On-Demand	Anodyne	OXTR	54	39
N[C@@H]1CC[C@@H]2CN(C(=O)C(=O)N3CC[C@]4(CCc5ccccc54)C3)C[C@H]21	ZINC000872192535	FD	On-Demand	Anodyne	OXTR	54	39
N[C@@H]1CC[C@@H]2CN(C(=O)C(=O)N3CC[C@@]4(CCc5ccccc54)C3)C[C@H]21	ZINC000872192536	FD	On-Demand	Anodyne	OXTR	54	39
N[C@@H]1CC[C@@H]2CN(C(=O)C(=O)N3CC[C@]4(CCc5ccccc54)C3)C[C@@H]21	ZINC000872192537	FD	On-Demand	Anodyne	OXTR	54	39
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Nc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872192580	GD	On-Demand	Anodyne	SFRP1	55	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Nc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872192580	GD	On-Demand	Anodyne	WNT3	58	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Nc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872192581	GD	On-Demand	Anodyne	SFRP1	55	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](Nc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872192581	GD	On-Demand	Anodyne	WNT3	58	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Nc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872192582	GD	On-Demand	Anodyne	SFRP1	55	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Nc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872192582	GD	On-Demand	Anodyne	WNT3	58	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Nc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872192583	GD	On-Demand	Anodyne	SFRP1	55	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](Nc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872192583	GD	On-Demand	Anodyne	WNT3	58	33
CCNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872192706	FD	On-Demand	Anodyne	OXTR	57	39
CCNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872192706	FD	On-Demand	Anodyne	GHRHR	44	39
CCNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872192706	FD	On-Demand	Anodyne	SLC18A3	15	40
CCNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872192707	FD	On-Demand	Anodyne	OXTR	57	39
CCNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872192707	FD	On-Demand	Anodyne	GHRHR	44	39
CCNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872192707	FD	On-Demand	Anodyne	SLC18A3	15	40
CN(CCCCCCN)C(=O)C(=O)N(C)OCc1ccccc1	ZINC000872192790	DD	On-Demand	Anodyne	KLK3	55	33
NC[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192892	ED	On-Demand	Anodyne	OXTR	45	37
NC[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192892	ED	On-Demand	Anodyne	GHRHR	26	40
NC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192893	ED	On-Demand	Anodyne	OXTR	45	37
NC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872192893	ED	On-Demand	Anodyne	GHRHR	26	40
NC[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192894	ED	On-Demand	Anodyne	OXTR	45	37
NC[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192894	ED	On-Demand	Anodyne	GHRHR	26	40
NC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192895	ED	On-Demand	Anodyne	OXTR	45	37
NC[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872192895	ED	On-Demand	Anodyne	GHRHR	26	40
NC[C@@H]1CCCCN1C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872192919	ED	On-Demand	Anodyne	OXTR	52	38
NC[C@@H]1CCCCN1C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872192920	ED	On-Demand	Anodyne	OXTR	52	38
NC[C@H]1CCCCN1C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872192921	ED	On-Demand	Anodyne	OXTR	52	38
NC[C@H]1CCCCN1C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872192922	ED	On-Demand	Anodyne	OXTR	52	38
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872192968	FD	On-Demand	Anodyne	DRD4	30	45
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872192968	FD	On-Demand	Anodyne	ACHE	23	45
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872192968	FD	On-Demand	Anodyne	SIGMAR1	50	43
CN(CCCCCCN)C(=O)C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872192968	FD	On-Demand	Anodyne	FAAH	21	42
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000872193229	GE	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000872193230	GE	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000872193231	GE	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000872193232	GE	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000872193236	GD	On-Demand	Anodyne	HTR1A	23	49
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000872193236	GD	On-Demand	Anodyne	HTR2A	19	49
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000872193236	GD	On-Demand	Anodyne	HTR7	26	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000872193236	GD	On-Demand	Anodyne	SSTR1	41	48
COc1ccc(CN(C)C(=O)C(=O)N(C)CCCCCCN)cc1Cl	ZINC000872193310	FE	On-Demand	Anodyne	PDE6A	45	36
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872193414	DC	On-Demand	Anodyne	SLC18A3	15	42
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCNCC1	ZINC000872193415	DC	On-Demand	Anodyne	SLC18A3	15	42
CN(CCCCCCN)C(=O)C(=O)N1CCC(Cc2cc(F)ccc2F)CC1	ZINC000872193444	GF	On-Demand	Anodyne	DPP4	16	45
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872193609	FE	On-Demand	Anodyne	GHRHR	20	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872193611	FE	On-Demand	Anodyne	GHRHR	20	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C(=O)N3CCNCC3)C2)C1	ZINC000872193630	GB	On-Demand	Anodyne	PREP	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C(=O)N3CCNCC3)C2)C1	ZINC000872193631	GB	On-Demand	Anodyne	PREP	16	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C(=O)N3CCNCC3)C2)C1	ZINC000872193632	GB	On-Demand	Anodyne	PREP	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C(=O)N3CCNCC3)C2)C1	ZINC000872193633	GB	On-Demand	Anodyne	PREP	16	40
NC[C@H]1CCCN1C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872193634	ED	On-Demand	Anodyne	OXTR	54	39
NC[C@H]1CCCN1C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872193635	ED	On-Demand	Anodyne	OXTR	54	39
NC[C@@H]1CCCN1C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872193636	ED	On-Demand	Anodyne	OXTR	54	39
NC[C@@H]1CCCN1C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872193637	ED	On-Demand	Anodyne	OXTR	54	39
CC(=O)C1CCN(C(=O)C(=O)N(CCCN)Cc2ccccc2)CC1	ZINC000872193638	ED	On-Demand	Anodyne	SIGMAR1	19	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCC(CN)CC1	ZINC000872193656	GF	On-Demand	Anodyne	MDM2	75	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193663	EC	On-Demand	Anodyne	SLC6A1	60	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193663	EC	On-Demand	Anodyne	PREP	40	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193663	EC	On-Demand	Anodyne	DPP7	61	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193665	EC	On-Demand	Anodyne	SLC6A1	60	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193665	EC	On-Demand	Anodyne	PREP	40	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N(CCN)Cc2ccccc2)C1	ZINC000872193665	EC	On-Demand	Anodyne	DPP7	61	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](N)C1)CC2	ZINC000872193691	EC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@H](N)C1)CC2	ZINC000872193695	EC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](N)C1)CC2	ZINC000872193698	EC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@H](N)C1)CC2	ZINC000872193699	EC	On-Demand	Anodyne	SLC18A2	49	37
NC[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872193718	EC	On-Demand	Anodyne	OXTR	50	38
NC[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872193719	EC	On-Demand	Anodyne	OXTR	50	38
NC[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872193720	EC	On-Demand	Anodyne	OXTR	50	38
NC[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872193721	EC	On-Demand	Anodyne	OXTR	50	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCNCC1)CC2	ZINC000872193746	EC	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCNCC1)CC2	ZINC000872193746	EC	On-Demand	Anodyne	MTNR1B	18	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCNCC1)CC2	ZINC000872193748	EC	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCNCC1)CC2	ZINC000872193748	EC	On-Demand	Anodyne	MTNR1B	18	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)C[C@@H](C)N)CC2	ZINC000872193754	EC	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)C[C@H](C)N)CC2	ZINC000872193755	EC	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)C[C@H](C)N)CC2	ZINC000872193756	EC	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)C[C@@H](C)N)CC2	ZINC000872193757	EC	On-Demand	Anodyne	SLC18A2	53	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCCNC2)CC1	ZINC000872193802	GE	On-Demand	Anodyne	OXTR	42	41
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCCNC2)CC1	ZINC000872193804	GE	On-Demand	Anodyne	OXTR	42	41
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCCNC2)CC1	ZINC000872193806	GE	On-Demand	Anodyne	OXTR	42	41
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCCNC2)CC1	ZINC000872193808	GE	On-Demand	Anodyne	OXTR	42	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](N)C1)CC2	ZINC000872193810	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](N)C1)CC2	ZINC000872193812	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](N)C1)CC2	ZINC000872193814	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](N)C1)CC2	ZINC000872193816	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3C[C@H]1CN3)CC2	ZINC000872193825	FC	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H]3C[C@H]1CN3)CC2	ZINC000872193826	FC	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CC[C@H](N)[C@H]3C1)CC2	ZINC000872193858	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H]3[C@H](N)CC[C@H]3C1)CC2	ZINC000872193859	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H]3[C@@H](N)CC[C@H]3C1)CC2	ZINC000872193860	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CC[C@@H](N)[C@H]3C1)CC2	ZINC000872193862	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(N)CC1)CC2	ZINC000872193875	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(N)CC1)CC2	ZINC000872193875	FD	On-Demand	Anodyne	MTNR1B	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(N)CC1)CC2	ZINC000872193876	FD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(N)CC1)CC2	ZINC000872193876	FD	On-Demand	Anodyne	MTNR1B	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC([C@H](C)N)CC1)CC2	ZINC000872193883	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC([C@@H](C)N)CC1)CC2	ZINC000872193884	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC([C@H](C)N)CC1)CC2	ZINC000872193886	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC([C@@H](C)N)CC1)CC2	ZINC000872193887	GD	On-Demand	Anodyne	SLC18A2	50	36
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1	ZINC000872193893	EC	On-Demand	Anodyne	PTAFR	34	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3ccccc3)C2)C1	ZINC000872193969	EC	On-Demand	Anodyne	SLC6A1	66	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3ccccc3)C2)C1	ZINC000872193969	EC	On-Demand	Anodyne	CCR5	37	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3ccccc3)C2)C1	ZINC000872193970	EC	On-Demand	Anodyne	SLC6A1	66	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3ccccc3)C2)C1	ZINC000872193970	EC	On-Demand	Anodyne	CCR5	37	46
COc1ccc(CN(C)C(=O)C(=O)N(C)CCCCCCN)cc1O	ZINC000872194005	FD	On-Demand	Anodyne	INHA	64	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H]([C@@H](C)N)C1)CC2	ZINC000872194031	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H]([C@H](C)N)C1)CC2	ZINC000872194032	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H]([C@@H](C)N)C1)CC2	ZINC000872194033	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H]([C@H](C)N)C1)CC2	ZINC000872194034	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@@H]([C@@H](C)N)C1)CC2	ZINC000872194051	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@H]([C@H](C)N)C1)CC2	ZINC000872194052	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@H]([C@@H](C)N)C1)CC2	ZINC000872194053	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@@H]([C@H](C)N)C1)CC2	ZINC000872194054	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(CN)CC1)CC2	ZINC000872194065	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(CN)CC1)CC2	ZINC000872194066	GD	On-Demand	Anodyne	SLC18A2	49	36
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@@H]2NCC[C@H]2C1	ZINC000872194084	FD	On-Demand	Anodyne	OXTR	54	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@H]2NCC[C@@H]2C1	ZINC000872194085	FD	On-Demand	Anodyne	OXTR	54	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@@H]2NCC[C@@H]2C1	ZINC000872194086	FD	On-Demand	Anodyne	OXTR	54	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@H]2NCC[C@H]2C1	ZINC000872194087	FD	On-Demand	Anodyne	OXTR	54	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(C)(N)CC1)CC2	ZINC000872194127	GD	On-Demand	Anodyne	SLC18A2	42	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(C)(N)CC1)CC2	ZINC000872194129	GD	On-Demand	Anodyne	SLC18A2	42	37
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@@H](N)C1	ZINC000872194135	ED	On-Demand	Anodyne	MDM2	72	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@H](N)C1	ZINC000872194136	ED	On-Demand	Anodyne	MDM2	72	32
O=C(C(=O)N1CCCC[C@@H]1[C@H]1CCCNC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872194149	GE	On-Demand	Anodyne	OXTR	26	41
O=C(C(=O)N1CCCC[C@@H]1[C@H]1CCCNC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872194150	GE	On-Demand	Anodyne	OXTR	26	41
O=C(C(=O)N1CCCC[C@@H]1[C@@H]1CCCNC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872194151	GE	On-Demand	Anodyne	OXTR	26	41
O=C(C(=O)N1CCCC[C@@H]1[C@@H]1CCCNC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872194152	GE	On-Demand	Anodyne	OXTR	26	41
CC(=O)C1CCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3ccccc3)C2)CC1	ZINC000872194154	EC	On-Demand	Anodyne	CCR5	23	41
COc1ccccc1[C@@H]1CNCCN1C(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000872194164	FC	On-Demand	Anodyne	MBTPS1	51	37
COc1ccccc1[C@@H]1CNCCN1C(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000872194168	FC	On-Demand	Anodyne	MBTPS1	51	37
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC2(CCNCC2)C1	ZINC000872194230	FD	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC2(CCNCC2)C1	ZINC000872194231	FD	On-Demand	Anodyne	SLC18A3	15	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](N)[C@H](C)C1)CC2	ZINC000872194255	GD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](N)[C@@H](C)C1)CC2	ZINC000872194256	GD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](N)[C@H](C)C1)CC2	ZINC000872194258	GD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](N)[C@@H](C)C1)CC2	ZINC000872194259	GD	On-Demand	Anodyne	SLC18A2	50	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@H](C2CCNCC2)C1	ZINC000872194273	GE	On-Demand	Anodyne	OXTR	52	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@@H](C2CCNCC2)C1	ZINC000872194275	GE	On-Demand	Anodyne	OXTR	52	38
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC[C@H](C2CCNCC2)C1	ZINC000872194278	GE	On-Demand	Anodyne	OXTR	52	38
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC[C@@H](C2CCNCC2)C1	ZINC000872194279	GE	On-Demand	Anodyne	OXTR	52	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1C[C@@H]2CC[C@H](C1)N2	ZINC000872194367	ED	On-Demand	Anodyne	OXTR	47	37
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1C[C@@H]2CC[C@H](C1)N2	ZINC000872194367	ED	On-Demand	Anodyne	SLC18A3	17	42
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1C[C@@H]2CC[C@H](C1)N2	ZINC000872194368	ED	On-Demand	Anodyne	OXTR	47	37
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1C[C@@H]2CC[C@H](C1)N2	ZINC000872194368	ED	On-Demand	Anodyne	SLC18A3	17	42
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@@H]([C@H]2CCCNC2)C1	ZINC000872194420	GE	On-Demand	Anodyne	OXTR	36	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@H]([C@@H]2CCCNC2)C1	ZINC000872194421	GE	On-Demand	Anodyne	OXTR	36	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@H]([C@H]2CCCNC2)C1	ZINC000872194422	GE	On-Demand	Anodyne	OXTR	36	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@@H]([C@@H]2CCCNC2)C1	ZINC000872194423	GE	On-Demand	Anodyne	OXTR	36	40
CN(CCOCCN)C(=O)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000872194424	GD	On-Demand	Anodyne	MDM2	92	33
CN(CCOCCN)C(=O)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000872194425	GD	On-Demand	Anodyne	MDM2	92	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@H](CN)C1)CC2	ZINC000872194450	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCO[C@@H](CN)C1)CC2	ZINC000872194451	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCO[C@@H](CN)C1)CC2	ZINC000872194452	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCO[C@H](CN)C1)CC2	ZINC000872194453	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CC(C)(C)N)CC2	ZINC000872194461	FD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CC(C)(C)N)CC2	ZINC000872194462	FD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](CCN)C1)CC2	ZINC000872194472	GD	On-Demand	Anodyne	SLC18A2	48	35
CC(=O)C1CCN(C(=O)C(=O)N2C[C@@H](CN)[C@H](c3ccccc3)C2)CC1	ZINC000872194474	FD	On-Demand	Anodyne	CCR5	41	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](CCN)C1)CC2	ZINC000872194475	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](CCN)C1)CC2	ZINC000872194476	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](CCN)C1)CC2	ZINC000872194478	GD	On-Demand	Anodyne	SLC18A2	48	35
N[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872194483	DC	On-Demand	Anodyne	OXTR	46	37
N[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872194483	DC	On-Demand	Anodyne	SLC18A3	16	42
N[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872194489	DC	On-Demand	Anodyne	OXTR	46	37
N[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872194489	DC	On-Demand	Anodyne	SLC18A3	16	42
NC[C@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194494	GD	On-Demand	Anodyne	EPHX2	19	41
NC[C@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194504	GD	On-Demand	Anodyne	EPHX2	19	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194510	GD	On-Demand	Anodyne	EPHX2	19	41
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@H](Oc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194517	GD	On-Demand	Anodyne	EPHX2	19	41
NCCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872194611	FD	On-Demand	Anodyne	OXTR	50	38
NCCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872194614	FD	On-Demand	Anodyne	OXTR	50	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3cccc(F)c3)C2)C1	ZINC000872194656	FC	On-Demand	Anodyne	CCR5	90	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3cccc(F)c3)C2)C1	ZINC000872194657	FC	On-Demand	Anodyne	CCR5	90	37
COc1ccccc1[C@@H]1CNCCN1C(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000872194671	FC	On-Demand	Anodyne	MBTPS1	49	34
C[C@@H](N)C1CCN(C(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)CC1	ZINC000872194678	GD	On-Demand	Anodyne	SIGMAR1	36	40
C[C@H](NC(=O)C(=O)N(C)CCCCCCN)c1ccccc1	ZINC000872194712	DD	On-Demand	Anodyne	KLK3	51	32
C[C@H](NC(=O)C(=O)N(C)CCCCCCN)c1ccccc1	ZINC000872194712	DD	On-Demand	Anodyne	CTSK	24	40
C[C@H](NC(=O)C(=O)N(C)CCCCCCN)c1ccccc1	ZINC000872194712	DD	On-Demand	Anodyne	POLG_WNV	40	29
CC[C@@H](NC(=O)C(=O)N(C)CCCCCCN)c1ccccc1	ZINC000872194729	DE	On-Demand	Anodyne	TACR3	45	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H]3CCC[C@H](C1)N3)CC2	ZINC000872194736	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CCC[C@H](C1)N3)CC2	ZINC000872194737	GD	On-Demand	Anodyne	SLC18A2	48	36
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194781	GD	On-Demand	Anodyne	SLC6A1	42	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194783	GD	On-Demand	Anodyne	SLC6A1	42	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194785	GD	On-Demand	Anodyne	SLC6A1	42	33
NC[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](c3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194786	GD	On-Demand	Anodyne	SLC6A1	42	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCCN)CC2	ZINC000872194801	EC	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCCN)CC2	ZINC000872194805	EC	On-Demand	Anodyne	SLC18A2	51	38
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCC[C@H](CN)C1	ZINC000872194834	GF	On-Demand	Anodyne	MDM2	47	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCC[C@@H](CN)C1	ZINC000872194836	GF	On-Demand	Anodyne	MDM2	47	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@H](F)[C@H](N)C1)CC2	ZINC000872194896	GD	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](F)[C@H](N)C1)CC2	ZINC000872194897	GD	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCCCCCN)CC2	ZINC000872194928	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCCCCCN)CC2	ZINC000872194930	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](C)[C@@H](CN)C1)CC2	ZINC000872194952	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](C)[C@H](CN)C1)CC2	ZINC000872194955	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](C)[C@H](CN)C1)CC2	ZINC000872194956	GD	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](C)[C@@H](CN)C1)CC2	ZINC000872194957	GD	On-Demand	Anodyne	SLC18A2	51	38
CNCC1CCN(C(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)CC1	ZINC000872194975	GF	On-Demand	Anodyne	MDM2	61	33
CNCC1CCN(C(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)CC1	ZINC000872194975	GF	On-Demand	Anodyne	CACNA1I	45	38
CNCC1CCN(C(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)CC1	ZINC000872194976	GF	On-Demand	Anodyne	MDM2	61	33
CNCC1CCN(C(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)CC1	ZINC000872194976	GF	On-Demand	Anodyne	CACNA1I	45	38
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCNC2)CC1	ZINC000872194987	GD	On-Demand	Anodyne	OXTR	56	39
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCNC2)CC1	ZINC000872194988	GD	On-Demand	Anodyne	OXTR	56	39
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCNC2)CC1	ZINC000872194990	GD	On-Demand	Anodyne	OXTR	56	39
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](Oc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194991	GD	On-Demand	Anodyne	EPHX2	19	41
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCNC2)CC1	ZINC000872194992	GD	On-Demand	Anodyne	OXTR	56	39
NC[C@H]1CN(C(=O)C(=O)N2CC[C@@H](Oc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194993	GD	On-Demand	Anodyne	EPHX2	19	41
NC[C@H]1CN(C(=O)C(=O)N2CC[C@@H](Oc3ccccc3)C2)C[C@H]1C(F)(F)F	ZINC000872194994	GD	On-Demand	Anodyne	EPHX2	19	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H](CN)C1)CC2	ZINC000872194995	GD	On-Demand	Anodyne	SLC18A2	49	36
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](Oc3ccccc3)C2)C[C@@H]1C(F)(F)F	ZINC000872194997	GD	On-Demand	Anodyne	EPHX2	19	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@@H](CN)C1)CC2	ZINC000872194998	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H](CN)C1)CC2	ZINC000872195000	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC[C@H](CN)C1)CC2	ZINC000872195002	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCN)CC2	ZINC000872195003	EC	On-Demand	Anodyne	SLC18A2	51	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCN)CC2	ZINC000872195009	EC	On-Demand	Anodyne	SLC18A2	51	38
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@H]1CN	ZINC000872195090	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@H]1CN	ZINC000872195090	FD	On-Demand	Anodyne	GHRHR	41	41
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H]1CN	ZINC000872195094	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H]1CN	ZINC000872195094	FD	On-Demand	Anodyne	GHRHR	41	41
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H]1CN	ZINC000872195097	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H]1CN	ZINC000872195097	FD	On-Demand	Anodyne	GHRHR	41	41
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195099	GD	On-Demand	Anodyne	AMY2	45	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195099	GD	On-Demand	Anodyne	SFRP1	62	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195099	GD	On-Demand	Anodyne	WNT3	41	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)C1	ZINC000872195100	GD	On-Demand	Anodyne	AMY2	45	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)C1	ZINC000872195100	GD	On-Demand	Anodyne	SFRP1	62	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](C(F)(F)F)[C@H](CN)C2)C1	ZINC000872195100	GD	On-Demand	Anodyne	WNT3	41	36
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@H]1CN	ZINC000872195101	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@H]1CN	ZINC000872195101	FD	On-Demand	Anodyne	GHRHR	41	41
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195102	GD	On-Demand	Anodyne	AMY2	45	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195102	GD	On-Demand	Anodyne	SFRP1	62	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@@H](C(F)(F)F)C2)C1	ZINC000872195102	GD	On-Demand	Anodyne	WNT3	41	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@H](C(F)(F)F)C2)C1	ZINC000872195103	GD	On-Demand	Anodyne	AMY2	45	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@H](C(F)(F)F)C2)C1	ZINC000872195103	GD	On-Demand	Anodyne	SFRP1	62	36
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)N2C[C@H](CN)[C@H](C(F)(F)F)C2)C1	ZINC000872195103	GD	On-Demand	Anodyne	WNT3	41	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](CN)[C@H](c3ccccc3)C2)C1	ZINC000872195171	FD	On-Demand	Anodyne	SLC6A1	81	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](CN)[C@H](c3ccccc3)C2)C1	ZINC000872195171	FD	On-Demand	Anodyne	CCR5	44	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](CN)[C@H](c3ccccc3)C2)C1	ZINC000872195172	FD	On-Demand	Anodyne	SLC6A1	81	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](CN)[C@H](c3ccccc3)C2)C1	ZINC000872195172	FD	On-Demand	Anodyne	CCR5	44	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@](C)(CN)C1)CC2	ZINC000872195205	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@](C)(CN)C1)CC2	ZINC000872195206	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@](C)(CN)C1)CC2	ZINC000872195207	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@](C)(CN)C1)CC2	ZINC000872195208	GD	On-Demand	Anodyne	SLC18A2	48	36
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@](C)(CN)C1	ZINC000872195301	GF	On-Demand	Anodyne	MDM2	57	31
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@@](C)(CN)C1	ZINC000872195303	GF	On-Demand	Anodyne	MDM2	57	31
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CC[C@H](N2CCNCC2)C1	ZINC000872195305	GC	On-Demand	Anodyne	SLC18A3	17	40
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CC[C@@H](N2CCNCC2)C1	ZINC000872195311	GC	On-Demand	Anodyne	SLC18A3	17	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@H](N2CCNCC2)C1	ZINC000872195313	GC	On-Demand	Anodyne	SLC18A3	17	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@@H](N2CCNCC2)C1	ZINC000872195316	GC	On-Demand	Anodyne	SLC18A3	17	40
COc1ccc([C@@H]2CCCN2C(=O)C(=O)N(C)CCCCCCN)cc1F	ZINC000872195366	GE	On-Demand	Anodyne	ACKR3	51	32
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2ccccc2)C1	ZINC000872195401	ED	On-Demand	Anodyne	PRSS2	52	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@H]([C@H](C)N)C2)C1	ZINC000872195413	DC	On-Demand	Anodyne	DPP7	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@@H]([C@H](C)N)C2)C1	ZINC000872195414	DC	On-Demand	Anodyne	DPP7	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@H]([C@@H](C)N)C2)C1	ZINC000872195415	DC	On-Demand	Anodyne	DPP7	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@@H]([C@@H](C)N)C2)C1	ZINC000872195416	DC	On-Demand	Anodyne	DPP7	24	40
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195422	ED	On-Demand	Anodyne	OXTR	49	38
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195422	ED	On-Demand	Anodyne	GHRHR	37	40
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195423	ED	On-Demand	Anodyne	OXTR	49	38
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195423	ED	On-Demand	Anodyne	GHRHR	37	40
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195424	ED	On-Demand	Anodyne	OXTR	49	38
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195424	ED	On-Demand	Anodyne	GHRHR	37	40
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195425	ED	On-Demand	Anodyne	OXTR	49	38
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195425	ED	On-Demand	Anodyne	GHRHR	37	40
C[C@H](N)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195435	FD	On-Demand	Anodyne	OXTR	43	39
C[C@H](N)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195435	FD	On-Demand	Anodyne	GHRHR	37	41
C[C@H](N)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195436	FD	On-Demand	Anodyne	OXTR	43	39
C[C@H](N)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195436	FD	On-Demand	Anodyne	GHRHR	37	41
C[C@H](N)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195437	FD	On-Demand	Anodyne	OXTR	43	39
C[C@H](N)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195437	FD	On-Demand	Anodyne	GHRHR	37	41
C[C@H](N)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195438	FD	On-Demand	Anodyne	OXTR	43	39
C[C@H](N)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195438	FD	On-Demand	Anodyne	GHRHR	37	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N(CCCN)Cc2ccccc2)C1	ZINC000872195439	ED	On-Demand	Anodyne	PREP	43	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N(CCCN)Cc2ccccc2)C1	ZINC000872195439	ED	On-Demand	Anodyne	DPP7	48	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N(CCCN)Cc2ccccc2)C1	ZINC000872195440	ED	On-Demand	Anodyne	PREP	43	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N(CCCN)Cc2ccccc2)C1	ZINC000872195440	ED	On-Demand	Anodyne	DPP7	48	43
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CC[C@H]2CC[C@@H](C1)N2	ZINC000872195452	FD	On-Demand	Anodyne	OXTR	40	36
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CC[C@H]2CC[C@@H](C1)N2	ZINC000872195453	FD	On-Demand	Anodyne	OXTR	40	36
NC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872195484	ED	On-Demand	Anodyne	OXTR	51	38
NC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872195484	ED	On-Demand	Anodyne	SLC18A3	16	43
NC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872195485	ED	On-Demand	Anodyne	OXTR	51	38
NC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872195485	ED	On-Demand	Anodyne	SLC18A3	16	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC(CCN)CC1)CC2	ZINC000872195614	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCC(CCN)CC1)CC2	ZINC000872195615	GD	On-Demand	Anodyne	SLC18A2	48	35
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000872195648	ED	On-Demand	Anodyne	PRSS2	52	33
C[C@@H](N)C1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872195728	FD	On-Demand	Anodyne	OXTR	52	39
C[C@@H](N)C1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872195729	FD	On-Demand	Anodyne	OXTR	52	39
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC2(CCN2)CC1	ZINC000872195741	FD	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC2(CCN2)CC1	ZINC000872195742	FD	On-Demand	Anodyne	SLC18A3	15	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC3CC1(CN)C3)CC2	ZINC000872195744	FD	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC3CC1(CN)C3)CC2	ZINC000872195746	FD	On-Demand	Anodyne	SLC18A2	53	40
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195771	GC	On-Demand	Anodyne	OXTR	43	39
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195771	GC	On-Demand	Anodyne	SSTR2	40	40
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195771	GC	On-Demand	Anodyne	GHRHR	45	42
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195775	GC	On-Demand	Anodyne	OXTR	43	39
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195775	GC	On-Demand	Anodyne	SSTR2	40	40
NCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195775	GC	On-Demand	Anodyne	GHRHR	45	42
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195780	GC	On-Demand	Anodyne	OXTR	43	39
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195780	GC	On-Demand	Anodyne	SSTR2	40	40
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872195780	GC	On-Demand	Anodyne	GHRHR	45	42
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195784	GC	On-Demand	Anodyne	OXTR	43	39
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195784	GC	On-Demand	Anodyne	SSTR2	40	40
NCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872195784	GC	On-Demand	Anodyne	GHRHR	45	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CC[C@H](C1)N3)CC2	ZINC000872195796	FD	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H]3CC[C@H](C1)N3)CC2	ZINC000872195798	FD	On-Demand	Anodyne	SLC18A2	49	37
CC(=O)C1CCN(C(=O)C(=O)N2CCNC[C@H]2c2cccnc2)CC1	ZINC000872195807	EC	On-Demand	Anodyne	CHRNA7	17	40
CC(=O)C1CCN(C(=O)C(=O)N2CCNC[C@@H]2c2cccnc2)CC1	ZINC000872195810	EC	On-Demand	Anodyne	CHRNA7	17	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@H](CN)C1)CC2	ZINC000872195819	FC	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CC[C@@H](CN)C1)CC2	ZINC000872195820	FC	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@H](CN)C1)CC2	ZINC000872195822	FC	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CC[C@@H](CN)C1)CC2	ZINC000872195823	FC	On-Demand	Anodyne	SLC18A2	51	37
CN(CCCCCCN)C(=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000872195838	FC	On-Demand	Anodyne	CHRNA4	27	51
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCNCC1	ZINC000872195869	ED	On-Demand	Anodyne	MDM2	64	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CNC[C@@H]3C1)CC2	ZINC000872195877	FC	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H]3CNC[C@@H]3C1)CC2	ZINC000872195878	FC	On-Demand	Anodyne	SLC18A2	50	37
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC(NCC2CC2)CC1	ZINC000872195922	GE	On-Demand	Anodyne	OXTR	49	37
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC(NCC2CC2)CC1	ZINC000872195922	GE	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC(NCC2CC2)CC1	ZINC000872195926	GE	On-Demand	Anodyne	OXTR	49	37
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC(NCC2CC2)CC1	ZINC000872195926	GE	On-Demand	Anodyne	SLC18A3	15	40
CNCC1CCN(C(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)CC1	ZINC000872195933	GD	On-Demand	Anodyne	ACHE	41	41
CNCC1CCN(C(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)CC1	ZINC000872195933	GD	On-Demand	Anodyne	GRIN2B	45	36
CNCC1CCN(C(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)CC1	ZINC000872195933	GD	On-Demand	Anodyne	SIGMAR1	50	39
CC(=O)C1CCN(C(=O)C(=O)N2C[C@@H](N)[C@H](c3cccc(F)c3)C2)CC1	ZINC000872195973	FC	On-Demand	Anodyne	CCR5	90	37
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@H](CN)C1	ZINC000872196033	FE	On-Demand	Anodyne	MDM2	53	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CC[C@@H](CN)C1	ZINC000872196034	FE	On-Demand	Anodyne	MDM2	53	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCCO[C@H](CN)C1)CC2	ZINC000872196098	GC	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCCO[C@@H](CN)C1)CC2	ZINC000872196100	GC	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCCO[C@H](CN)C1)CC2	ZINC000872196102	GC	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCCO[C@@H](CN)C1)CC2	ZINC000872196103	GC	On-Demand	Anodyne	SLC18A2	48	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H]3NCC[C@H]3C2)C1	ZINC000872196104	DC	On-Demand	Anodyne	L3MBTL3	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@H]3NCC[C@@H]3C2)C1	ZINC000872196105	DC	On-Demand	Anodyne	L3MBTL3	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H]3NCC[C@@H]3C2)C1	ZINC000872196106	DC	On-Demand	Anodyne	L3MBTL3	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@H]3NCC[C@H]3C2)C1	ZINC000872196108	DC	On-Demand	Anodyne	L3MBTL3	15	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H]([C@H](C)N)C1)CC2	ZINC000872196142	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H]([C@@H](C)N)C1)CC2	ZINC000872196144	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@@H]([C@H](C)N)C1)CC2	ZINC000872196147	GD	On-Demand	Anodyne	SLC18A2	50	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCC[C@H]([C@@H](C)N)C1)CC2	ZINC000872196148	GD	On-Demand	Anodyne	SLC18A2	50	36
CCN(CCN)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196166	DC	On-Demand	Anodyne	OXTR	41	37
CCN(CCN)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196166	DC	On-Demand	Anodyne	GHRHR	37	42
CCN(CCN)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196166	DC	On-Demand	Anodyne	SLC18A3	15	40
CCN(CCN)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196167	DC	On-Demand	Anodyne	OXTR	41	37
CCN(CCN)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196167	DC	On-Demand	Anodyne	GHRHR	37	42
CCN(CCN)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196167	DC	On-Demand	Anodyne	SLC18A3	15	40
CCN(CCN)C(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1	ZINC000872196317	FC	On-Demand	Anodyne	SIGMAR1	18	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000872196366	FD	On-Demand	Anodyne	HTR7	17	40
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000872196366	FD	On-Demand	Anodyne	SSTR1	39	49
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1C[C@@H]2CNC[C@@H]2C1	ZINC000872196426	EC	On-Demand	Anodyne	OXTR	47	37
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1C[C@@H]2CNC[C@@H]2C1	ZINC000872196426	EC	On-Demand	Anodyne	SLC18A3	16	42
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1C[C@@H]2CNC[C@@H]2C1	ZINC000872196427	EC	On-Demand	Anodyne	OXTR	47	37
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1C[C@@H]2CNC[C@@H]2C1	ZINC000872196427	EC	On-Demand	Anodyne	SLC18A3	16	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)N1CCC(N)CC1	ZINC000872196543	FE	On-Demand	Anodyne	MDM2	61	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H](C)[C@@H](N)C1)CC2	ZINC000872196560	FC	On-Demand	Anodyne	SLC18A2	51	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H](C)[C@H](N)C1)CC2	ZINC000872196562	FC	On-Demand	Anodyne	SLC18A2	51	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H](N)[C@H](C)C1)CC2	ZINC000872196564	FC	On-Demand	Anodyne	SLC18A2	51	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H](C)[C@@H](N)C1)CC2	ZINC000872196567	FC	On-Demand	Anodyne	SLC18A2	51	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCN[C@H](C)C1)CC2	ZINC000872196604	FC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCN[C@H](C)C1)CC2	ZINC000872196606	FC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1CCN[C@@H](C)C1)CC2	ZINC000872196608	FC	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1CCN[C@@H](C)C1)CC2	ZINC000872196610	FC	On-Demand	Anodyne	SLC18A2	49	37
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCN([C@H]2CCNC2)CC1	ZINC000872196612	GC	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCN([C@@H]2CCNC2)CC1	ZINC000872196615	GC	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCN([C@H]2CCNC2)CC1	ZINC000872196617	GC	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCN([C@@H]2CCNC2)CC1	ZINC000872196619	GC	On-Demand	Anodyne	SLC18A3	15	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CC(C)(C)CN)CC2	ZINC000872196630	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CC(C)(C)CN)CC2	ZINC000872196632	GD	On-Demand	Anodyne	SLC18A2	49	36
CCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196659	CD	On-Demand	Anodyne	SIGMAR1	69	43
CCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196659	CD	On-Demand	Anodyne	NPFFR2	33	41
CCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196659	CD	On-Demand	Anodyne	NPFFR1	45	41
CCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196660	CD	On-Demand	Anodyne	SIGMAR1	69	43
CCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196660	CD	On-Demand	Anodyne	NPFFR2	33	41
CCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872196660	CD	On-Demand	Anodyne	NPFFR1	45	41
CN(CCCCCCN)C(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000872196697	GD	On-Demand	Mild	SSTR1	16	40
CN(CCOCCN)C(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196772	EC	On-Demand	Anodyne	GHRHR	20	41
CN(CCOCCN)C(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196773	EC	On-Demand	Anodyne	GHRHR	20	41
CC(=O)C1CCN(C(=O)C(=O)N(CCN)Cc2ccccc2)CC1	ZINC000872196785	EC	On-Demand	Anodyne	SIGMAR1	19	42
CNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872196786	FD	On-Demand	Anodyne	OXTR	57	39
CNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872196786	FD	On-Demand	Anodyne	GHRHR	20	40
CNCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872196786	FD	On-Demand	Anodyne	SLC18A3	15	41
CNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872196788	FD	On-Demand	Anodyne	OXTR	57	39
CNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872196788	FD	On-Demand	Anodyne	GHRHR	20	40
CNCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872196788	FD	On-Demand	Anodyne	SLC18A3	15	41
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)C1	ZINC000872196826	GF	On-Demand	Anodyne	MDM2	101	35
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)C1	ZINC000872196827	GF	On-Demand	Anodyne	MDM2	101	35
C[C@H](N)[C@H]1CCN(C(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)C1	ZINC000872196829	GF	On-Demand	Anodyne	MDM2	101	35
C[C@H](N)[C@@H]1CCN(C(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)C1	ZINC000872196831	GF	On-Demand	Anodyne	MDM2	101	35
NCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872196851	ED	On-Demand	Anodyne	OXTR	52	39
NCC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872196851	ED	On-Demand	Anodyne	SLC18A3	17	41
NCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872196853	ED	On-Demand	Anodyne	OXTR	52	39
NCC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872196853	ED	On-Demand	Anodyne	SLC18A3	17	41
O=C(C(=O)N1CC[C@@H]2CNC[C@@H]21)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196856	EC	On-Demand	Anodyne	OXTR	42	36
O=C(C(=O)N1CC[C@@H]2CNC[C@@H]21)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872196856	EC	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1CC[C@@H]2CNC[C@@H]21)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196857	EC	On-Demand	Anodyne	OXTR	42	36
O=C(C(=O)N1CC[C@@H]2CNC[C@@H]21)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872196857	EC	On-Demand	Anodyne	SLC18A3	15	40
CNCC1CCN(C(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)CC1	ZINC000872196875	GD	On-Demand	Anodyne	SLC18A2	49	36
CNCC1CCN(C(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)CC1	ZINC000872196875	GD	On-Demand	Anodyne	MTNR1B	15	46
CNCC1CCN(C(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)CC1	ZINC000872196877	GD	On-Demand	Anodyne	SLC18A2	49	36
CNCC1CCN(C(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)CC1	ZINC000872196877	GD	On-Demand	Anodyne	MTNR1B	15	46
C[C@H](NC(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1)c1ccccc1	ZINC000872196924	ED	On-Demand	Anodyne	CTSK	33	41
C[C@H](NC(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1)c1ccccc1	ZINC000872196926	ED	On-Demand	Anodyne	CTSK	33	41
C[C@H](NC(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1)c1ccccc1	ZINC000872196927	ED	On-Demand	Anodyne	CTSK	33	41
C[C@H](NC(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000872196930	ED	On-Demand	Anodyne	CTSK	33	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@H](N3CCNCC3)C2)C1	ZINC000872196932	EB	On-Demand	Anodyne	L3MBTL3	57	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@H](N3CCNCC3)C2)C1	ZINC000872196934	EB	On-Demand	Anodyne	L3MBTL3	57	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@H](N3CCNCC3)C2)C1	ZINC000872196936	EB	On-Demand	Anodyne	L3MBTL3	57	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)N2CC[C@@H](N3CCNCC3)C2)C1	ZINC000872196937	EB	On-Demand	Anodyne	L3MBTL3	57	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H](C)[C@@H](CN)C1)CC2	ZINC000872196939	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H](C)[C@H](CN)C1)CC2	ZINC000872196941	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H](C)[C@H](CN)C1)CC2	ZINC000872196943	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@H](CN)[C@@H](C)C1)CC2	ZINC000872196945	GD	On-Demand	Anodyne	SLC18A2	53	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CCOCCN)CC2	ZINC000872196952	GC	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CCOCCN)CC2	ZINC000872196953	GC	On-Demand	Anodyne	SLC18A2	48	36
CCN(CCN)C(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000872196967	EC	On-Demand	Anodyne	SLC18A2	49	37
CCN(CCN)C(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000872196968	EC	On-Demand	Anodyne	SLC18A2	49	37
C[C@@]12CNC[C@]1(C)CN(C(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)C2	ZINC000872197041	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@]12CNC[C@]1(C)CN(C(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)C2	ZINC000872197041	FD	On-Demand	Anodyne	SLC18A3	15	40
C[C@@]12CNC[C@]1(C)CN(C(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)C2	ZINC000872197042	FD	On-Demand	Anodyne	OXTR	52	38
C[C@@]12CNC[C@]1(C)CN(C(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)C2	ZINC000872197042	FD	On-Demand	Anodyne	SLC18A3	15	40
C[C@H](NC(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1)c1ccccc1	ZINC000872197089	DC	On-Demand	Anodyne	CTSK	29	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N1C[C@@H]3CNC[C@]3(C)C1)CC2	ZINC000872197090	GD	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N1C[C@@H]3CNC[C@]3(C)C1)CC2	ZINC000872197091	GD	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CC[C@H](N)C(C)C)CC2	ZINC000872197104	GD	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N(C)CC[C@@H](N)C(C)C)CC2	ZINC000872197105	GD	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CC[C@@H](N)C(C)C)CC2	ZINC000872197106	GD	On-Demand	Anodyne	SLC18A2	53	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N(C)CC[C@H](N)C(C)C)CC2	ZINC000872197107	GD	On-Demand	Anodyne	SLC18A2	53	40
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@@H]([C@@H]2CCNC2)C1	ZINC000872197123	GD	On-Demand	Anodyne	OXTR	46	39
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@H]([C@@H]2CCNC2)C1	ZINC000872197124	GD	On-Demand	Anodyne	OXTR	46	39
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@H]([C@H]2CCNC2)C1	ZINC000872197125	GD	On-Demand	Anodyne	OXTR	46	39
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC[C@@H]([C@H]2CCNC2)C1	ZINC000872197126	GD	On-Demand	Anodyne	OXTR	46	39
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H]1C(F)(F)F	ZINC000872197127	GD	On-Demand	Anodyne	GHRHR	53	43
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@H]1C(F)(F)F	ZINC000872197251	GD	On-Demand	Anodyne	GHRHR	53	43
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@H]1C(F)(F)F	ZINC000872197252	GD	On-Demand	Anodyne	GHRHR	53	43
NC[C@@H]1CN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H]1C(F)(F)F	ZINC000872197253	GD	On-Demand	Anodyne	GHRHR	53	43
O=C(C(=O)N1[C@H]2CC[C@H]1CNC2)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872197326	ED	On-Demand	Anodyne	OXTR	44	36
O=C(C(=O)N1[C@H]2CC[C@H]1CNC2)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872197326	ED	On-Demand	Anodyne	SLC18A3	15	40
O=C(C(=O)N1[C@H]2CC[C@H]1CNC2)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872197327	ED	On-Demand	Anodyne	OXTR	44	36
O=C(C(=O)N1[C@H]2CC[C@H]1CNC2)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872197327	ED	On-Demand	Anodyne	SLC18A3	15	40
C[C@@](O)(C[C@H](O)CNCc1ccc2ccccc2c1)C1CC1	ZINC000872197464	CF	On-Demand	Anodyne	CASR	40	42
C[C@@](O)(C[C@@H](O)CNCc1ccc2ccccc2c1)C1CC1	ZINC000872197465	CF	On-Demand	Anodyne	CASR	40	42
CCCOc1ccc([C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872197502	CF	On-Demand	Anodyne	ACACA	15	45
CCCOc1ccc([C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872197502	CF	On-Demand	Anodyne	ACACB	17	45
CCCOc1ccc([C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872197503	CF	On-Demand	Anodyne	ACACA	15	45
CCCOc1ccc([C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872197503	CF	On-Demand	Anodyne	ACACB	17	45
CCCOc1ccc([C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872197505	CF	On-Demand	Anodyne	ACACA	15	45
CCCOc1ccc([C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872197505	CF	On-Demand	Anodyne	ACACB	17	45
CCCOc1ccc([C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872197508	CF	On-Demand	Anodyne	ACACA	15	45
CCCOc1ccc([C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872197508	CF	On-Demand	Anodyne	ACACB	17	45
CC(=O)C1CCN(C(=O)C(=O)N2CCC([C@@H]3CCCN3)CC2)CC1	ZINC000872197800	EC	On-Demand	Anodyne	L3MBTL3	15	55
CC(=O)C1CCN(C(=O)C(=O)N2CCC([C@H]3CCCN3)CC2)CC1	ZINC000872197801	EC	On-Demand	Anodyne	L3MBTL3	15	55
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCCN2)CC1	ZINC000872198191	GE	On-Demand	Anodyne	OXTR	43	36
Cc1cc(F)ccc1C1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872198193	GF	On-Demand	Anodyne	TACR1	29	43
Cc1cc(F)ccc1C1CCN(C(=O)C(=O)N(C)CCCCCCN)CC1	ZINC000872198193	GF	On-Demand	Anodyne	PRCP	47	36
O=C(C(=O)N1CC[C@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCCN2)CC1	ZINC000872198195	GE	On-Demand	Anodyne	OXTR	43	36
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@H]2CCCN2)CC1	ZINC000872198197	GE	On-Demand	Anodyne	OXTR	43	36
O=C(C(=O)N1CC[C@@]2(CCc3ccccc32)C1)N1CCC([C@@H]2CCCN2)CC1	ZINC000872198201	GE	On-Demand	Anodyne	OXTR	43	36
CCOc1ccccc1[C@@H](C)NC[C@H](O)CC(C)(C)O	ZINC000872198290	CE	On-Demand	Anodyne	ADRB2	22	43
CCOc1ccccc1[C@@H](C)NC[C@@H](O)CC(C)(C)O	ZINC000872198291	CE	On-Demand	Anodyne	ADRB2	22	43
CCOc1ccccc1[C@H](C)NC[C@H](O)CC(C)(C)O	ZINC000872198293	CE	On-Demand	Anodyne	ADRB2	22	43
CCOc1ccccc1[C@H](C)NC[C@@H](O)CC(C)(C)O	ZINC000872198294	CE	On-Demand	Anodyne	ADRB2	22	43
O=C(CNC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198325	GE	On-Demand	Anodyne	SIGMAR1	32	44
O=C(CNC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198325	GE	On-Demand	Anodyne	NPFFR2	41	42
O=C(CNC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198325	GE	On-Demand	Anodyne	MCHR1	24	43
O=C(CNC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198325	GE	On-Demand	Anodyne	NPFFR1	51	42
O=C(CNC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198330	GE	On-Demand	Anodyne	SIGMAR1	32	44
O=C(CNC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198330	GE	On-Demand	Anodyne	NPFFR2	41	42
O=C(CNC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198330	GE	On-Demand	Anodyne	MCHR1	24	43
O=C(CNC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(F)c(F)c1	ZINC000872198330	GE	On-Demand	Anodyne	NPFFR1	51	42
N[C@@H]1CCC[C@@H]2CN(C(=O)C(=O)N3CC[C@@]4(CCc5ccccc54)C3)C[C@@H]21	ZINC000872198347	FD	On-Demand	Anodyne	OXTR	51	38
N[C@@H]1CCC[C@@H]2CN(C(=O)C(=O)N3CC[C@]4(CCc5ccccc54)C3)C[C@H]21	ZINC000872198352	FD	On-Demand	Anodyne	OXTR	51	38
N[C@@H]1CCC[C@@H]2CN(C(=O)C(=O)N3CC[C@@]4(CCc5ccccc54)C3)C[C@H]21	ZINC000872198355	FD	On-Demand	Anodyne	OXTR	51	38
N[C@@H]1CCC[C@@H]2CN(C(=O)C(=O)N3CC[C@]4(CCc5ccccc54)C3)C[C@@H]21	ZINC000872198361	FD	On-Demand	Anodyne	OXTR	51	38
COc1cccc([C@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872198367	CD	On-Demand	Anodyne	ADRB2	16	43
COc1cccc([C@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872198367	CD	On-Demand	Anodyne	CASR	20	53
COc1cccc([C@@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872198368	CD	On-Demand	Anodyne	ADRB2	16	43
COc1cccc([C@@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872198368	CD	On-Demand	Anodyne	CASR	20	53
COc1cccc([C@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872198369	CD	On-Demand	Anodyne	ADRB2	16	43
COc1cccc([C@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872198369	CD	On-Demand	Anodyne	CASR	20	53
COc1cccc([C@@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872198370	CD	On-Demand	Anodyne	ADRB2	16	43
COc1cccc([C@@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872198370	CD	On-Demand	Anodyne	CASR	20	53
N[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872198371	ED	On-Demand	Anodyne	OXTR	40	36
N[C@@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872198371	ED	On-Demand	Anodyne	SLC18A3	16	40
COCCOc1ccc(CNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198374	CD	On-Demand	Anodyne	ADRB2	19	42
COCCOc1ccc(CNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198374	CD	On-Demand	Anodyne	ADRB1	32	42
COCCOc1ccc(CNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198375	CD	On-Demand	Anodyne	ADRB2	19	42
COCCOc1ccc(CNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198375	CD	On-Demand	Anodyne	ADRB1	32	42
N[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872198377	ED	On-Demand	Anodyne	OXTR	40	36
N[C@@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872198377	ED	On-Demand	Anodyne	SLC18A3	16	40
N[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872198381	ED	On-Demand	Anodyne	OXTR	40	36
N[C@H]1CCCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872198381	ED	On-Demand	Anodyne	SLC18A3	16	40
N[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872198382	ED	On-Demand	Anodyne	OXTR	40	36
N[C@H]1CCCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872198382	ED	On-Demand	Anodyne	SLC18A3	16	40
COCCNC1CCN(C(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000872198393	EC	On-Demand	Anodyne	DPP7	16	40
COCCNC1CCN(C(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000872198394	EC	On-Demand	Anodyne	DPP7	16	40
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2)C1	ZINC000872198416	GE	On-Demand	Anodyne	PRSS2	57	32
CN(CCCCCCN)C(=O)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2)C1	ZINC000872198416	GE	On-Demand	Anodyne	LSS	21	41
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccc(Cl)cc2)C1	ZINC000872198417	GE	On-Demand	Anodyne	PRSS2	57	32
CN(CCCCCCN)C(=O)C(=O)N1CC[C@@H](Oc2ccc(Cl)cc2)C1	ZINC000872198417	GE	On-Demand	Anodyne	LSS	21	41
C[C@H](NC[C@H](O)CC(C)(C)O)c1cccnc1	ZINC000872198465	BD	On-Demand	Anodyne	ADRB3	21	41
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1cccnc1	ZINC000872198467	BD	On-Demand	Anodyne	ADRB3	21	41
O=C1CCCN1c1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872198486	GF	On-Demand	Anodyne	NPFFR1	40	39
O=C1CCCN1c1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872198487	GF	On-Demand	Anodyne	NPFFR1	40	39
COCCNC1CCN(C(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000872198553	GD	On-Demand	Anodyne	OXTR	50	36
COCCNC1CCN(C(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000872198554	GD	On-Demand	Anodyne	OXTR	50	36
O[C@]1(CNC[C@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198560	EE	On-Demand	Anodyne	SIGMAR1	57	38
O[C@]1(CNC[C@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198560	EE	On-Demand	Anodyne	NPFFR1	42	37
O[C@]1(CNC[C@@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198561	EE	On-Demand	Anodyne	SIGMAR1	57	38
O[C@]1(CNC[C@@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198561	EE	On-Demand	Anodyne	NPFFR1	42	37
O[C@@]1(CNC[C@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198562	EE	On-Demand	Anodyne	SIGMAR1	57	38
O[C@@]1(CNC[C@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198562	EE	On-Demand	Anodyne	NPFFR1	42	37
O[C@@]1(CNC[C@@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198563	EE	On-Demand	Anodyne	SIGMAR1	57	38
O[C@@]1(CNC[C@@H]2CC2(Cl)Cl)CCN(Cc2ccccc2)C1	ZINC000872198563	EE	On-Demand	Anodyne	NPFFR1	42	37
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@@](CO)(Cc2ccccc2)C1	ZINC000872198585	GD	On-Demand	Anodyne	SLC12A5	47	34
CN(CCCCCCN)C(=O)C(=O)N1CCC[C@](CO)(Cc2ccccc2)C1	ZINC000872198588	GD	On-Demand	Anodyne	SLC12A5	47	34
COC(=O)c1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198595	CD	On-Demand	Anodyne	ADRB2	50	51
COC(=O)c1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198595	CD	On-Demand	Anodyne	ADRB1	70	51
COC(=O)c1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198595	CD	On-Demand	Anodyne	ADRB3	73	51
COC(=O)c1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198597	CD	On-Demand	Anodyne	ADRB2	50	51
COC(=O)c1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198597	CD	On-Demand	Anodyne	ADRB1	70	51
COC(=O)c1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198597	CD	On-Demand	Anodyne	ADRB3	73	51
CC(=O)Nc1ccc(CNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872198603	CD	On-Demand	Anodyne	ADRB1	17	44
CC(=O)Nc1ccc(CNC[C@H](O)CC(C)(C)O)cc1	ZINC000872198605	CD	On-Demand	Anodyne	ADRB1	17	44
C[C@@](O)(C[C@@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198613	CD	On-Demand	Anodyne	ADRB2	21	40
C[C@@](O)(C[C@@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198613	CD	On-Demand	Anodyne	ADRB1	28	40
C[C@@](O)(C[C@@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198613	CD	On-Demand	Anodyne	ADRB3	70	41
C[C@@](O)(C[C@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198614	CD	On-Demand	Anodyne	ADRB2	21	40
C[C@@](O)(C[C@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198614	CD	On-Demand	Anodyne	ADRB1	28	40
C[C@@](O)(C[C@H](O)CNCCc1cccnc1)C1CC1	ZINC000872198614	CD	On-Demand	Anodyne	ADRB3	70	41
CCONC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872198639	CE	On-Demand	Anodyne	ADRB2	18	44
CCONC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872198639	CE	On-Demand	Anodyne	PDS	15	40
CCONC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872198640	CE	On-Demand	Anodyne	ADRB2	18	44
CCONC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872198640	CE	On-Demand	Anodyne	PDS	15	40
O[C@@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198651	EF	On-Demand	Anodyne	ADRB2	71	57
O[C@@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198651	EF	On-Demand	Anodyne	ADRB1	110	57
O[C@@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198651	EF	On-Demand	Anodyne	GRIN1	20	49
O[C@@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198651	EF	On-Demand	Anodyne	ADRB3	123	57
O[C@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198652	EF	On-Demand	Anodyne	ADRB2	71	57
O[C@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198652	EF	On-Demand	Anodyne	ADRB1	110	57
O[C@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198652	EF	On-Demand	Anodyne	GRIN1	20	49
O[C@H](CNCCc1cccnc1)COc1cc(Cl)cc(Cl)c1	ZINC000872198652	EF	On-Demand	Anodyne	ADRB3	123	57
O[C@]1(CNOCc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000872198682	DE	On-Demand	Anodyne	SIGMAR1	67	43
O[C@]1(CNOCc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000872198682	DE	On-Demand	Anodyne	NPFFR1	46	40
O[C@@]1(CNOCc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000872198683	DE	On-Demand	Anodyne	SIGMAR1	67	43
O[C@@]1(CNOCc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000872198683	DE	On-Demand	Anodyne	NPFFR1	46	40
C[C@@](O)(C[C@H](O)CNCc1ccc(-n2ccnc2)nc1)C1CC1	ZINC000872198746	DD	On-Demand	Anodyne	NOS2	44	32
C[C@@](O)(C[C@@H](O)CNCc1ccc(-n2ccnc2)nc1)C1CC1	ZINC000872198747	DD	On-Demand	Anodyne	NOS2	44	32
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccccc1OCc1ccccc1	ZINC000872198800	EG	On-Demand	Anodyne	ADRB2	19	41
Cc1ccc(OC[C@H](C)NC[C@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872198963	DE	On-Demand	Anodyne	ADRB2	18	52
Cc1ccc(OC[C@H](C)NC[C@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872198963	DE	On-Demand	Anodyne	ADRB1	26	44
Cc1ccc(OC[C@H](C)NC[C@@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872198967	DE	On-Demand	Anodyne	ADRB2	18	52
Cc1ccc(OC[C@H](C)NC[C@@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872198967	DE	On-Demand	Anodyne	ADRB1	26	44
Cc1ccc(OC[C@H](C)NC[C@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872198969	DE	On-Demand	Anodyne	ADRB2	18	52
Cc1ccc(OC[C@H](C)NC[C@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872198969	DE	On-Demand	Anodyne	ADRB1	26	44
Cc1ccc(OC[C@H](C)NC[C@@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872198971	DE	On-Demand	Anodyne	ADRB2	18	52
Cc1ccc(OC[C@H](C)NC[C@@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872198971	DE	On-Demand	Anodyne	ADRB1	26	44
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872198976	GD	On-Demand	Anodyne	SIGMAR1	42	40
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872198976	GD	On-Demand	Anodyne	NPFFR1	45	40
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872198978	GD	On-Demand	Anodyne	SIGMAR1	42	40
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872198978	GD	On-Demand	Anodyne	NPFFR1	45	40
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	HTR1A	55	50
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	DRD4	23	43
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	ADRA1D	44	39
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	DRD3	41	43
COc1ccccc1N1CC[C@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198993	DD	On-Demand	Anodyne	HTR7	38	43
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	HTR1A	55	50
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	DRD4	23	43
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	ADRA1D	44	39
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	DRD3	41	43
COc1ccccc1N1CC[C@@H](CNC[C@@H](O)CC(C)(C)O)C1	ZINC000872198995	DD	On-Demand	Anodyne	HTR7	38	43
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	HTR1A	55	50
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	DRD4	23	43
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	ADRA1D	44	39
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	DRD3	41	43
COc1ccccc1N1CC[C@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872198997	DD	On-Demand	Anodyne	HTR7	38	43
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	HTR1A	55	50
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	DRD2	40	50
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	DRD4	23	43
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	ADRA1D	44	39
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	DRD3	41	43
COc1ccccc1N1CC[C@@H](CNC[C@H](O)CC(C)(C)O)C1	ZINC000872199000	DD	On-Demand	Anodyne	HTR7	38	43
Cc1ccc(OC[C@@H](C)NC[C@@H](O)CC2(O)CCOCC2)cc1	ZINC000872199163	DD	On-Demand	Anodyne	ADRB2	15	51
Cc1ccc(OC[C@@H](C)NC[C@@H](O)CC2(O)CCOCC2)cc1	ZINC000872199163	DD	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(OC[C@H](C)NC[C@@H](O)CC2(O)CCOCC2)cc1	ZINC000872199167	DD	On-Demand	Anodyne	ADRB2	15	51
Cc1ccc(OC[C@H](C)NC[C@@H](O)CC2(O)CCOCC2)cc1	ZINC000872199167	DD	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(OC[C@@H](C)NC[C@H](O)CC2(O)CCOCC2)cc1	ZINC000872199170	DD	On-Demand	Anodyne	ADRB2	15	51
Cc1ccc(OC[C@@H](C)NC[C@H](O)CC2(O)CCOCC2)cc1	ZINC000872199170	DD	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(OC[C@H](C)NC[C@H](O)CC2(O)CCOCC2)cc1	ZINC000872199172	DD	On-Demand	Anodyne	ADRB2	15	51
Cc1ccc(OC[C@H](C)NC[C@H](O)CC2(O)CCOCC2)cc1	ZINC000872199172	DD	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(OC[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199185	CD	On-Demand	Anodyne	ADRB2	29	60
Cc1ccc(OC[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199185	CD	On-Demand	Anodyne	ADRB1	25	47
Cc1ccc(OC[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199186	CD	On-Demand	Anodyne	ADRB2	29	60
Cc1ccc(OC[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199186	CD	On-Demand	Anodyne	ADRB1	25	47
Cc1ccc(OC[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199189	CD	On-Demand	Anodyne	ADRB2	29	60
Cc1ccc(OC[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199189	CD	On-Demand	Anodyne	ADRB1	25	47
Cc1ccc(OC[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199192	CD	On-Demand	Anodyne	ADRB2	29	60
Cc1ccc(OC[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199192	CD	On-Demand	Anodyne	ADRB1	25	47
CNS(=O)(=O)c1cccc([C@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872199218	EC	On-Demand	Anodyne	MTNN	41	29
CNS(=O)(=O)c1cccc([C@@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872199222	EC	On-Demand	Anodyne	MTNN	41	29
CNS(=O)(=O)c1cccc([C@H](C)NC[C@H](O)CC(C)(C)O)c1	ZINC000872199228	EC	On-Demand	Anodyne	MTNN	41	29
CNS(=O)(=O)c1cccc([C@@H](C)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872199229	EC	On-Demand	Anodyne	MTNN	41	29
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRB2	17	45
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRB1	16	45
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	HTR1A	81	44
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	DRD2	63	44
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRA1D	82	41
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRA1A	71	41
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRA1B	61	41
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	ADRB3	17	43
COc1ccccc1N1CCC(NC[C@@H](O)CC(C)(C)O)CC1	ZINC000872199498	DD	On-Demand	Anodyne	HTR7	49	41
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRB2	17	45
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRB1	16	45
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	HTR1A	81	44
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	DRD2	63	44
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRA1D	82	41
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRA1A	71	41
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRA1B	61	41
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	ADRB3	17	43
COc1ccccc1N1CCC(NC[C@H](O)CC(C)(C)O)CC1	ZINC000872199501	DD	On-Demand	Anodyne	HTR7	49	41
COc1ccc(OCCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872199542	CD	On-Demand	Anodyne	ADRB2	31	51
COc1ccc(OCCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872199542	CD	On-Demand	Anodyne	ADRB1	41	51
COc1ccc(OCCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872199542	CD	On-Demand	Anodyne	ADRB3	25	51
COc1ccc(OCCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199545	CD	On-Demand	Anodyne	ADRB2	31	51
COc1ccc(OCCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199545	CD	On-Demand	Anodyne	ADRB1	41	51
COc1ccc(OCCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199545	CD	On-Demand	Anodyne	ADRB3	25	51
CC[C@H](C(=O)N1CCC(NC[C@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199576	FE	On-Demand	Anodyne	CCR8	50	42
CC[C@H](C(=O)N1CCC(NC[C@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199576	FE	On-Demand	Anodyne	SFRP1	50	33
CC[C@H](C(=O)N1CCC(NC[C@@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199578	FE	On-Demand	Anodyne	CCR8	50	42
CC[C@H](C(=O)N1CCC(NC[C@@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199578	FE	On-Demand	Anodyne	SFRP1	50	33
CC[C@@H](C(=O)N1CCC(NC[C@@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199581	FE	On-Demand	Anodyne	CCR8	50	42
CC[C@@H](C(=O)N1CCC(NC[C@@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199581	FE	On-Demand	Anodyne	SFRP1	50	33
CC[C@@H](C(=O)N1CCC(NC[C@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199584	FE	On-Demand	Anodyne	CCR8	50	42
CC[C@@H](C(=O)N1CCC(NC[C@H](O)CC(C)(C)O)CC1)c1ccccc1	ZINC000872199584	FE	On-Demand	Anodyne	SFRP1	50	33
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)CC(C)(C)O)CC2	ZINC000872199668	GD	On-Demand	Anodyne	ABCB1	15	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	ADRB2	29	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	ADRB1	57	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	ADRB3	36	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	DRTS_LEIMA	16	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	MTNR1A	25	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199697	DD	On-Demand	Anodyne	MTNR1B	23	43
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	ADRB2	29	42
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	ADRB1	57	43
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	ADRB3	36	43
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	DRTS_LEIMA	16	41
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	MTNR1A	25	43
CC(=O)Nc1cccc(OCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872199698	DD	On-Demand	Anodyne	MTNR1B	23	43
CCCNC(=O)c1cccc(CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199731	DD	On-Demand	Anodyne	CCR2	16	41
CCCNC(=O)c1cccc(CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872199731	DD	On-Demand	Anodyne	BACE1	20	42
CCCNC(=O)c1cccc(CNC[C@H](O)CC(C)(C)O)c1	ZINC000872199733	DD	On-Demand	Anodyne	CCR2	16	41
CCCNC(=O)c1cccc(CNC[C@H](O)CC(C)(C)O)c1	ZINC000872199733	DD	On-Demand	Anodyne	BACE1	20	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199766	FD	On-Demand	Anodyne	ADRB2	38	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199766	FD	On-Demand	Anodyne	ADRB1	50	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199766	FD	On-Demand	Anodyne	GRIN1	19	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199766	FD	On-Demand	Anodyne	ADRB3	33	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199785	FD	On-Demand	Anodyne	ADRB2	38	47
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199785	FD	On-Demand	Anodyne	ADRB1	50	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199785	FD	On-Demand	Anodyne	GRIN1	19	46
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872199785	FD	On-Demand	Anodyne	ADRB3	33	43
COc1ccc(CC[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199814	CE	On-Demand	Anodyne	ADRB2	29	63
COc1ccc(CC[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199814	CE	On-Demand	Anodyne	ADRB1	23	63
COc1ccc(CC[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199816	CE	On-Demand	Anodyne	ADRB2	29	63
COc1ccc(CC[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199816	CE	On-Demand	Anodyne	ADRB1	23	63
COc1ccc(CC[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199818	CE	On-Demand	Anodyne	ADRB2	29	63
COc1ccc(CC[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872199818	CE	On-Demand	Anodyne	ADRB1	23	63
COc1ccc(CC[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199821	CE	On-Demand	Anodyne	ADRB2	29	63
COc1ccc(CC[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199821	CE	On-Demand	Anodyne	ADRB1	23	63
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA2	16	42
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA1	17	42
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA5B	42	36
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA5A	48	36
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA12	20	42
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(CC(=O)OC)cc2)c1	ZINC000872199896	JE	On-Demand	Anodyne	CA9	36	42
CN(C)CCOc1ccc(CNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872199900	DD	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(CNC[C@H](O)CC(C)(C)O)cc1	ZINC000872199902	DD	On-Demand	Anodyne	ESRRG	45	33
O[C@H](CNCCn1cncn1)COc1cc(Cl)cc(Cl)c1	ZINC000872200022	ED	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNCCn1cncn1)COc1cc(Cl)cc(Cl)c1	ZINC000872200024	ED	On-Demand	Anodyne	ADRB2	24	42
O[C@H](CNCc1ccc(-n2ccnc2)cc1)CC1(O)CCOCC1	ZINC000872200032	ED	On-Demand	Anodyne	NOS2	43	31
O[C@@H](CNCc1ccc(-n2ccnc2)cc1)CC1(O)CCOCC1	ZINC000872200033	ED	On-Demand	Anodyne	NOS2	43	31
CCOc1ccccc1CNC[C@H](O)CC(C)(C)O	ZINC000872200112	CD	On-Demand	Anodyne	ADRB2	17	40
CCOc1ccccc1CNC[C@@H](O)CC(C)(C)O	ZINC000872200113	CD	On-Demand	Anodyne	ADRB2	17	40
CCN(CC)C(=O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872200128	EE	On-Demand	Anodyne	ADRB2	29	52
CCN(CC)C(=O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872200128	EE	On-Demand	Anodyne	PDS	36	40
CCN(CC)C(=O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872200129	EE	On-Demand	Anodyne	ADRB2	29	52
CCN(CC)C(=O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872200129	EE	On-Demand	Anodyne	PDS	36	40
O[C@@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200144	EF	On-Demand	Anodyne	ADRB2	59	55
O[C@@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200144	EF	On-Demand	Anodyne	ADRB1	98	55
O[C@@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200144	EF	On-Demand	Anodyne	GRIN1	22	51
O[C@@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200144	EF	On-Demand	Anodyne	ADRB3	77	55
O[C@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200145	EF	On-Demand	Anodyne	ADRB2	59	55
O[C@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200145	EF	On-Demand	Anodyne	ADRB1	98	55
O[C@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200145	EF	On-Demand	Anodyne	GRIN1	22	51
O[C@H](CNCCc1ccncc1)COc1cc(Cl)cc(Cl)c1	ZINC000872200145	EF	On-Demand	Anodyne	ADRB3	77	55
COc1ccc(N2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872200281	DD	On-Demand	Clean	ADRB2	18	42
COc1ccc(N2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872200281	DD	On-Demand	Clean	ADRB3	25	45
COc1ccc(N2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872200284	DD	On-Demand	Clean	ADRB2	18	42
COc1ccc(N2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872200284	DD	On-Demand	Clean	ADRB3	25	45
CCOc1ccccc1CCNC[C@@H](O)CC(C)(C)O	ZINC000872200307	CD	On-Demand	Anodyne	ADRB2	30	43
CCOc1ccccc1CCNC[C@H](O)CC(C)(C)O	ZINC000872200310	CD	On-Demand	Anodyne	ADRB2	30	43
CCc1noc(-c2ccc(CCNC[C@@H](O)CC(C)(C)O)cc2)n1	ZINC000872200351	ED	On-Demand	Anodyne	ADRB3	45	41
CCc1noc(-c2ccc(CCNC[C@H](O)CC(C)(C)O)cc2)n1	ZINC000872200360	ED	On-Demand	Anodyne	ADRB3	45	41
CC(C)(C)OC(=O)N1CCC(CNC[C@H](O)C[C@](C)(O)C2CC2)CC1	ZINC000872200384	FE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC(CNC[C@@H](O)C[C@](C)(O)C2CC2)CC1	ZINC000872200386	FE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC(CNC[C@@H](O)C[C@@](C)(O)C2CC2)CC1	ZINC000872200388	FE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC(CNC[C@H](O)C[C@@](C)(O)C2CC2)CC1	ZINC000872200390	FE	On-Demand	Anodyne	GPR119	34	41
COC(=O)N1CCC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200395	ED	On-Demand	Anodyne	DRD4	28	41
COC(=O)N1CCC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200395	ED	On-Demand	Anodyne	SIGMAR1	53	43
COC(=O)N1CCC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200395	ED	On-Demand	Anodyne	NPFFR1	46	41
COC(=O)N1CCC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200397	ED	On-Demand	Anodyne	DRD4	28	41
COC(=O)N1CCC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200397	ED	On-Demand	Anodyne	SIGMAR1	53	43
COC(=O)N1CCC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200397	ED	On-Demand	Anodyne	NPFFR1	46	41
COC(=O)N1CCC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200399	ED	On-Demand	Anodyne	DRD4	28	41
COC(=O)N1CCC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200399	ED	On-Demand	Anodyne	SIGMAR1	53	43
COC(=O)N1CCC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200399	ED	On-Demand	Anodyne	NPFFR1	46	41
COC(=O)N1CCC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200402	ED	On-Demand	Anodyne	DRD4	28	41
COC(=O)N1CCC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200402	ED	On-Demand	Anodyne	SIGMAR1	53	43
COC(=O)N1CCC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872200402	ED	On-Demand	Anodyne	NPFFR1	46	41
COc1ccc(N2CCC(NC[C@@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872200476	EE	On-Demand	Clean	ADRB2	15	40
COc1ccc(N2CCC(NC[C@@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872200476	EE	On-Demand	Clean	ADRB3	23	45
COc1ccc(N2CCC(NC[C@@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872200479	EE	On-Demand	Clean	ADRB2	15	40
COc1ccc(N2CCC(NC[C@@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872200479	EE	On-Demand	Clean	ADRB3	23	45
COc1ccc(N2CCC(NC[C@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872200483	EE	On-Demand	Clean	ADRB2	15	40
COc1ccc(N2CCC(NC[C@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872200483	EE	On-Demand	Clean	ADRB3	23	45
COc1ccc(N2CCC(NC[C@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872200485	EE	On-Demand	Clean	ADRB2	15	40
COc1ccc(N2CCC(NC[C@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872200485	EE	On-Demand	Clean	ADRB3	23	45
CC(=O)N1CCN(c2ccccc2CNC[C@@H](O)CC(C)(C)O)CC1	ZINC000872200600	EC	On-Demand	Anodyne	MC4R	40	45
CC(=O)N1CCN(c2ccccc2CNC[C@@H](O)CC(C)(C)O)CC1	ZINC000872200600	EC	On-Demand	Anodyne	KCNQ2	52	33
CC(=O)N1CCN(c2ccccc2CNC[C@H](O)CC(C)(C)O)CC1	ZINC000872200601	EC	On-Demand	Anodyne	MC4R	40	45
CC(=O)N1CCN(c2ccccc2CNC[C@H](O)CC(C)(C)O)CC1	ZINC000872200601	EC	On-Demand	Anodyne	KCNQ2	52	33
COc1ccc(N2CCC(NC[C@H](O)CC3(O)CCOCC3)CC2)cc1	ZINC000872200622	FD	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@H](O)CC3(O)CCOCC3)CC2)cc1	ZINC000872200622	FD	On-Demand	Clean	ADRB3	24	44
COc1ccc(N2CCC(NC[C@@H](O)CC3(O)CCOCC3)CC2)cc1	ZINC000872200623	FD	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@@H](O)CC3(O)CCOCC3)CC2)cc1	ZINC000872200623	FD	On-Demand	Clean	ADRB3	24	44
C[C@@](O)(C[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000872200630	GF	On-Demand	Clean	ADRB3	20	41
C[C@@](O)(C[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000872200633	GF	On-Demand	Clean	ADRB3	20	41
CCOc1ccccc1[C@@H](CC)NC[C@@H](O)CC(C)(C)O	ZINC000872200826	CF	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@H](CC)NC[C@H](O)CC(C)(C)O	ZINC000872200827	CF	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@@H](CC)NC[C@H](O)CC(C)(C)O	ZINC000872200828	CF	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@H](CC)NC[C@@H](O)CC(C)(C)O	ZINC000872200829	CF	On-Demand	Anodyne	ADRB2	15	40
CC[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccccc1OCC(=O)N1CCCC1	ZINC000872200897	GE	On-Demand	Anodyne	HCN1	46	31
CC[C@@H](NC[C@H](O)CC(C)(C)O)c1ccccc1OCC(=O)N1CCCC1	ZINC000872200898	GE	On-Demand	Anodyne	HCN1	46	31
O=[S@](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201004	FE	On-Demand	Anodyne	NPFFR2	35	41
O=[S@](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201004	FE	On-Demand	Anodyne	NPFFR1	49	42
O=[S@@](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201005	FE	On-Demand	Anodyne	NPFFR2	35	41
O=[S@@](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201005	FE	On-Demand	Anodyne	NPFFR1	49	42
O=[S@](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201006	FE	On-Demand	Anodyne	NPFFR2	35	41
O=[S@](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201006	FE	On-Demand	Anodyne	NPFFR1	49	42
O=[S@@](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201007	FE	On-Demand	Anodyne	NPFFR2	35	41
O=[S@@](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)Cc1ccccc1	ZINC000872201007	FE	On-Demand	Anodyne	NPFFR1	49	42
C[S@@](=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201068	ED	On-Demand	Anodyne	ADRB2	39	48
C[S@@](=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201068	ED	On-Demand	Anodyne	ADRB1	54	39
C[S@@](=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201072	ED	On-Demand	Anodyne	ADRB2	39	48
C[S@@](=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201072	ED	On-Demand	Anodyne	ADRB1	54	39
C[S@](=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201074	ED	On-Demand	Anodyne	ADRB2	39	48
C[S@](=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201074	ED	On-Demand	Anodyne	ADRB1	54	39
C[S@](=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201076	ED	On-Demand	Anodyne	ADRB2	39	48
C[S@](=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872201076	ED	On-Demand	Anodyne	ADRB1	54	39
CCNS(=O)(=O)CCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872201166	EC	On-Demand	Anodyne	NPFFR1	43	38
CCNS(=O)(=O)CCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872201167	EC	On-Demand	Anodyne	NPFFR1	43	38
Cc1cccc(NC(=O)Nc2cccc(CNC[C@@H](O)CC(C)(C)O)c2)c1	ZINC000872201222	FG	On-Demand	Anodyne	KCNK3	49	36
Cc1cccc(NC(=O)Nc2cccc(CNC[C@@H](O)CC(C)(C)O)c2)c1	ZINC000872201222	FG	On-Demand	Anodyne	KCNK9	41	36
Cc1cccc(NC(=O)Nc2cccc(CNC[C@H](O)CC(C)(C)O)c2)c1	ZINC000872201223	FG	On-Demand	Anodyne	KCNK3	49	36
Cc1cccc(NC(=O)Nc2cccc(CNC[C@H](O)CC(C)(C)O)c2)c1	ZINC000872201223	FG	On-Demand	Anodyne	KCNK9	41	36
CC(=O)Nc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872201272	CD	On-Demand	Anodyne	ADRB2	53	59
CC(=O)Nc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872201272	CD	On-Demand	Anodyne	ADRB1	79	59
CC(=O)Nc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872201272	CD	On-Demand	Anodyne	ADRB3	97	59
CC(=O)Nc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872201273	CD	On-Demand	Anodyne	ADRB2	53	59
CC(=O)Nc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872201273	CD	On-Demand	Anodyne	ADRB1	79	59
CC(=O)Nc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872201273	CD	On-Demand	Anodyne	ADRB3	97	59
C[C@H](NC[C@H](O)CC(C)(C)O)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872201402	EE	On-Demand	Anodyne	EPHX2	45	42
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872201405	EE	On-Demand	Anodyne	EPHX2	45	42
C[C@H](NC[C@H](O)CC(C)(C)O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000872201496	FF	On-Demand	Anodyne	TRPV1	15	45
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000872201497	FF	On-Demand	Anodyne	TRPV1	15	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201604	DE	On-Demand	Anodyne	DRD4	30	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201604	DE	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201604	DE	On-Demand	Anodyne	SIGMAR1	35	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201606	DE	On-Demand	Anodyne	DRD4	30	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201606	DE	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201606	DE	On-Demand	Anodyne	SIGMAR1	35	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201608	DE	On-Demand	Anodyne	DRD4	30	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201608	DE	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CC(C)(C)O	ZINC000872201608	DE	On-Demand	Anodyne	SIGMAR1	35	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201610	DE	On-Demand	Anodyne	DRD4	30	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201610	DE	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CC(C)(C)O	ZINC000872201610	DE	On-Demand	Anodyne	SIGMAR1	35	40
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1CCCC[C@H]1C	ZINC000872201673	CC	On-Demand	Anodyne	ACE	17	42
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1CCCC[C@@H]1C	ZINC000872201675	CC	On-Demand	Anodyne	ACE	17	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)CC(C)(C)O)C2)CC1	ZINC000872201929	CC	On-Demand	Anodyne	SLC6A5	16	40
CN1CCC(N2CC[C@@H](NC[C@H](O)CC(C)(C)O)C2)CC1	ZINC000872201930	CC	On-Demand	Anodyne	SLC6A5	16	40
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	HTR1A	15	53
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	HTR1D	39	53
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	HTR1B	33	40
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	NQO2	25	57
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	MPO	70	43
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	MTNR1A	48	58
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	MTNR1B	31	57
COc1ccc2[nH]cc(CCNC[C@H](O)CC(C)(C)O)c2c1	ZINC000872201954	DD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	HTR1A	15	53
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	HTR1D	39	53
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	HTR1B	33	40
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	NQO2	25	57
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	MPO	70	43
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	MTNR1A	48	58
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	MTNR1B	31	57
COc1ccc2[nH]cc(CCNC[C@@H](O)CC(C)(C)O)c2c1	ZINC000872201955	DD	On-Demand	Anodyne	ABCG2	25	42
C[C@@](O)(C[C@H](O)CNCCOc1cccnc1)C1CC1	ZINC000872201964	CC	On-Demand	Anodyne	ADRB1	27	42
C[C@@](O)(C[C@H](O)CNCCOc1cccnc1)C1CC1	ZINC000872201964	CC	On-Demand	Anodyne	ADRB3	20	42
C[C@@](O)(C[C@@H](O)CNCCOc1cccnc1)C1CC1	ZINC000872201966	CC	On-Demand	Anodyne	ADRB1	27	42
C[C@@](O)(C[C@@H](O)CNCCOc1cccnc1)C1CC1	ZINC000872201966	CC	On-Demand	Anodyne	ADRB3	20	42
CCOc1cc(CNC[C@H](O)CC(C)(C)O)ccc1OC	ZINC000872201996	CD	On-Demand	Anodyne	MT-ND1	19	43
CCOc1cc(CNC[C@H](O)CC(C)(C)O)ccc1OC	ZINC000872201996	CD	On-Demand	Anodyne	DRTS_TRYCR	45	32
CCOc1cc(CNC[C@@H](O)CC(C)(C)O)ccc1OC	ZINC000872201997	CD	On-Demand	Anodyne	MT-ND1	19	43
CCOc1cc(CNC[C@@H](O)CC(C)(C)O)ccc1OC	ZINC000872201997	CD	On-Demand	Anodyne	DRTS_TRYCR	45	32
CCc1cccc2c(CCNC[C@@H](O)CC(C)(C)O)c[nH]c12	ZINC000872202018	DE	On-Demand	Anodyne	ADRB3	20	45
CCc1cccc2c(CCNC[C@H](O)CC(C)(C)O)c[nH]c12	ZINC000872202019	DE	On-Demand	Anodyne	ADRB3	20	45
O[C@]1(CNCCOc2cccnc2)CCN(Cc2ccccc2)C1	ZINC000872202142	ED	On-Demand	Anodyne	NPFFR1	41	35
O[C@@]1(CNCCOc2cccnc2)CCN(Cc2ccccc2)C1	ZINC000872202143	ED	On-Demand	Anodyne	NPFFR1	41	35
O=C1C=CC=N/C1=C(\O)NCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872202150	FC	On-Demand	Mild	NPFFR1	40	39
O=C1C=CC=N/C1=C(/O)NCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872202151	FC	On-Demand	Mild	NPFFR1	40	39
O=C1C=CC=N/C1=C(/O)NCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872202152	FC	On-Demand	Mild	NPFFR1	40	39
O=C1C=CC=N/C1=C(\O)NCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872202153	FC	On-Demand	Mild	NPFFR1	40	39
CC[C@H](C#N)Oc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872202168	GG	On-Demand	Mild	NPFFR1	42	38
CC[C@H](C#N)Oc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872202169	GG	On-Demand	Mild	NPFFR1	42	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872202170	GG	On-Demand	Mild	NPFFR1	42	38
CC[C@@H](C#N)Oc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872202171	GG	On-Demand	Mild	NPFFR1	42	38
COc1ccc(-n2cc(CNC[C@@H](O)CC(C)(C)O)nn2)cc1	ZINC000872202254	DC	On-Demand	Anodyne	FIMH	17	43
COc1ccc(-n2cc(CNC[C@H](O)CC(C)(C)O)nn2)cc1	ZINC000872202255	DC	On-Demand	Anodyne	FIMH	17	43
CC[C@@H](CNC[C@@H](O)CC(C)(C)O)Oc1cccc(C(F)(F)F)c1	ZINC000872202326	EF	On-Demand	Anodyne	PDS	53	44
CC[C@@H](CNC[C@H](O)CC(C)(C)O)Oc1cccc(C(F)(F)F)c1	ZINC000872202327	EF	On-Demand	Anodyne	PDS	53	44
O[C@]1(CNCCc2ccc(Cl)nc2)CCN(Cc2ccccc2)C1	ZINC000872202384	EF	On-Demand	Anodyne	NPFFR1	40	38
O[C@@]1(CNCCc2ccc(Cl)nc2)CCN(Cc2ccccc2)C1	ZINC000872202385	EF	On-Demand	Anodyne	NPFFR1	40	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202393	DD	On-Demand	Anodyne	DRD3	43	38
COc1cccc(C(NC[C@@H](O)CC(C)(C)O)c2cccc(OC)c2)c1	ZINC000872202395	FF	On-Demand	Anodyne	CASR	16	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CC(C)(C)O)C1	ZINC000872202396	DD	On-Demand	Anodyne	DRD3	43	38
COc1cccc(C(NC[C@H](O)CC(C)(C)O)c2cccc(OC)c2)c1	ZINC000872202397	FF	On-Demand	Anodyne	CASR	16	42
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202398	DD	On-Demand	Anodyne	DRD3	43	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CC(C)(C)O)C1	ZINC000872202399	DD	On-Demand	Anodyne	DRD3	43	38
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC1(O)CCOCC1	ZINC000872202574	EE	On-Demand	Anodyne	BACE1	22	43
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC1(O)CCOCC1	ZINC000872202575	EE	On-Demand	Anodyne	BACE1	22	43
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC1(O)CCOCC1	ZINC000872202576	EE	On-Demand	Anodyne	BACE1	22	43
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC1(O)CCOCC1	ZINC000872202577	EE	On-Demand	Anodyne	BACE1	22	43
CC[C@@H](CNC[C@@H](O)CC(C)(C)O)Oc1cccc(F)c1	ZINC000872202652	CE	On-Demand	Anodyne	PDS	37	40
CC[C@@H](CNC[C@H](O)CC(C)(C)O)Oc1cccc(F)c1	ZINC000872202653	CE	On-Demand	Anodyne	PDS	37	40
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202736	CD	On-Demand	Anodyne	ADRB2	18	62
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202736	CD	On-Demand	Anodyne	ADRB1	20	62
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202736	CD	On-Demand	Anodyne	ADRB3	15	62
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202737	CD	On-Demand	Anodyne	ADRB2	18	62
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202737	CD	On-Demand	Anodyne	ADRB1	20	62
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202737	CD	On-Demand	Anodyne	ADRB3	15	62
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202738	CD	On-Demand	Anodyne	ADRB2	18	62
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202738	CD	On-Demand	Anodyne	ADRB1	20	62
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872202738	CD	On-Demand	Anodyne	ADRB3	15	62
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202739	CD	On-Demand	Anodyne	ADRB2	18	62
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202739	CD	On-Demand	Anodyne	ADRB1	20	62
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872202739	CD	On-Demand	Anodyne	ADRB3	15	62
C[C@H](O)c1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872202758	EE	On-Demand	Anodyne	NPFFR1	43	38
C[C@H](O)c1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872202760	EE	On-Demand	Anodyne	NPFFR1	43	38
CC(C)c1nnc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)s1	ZINC000872203252	EE	On-Demand	Anodyne	NPFFR1	43	38
CC(C)c1nnc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)s1	ZINC000872203253	EE	On-Demand	Anodyne	NPFFR1	43	38
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1)CC1CC1	ZINC000872203356	GE	On-Demand	Anodyne	ADRB2	30	42
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1)CC1CC1	ZINC000872203356	GE	On-Demand	Anodyne	ADRB1	55	46
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)CC1CC1	ZINC000872203357	GE	On-Demand	Anodyne	ADRB2	30	42
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)CC1CC1	ZINC000872203357	GE	On-Demand	Anodyne	ADRB1	55	46
COc1cccc(O[C@H](C)CNC[C@H](O)CC(C)(C)O)c1	ZINC000872203441	CD	On-Demand	Anodyne	MTNR1A	34	55
COc1cccc(O[C@H](C)CNC[C@H](O)CC(C)(C)O)c1	ZINC000872203441	CD	On-Demand	Anodyne	MTNR1B	33	55
COc1cccc(O[C@H](C)CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203442	CD	On-Demand	Anodyne	MTNR1A	34	55
COc1cccc(O[C@H](C)CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203442	CD	On-Demand	Anodyne	MTNR1B	33	55
COc1cccc(O[C@@H](C)CNC[C@H](O)CC(C)(C)O)c1	ZINC000872203444	CD	On-Demand	Anodyne	MTNR1A	34	55
COc1cccc(O[C@@H](C)CNC[C@H](O)CC(C)(C)O)c1	ZINC000872203444	CD	On-Demand	Anodyne	MTNR1B	33	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203446	CD	On-Demand	Anodyne	MTNR1A	34	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203446	CD	On-Demand	Anodyne	MTNR1B	33	55
C[C@@](O)(C[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203473	EF	On-Demand	Anodyne	HTR1D	55	43
C[C@@](O)(C[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203473	EF	On-Demand	Anodyne	HTR1B	48	40
C[C@@](O)(C[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203473	EF	On-Demand	Anodyne	MPO	60	39
C[C@@](O)(C[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203474	EF	On-Demand	Anodyne	HTR1D	55	43
C[C@@](O)(C[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203474	EF	On-Demand	Anodyne	HTR1B	48	40
C[C@@](O)(C[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000872203474	EF	On-Demand	Anodyne	MPO	60	39
CN(C)c1ccc(N2CCC(NC[C@@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872203507	FE	On-Demand	Anodyne	ADRB3	17	40
CN(C)c1ccc(N2CCC(NC[C@H](O)C[C@@](C)(O)C3CC3)CC2)cc1	ZINC000872203508	FE	On-Demand	Anodyne	ADRB3	17	40
CN(C)c1ccc(N2CCC(NC[C@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872203509	FE	On-Demand	Anodyne	ADRB3	17	40
CN(C)c1ccc(N2CCC(NC[C@@H](O)C[C@](C)(O)C3CC3)CC2)cc1	ZINC000872203511	FE	On-Demand	Anodyne	ADRB3	17	40
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)CC1CC1	ZINC000872203516	FD	On-Demand	Anodyne	SIGMAR1	45	37
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)CC1CC1	ZINC000872203516	FD	On-Demand	Anodyne	NPFFR1	41	37
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)CC1CC1	ZINC000872203518	FD	On-Demand	Anodyne	SIGMAR1	45	37
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)CC1CC1	ZINC000872203518	FD	On-Demand	Anodyne	NPFFR1	41	37
CS[C@@H]1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872203520	DE	On-Demand	Anodyne	SIGMAR1	47	40
CS[C@@H]1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872203527	DE	On-Demand	Anodyne	SIGMAR1	47	40
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203530	CD	On-Demand	Anodyne	ADRB2	21	60
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203530	CD	On-Demand	Anodyne	ADRB1	17	60
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872203534	CD	On-Demand	Anodyne	ADRB2	21	60
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CC(C)(C)O	ZINC000872203534	CD	On-Demand	Anodyne	ADRB1	17	60
C#CCCCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872203551	CE	On-Demand	Mild	NPFFR1	43	38
C#CCCCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872203553	CE	On-Demand	Mild	NPFFR1	43	38
COC[C@@H](Cc1ccccc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203650	CD	On-Demand	Anodyne	ADRB2	22	40
COC[C@@H](Cc1ccccc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203650	CD	On-Demand	Anodyne	ADRB1	22	43
COC[C@H](Cc1ccccc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203651	CD	On-Demand	Anodyne	ADRB2	22	40
COC[C@H](Cc1ccccc1)NC[C@@H](O)CC(C)(C)O	ZINC000872203651	CD	On-Demand	Anodyne	ADRB1	22	43
COC[C@@H](Cc1ccccc1)NC[C@H](O)CC(C)(C)O	ZINC000872203652	CD	On-Demand	Anodyne	ADRB2	22	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)CC(C)(C)O	ZINC000872203652	CD	On-Demand	Anodyne	ADRB1	22	43
COC[C@H](Cc1ccccc1)NC[C@H](O)CC(C)(C)O	ZINC000872203653	CD	On-Demand	Anodyne	ADRB2	22	40
COC[C@H](Cc1ccccc1)NC[C@H](O)CC(C)(C)O	ZINC000872203653	CD	On-Demand	Anodyne	ADRB1	22	43
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	ADRB2	22	49
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	DRD4	15	41
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	ADRB3	17	40
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	MTNR1A	23	49
COc1cccc(OCCCNC[C@H](O)CC(C)(C)O)c1	ZINC000872203736	CD	On-Demand	Anodyne	MTNR1B	27	49
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	ADRB2	22	49
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	DRD4	15	41
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	ADRB3	17	40
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	MTNR1A	23	49
COc1cccc(OCCCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872203737	CD	On-Demand	Anodyne	MTNR1B	27	49
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccc(-n2cccn2)cc1	ZINC000872203821	DE	On-Demand	Anodyne	AMP1_PLAFQ	62	45
C[C@H](NC[C@H](O)CC(C)(C)O)c1ccc(-n2cccn2)cc1	ZINC000872203823	DE	On-Demand	Anodyne	AMP1_PLAFQ	62	45
CC[C@@H](NC[C@H](O)COC(C)C)c1ccncc1	ZINC000872203895	CD	On-Demand	Anodyne	ADRB2	17	49
CC[C@@H](NC[C@@H](O)COC(C)C)c1ccncc1	ZINC000872203896	CD	On-Demand	Anodyne	ADRB2	17	49
CN(C)c1ccc(N2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872204042	ED	On-Demand	Anodyne	ADRB3	19	41
CN(C)c1ccc(N2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872204043	ED	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CNCCOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872204046	EF	On-Demand	Anodyne	ADRB2	32	51
O[C@H](CNCCOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872204046	EF	On-Demand	Anodyne	ADRB1	57	52
O[C@@H](CNCCOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872204047	EF	On-Demand	Anodyne	ADRB2	32	51
O[C@@H](CNCCOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872204047	EF	On-Demand	Anodyne	ADRB1	57	52
C#CCCCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872204062	DF	On-Demand	Mild	ADRB2	28	43
C#CCCCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872204063	DF	On-Demand	Mild	ADRB2	28	43
COc1ccc(C(=O)N2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1OC	ZINC000872204077	GD	On-Demand	Anodyne	ADRB3	17	42
COc1ccc(C(=O)N2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1OC	ZINC000872204077	GD	On-Demand	Anodyne	L3MBTL3	49	33
COc1ccc(C(=O)N2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1OC	ZINC000872204078	GD	On-Demand	Anodyne	ADRB3	17	42
COc1ccc(C(=O)N2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1OC	ZINC000872204078	GD	On-Demand	Anodyne	L3MBTL3	49	33
C#CCSCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204111	DD	On-Demand	Mild	NPFFR1	40	37
C#CCSCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204112	DD	On-Demand	Mild	NPFFR1	40	37
Cn1cccc1CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872204218	EF	On-Demand	Anodyne	ADRB2	27	43
Cn1cccc1CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872204219	EF	On-Demand	Anodyne	ADRB2	27	43
CSCC[C@H](C)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204314	DE	On-Demand	Anodyne	NPFFR1	40	35
CSCC[C@@H](C)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204315	DE	On-Demand	Anodyne	NPFFR1	40	35
CSCC[C@H](C)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204316	DE	On-Demand	Anodyne	NPFFR1	40	35
CSCC[C@@H](C)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872204317	DE	On-Demand	Anodyne	NPFFR1	40	35
O[C@@]1(CNC[C@@H]2OCCc3sccc32)CCN(Cc2ccccc2)C1	ZINC000872204380	FF	On-Demand	Anodyne	SIGMAR1	31	46
O[C@]1(CNC[C@@H]2OCCc3sccc32)CCN(Cc2ccccc2)C1	ZINC000872204381	FF	On-Demand	Anodyne	SIGMAR1	31	46
O[C@]1(CNC[C@H]2OCCc3sccc32)CCN(Cc2ccccc2)C1	ZINC000872204382	FF	On-Demand	Anodyne	SIGMAR1	31	46
O[C@@]1(CNC[C@H]2OCCc3sccc32)CCN(Cc2ccccc2)C1	ZINC000872204383	FF	On-Demand	Anodyne	SIGMAR1	31	46
CCOc1ccccc1[C@@H](CC(C)C)NC[C@@H](O)CC(C)(C)O	ZINC000872204394	DG	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@@H](CC(C)C)NC[C@H](O)CC(C)(C)O	ZINC000872204395	DG	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@H](CC(C)C)NC[C@@H](O)CC(C)(C)O	ZINC000872204396	DG	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccccc1[C@H](CC(C)C)NC[C@H](O)CC(C)(C)O	ZINC000872204397	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCc1c[nH]c2ccc(Cl)cc12)CC1(O)CCOCC1	ZINC000872204398	FE	On-Demand	Anodyne	MPO	47	39
O[C@@H](CNCCc1c[nH]c2ccc(Cl)cc12)CC1(O)CCOCC1	ZINC000872204399	FE	On-Demand	Anodyne	MPO	47	39
C[C@H](NC[C@H](O)CC(C)(C)O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872204550	ED	On-Demand	Anodyne	DRD4	15	43
C[C@H](NC[C@H](O)CC(C)(C)O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872204551	ED	On-Demand	Anodyne	DRD4	15	43
CC(C)c1ccc(CCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872204576	CF	On-Demand	Anodyne	ADRB2	18	43
CC(C)c1ccc(CCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872204576	CF	On-Demand	Anodyne	ADRB1	17	43
CC(C)c1ccc(CCCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872204576	CF	On-Demand	Anodyne	ADRB3	16	43
CC(C)c1ccc(CCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872204577	CF	On-Demand	Anodyne	ADRB2	18	43
CC(C)c1ccc(CCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872204577	CF	On-Demand	Anodyne	ADRB1	17	43
CC(C)c1ccc(CCCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872204577	CF	On-Demand	Anodyne	ADRB3	16	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)CC(C)(C)O	ZINC000872204616	EC	On-Demand	Anodyne	DRD4	29	44
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)CC(C)(C)O	ZINC000872204618	EC	On-Demand	Anodyne	DRD4	29	44
CCCOc1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872204864	CE	On-Demand	Anodyne	ADRB2	40	46
CCCOc1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872204864	CE	On-Demand	Anodyne	ADRB1	58	46
CCCOc1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872204864	CE	On-Demand	Anodyne	ADRB3	48	39
CCCOc1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872204865	CE	On-Demand	Anodyne	ADRB2	40	46
CCCOc1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872204865	CE	On-Demand	Anodyne	ADRB1	58	46
CCCOc1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872204865	CE	On-Demand	Anodyne	ADRB3	48	39
O[C@H](CNCc1cccc(F)n1)COc1cc(Cl)cc(Cl)c1	ZINC000872204906	EG	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNCc1cccc(F)n1)COc1cc(Cl)cc(Cl)c1	ZINC000872204907	EG	On-Demand	Anodyne	ADRB2	24	42
COc1ccc([C@@H](NC[C@@H](O)CC(C)(C)O)c2ccccc2OC)cc1	ZINC000872205011	FF	On-Demand	Anodyne	ADRB2	15	42
COc1ccc([C@@H](NC[C@H](O)CC(C)(C)O)c2ccccc2OC)cc1	ZINC000872205012	FF	On-Demand	Anodyne	ADRB2	15	42
CCC1(CNC[C@@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205028	EF	On-Demand	Anodyne	SIGMAR1	42	38
CCC1(CNC[C@@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205028	EF	On-Demand	Anodyne	NPFFR2	27	41
CCC1(CNC[C@@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205028	EF	On-Demand	Anodyne	NPFFR1	40	41
CCC1(CNC[C@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205029	EF	On-Demand	Anodyne	SIGMAR1	42	38
CCC1(CNC[C@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205029	EF	On-Demand	Anodyne	NPFFR2	27	41
CCC1(CNC[C@H](O)CC(C)(C)O)CCN(Cc2ccccc2)CC1	ZINC000872205029	EF	On-Demand	Anodyne	NPFFR1	40	41
C[C@H](NC[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc[nH]1	ZINC000872205046	EG	On-Demand	Anodyne	ADRB2	28	45
C[C@H](NC[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc[nH]1	ZINC000872205046	EG	On-Demand	Anodyne	ADRB1	27	43
C[C@@H](NC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc[nH]1	ZINC000872205049	EG	On-Demand	Anodyne	ADRB2	28	45
C[C@@H](NC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc[nH]1	ZINC000872205049	EG	On-Demand	Anodyne	ADRB1	27	43
O[C@@]1(CNCc2cccc(F)n2)CCN(Cc2ccccc2)C1	ZINC000872205150	DD	On-Demand	Anodyne	NPFFR1	42	36
O[C@]1(CNCc2cccc(F)n2)CCN(Cc2ccccc2)C1	ZINC000872205151	DD	On-Demand	Anodyne	NPFFR1	42	36
C#CC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000872205154	EF	On-Demand	Mild	NPFFR1	41	38
C#CC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000872205155	EF	On-Demand	Mild	NPFFR1	41	38
C#CC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000872205156	EF	On-Demand	Mild	NPFFR1	41	38
C#CC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000872205157	EF	On-Demand	Mild	NPFFR1	41	38
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1ccccc1[N+](=O)[O-]	ZINC000872205327	CD	On-Demand	Bother	COLA	95	33
C[C@H](NC[C@H](O)CC(C)(C)O)c1ccccc1[N+](=O)[O-]	ZINC000872205329	CD	On-Demand	Bother	COLA	95	33
C[C@H](NC[C@H](O)CC(C)(C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872205334	DE	On-Demand	Anodyne	SIGMAR1	36	45
C[C@H](NC[C@H](O)CC(C)(C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872205336	DE	On-Demand	Anodyne	SIGMAR1	36	45
O[C@@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205362	EE	On-Demand	Anodyne	ADRB2	34	45
O[C@@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205362	EE	On-Demand	Anodyne	ADRB1	54	45
O[C@@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205362	EE	On-Demand	Anodyne	ADRB3	40	50
O[C@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205363	EE	On-Demand	Anodyne	ADRB2	34	45
O[C@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205363	EE	On-Demand	Anodyne	ADRB1	54	45
O[C@H](CNCCc1cnccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872205363	EE	On-Demand	Anodyne	ADRB3	40	50
CC(C)(C)OC(=O)NC/C=C/CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205500	GE	On-Demand	Anodyne	SIGMAR1	33	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205500	GE	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205500	GE	On-Demand	Anodyne	NPFFR2	37	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205500	GE	On-Demand	Anodyne	NPFFR1	48	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205501	GE	On-Demand	Anodyne	SIGMAR1	33	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205501	GE	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205501	GE	On-Demand	Anodyne	NPFFR2	37	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205501	GE	On-Demand	Anodyne	NPFFR1	48	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205502	GE	On-Demand	Anodyne	SIGMAR1	33	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205502	GE	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205502	GE	On-Demand	Anodyne	NPFFR2	37	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205502	GE	On-Demand	Anodyne	NPFFR1	48	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205503	GE	On-Demand	Anodyne	SIGMAR1	33	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205503	GE	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205503	GE	On-Demand	Anodyne	NPFFR2	37	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205503	GE	On-Demand	Anodyne	NPFFR1	48	40
OC1(c2cccnc2)CCC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872205506	GE	On-Demand	Anodyne	SIGMAR1	38	40
OC1(c2cccnc2)CCC(NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872205507	GE	On-Demand	Anodyne	SIGMAR1	38	40
O[C@]1(CNOC2CCCC2)CCN(Cc2ccccc2)C1	ZINC000872205592	CE	On-Demand	Anodyne	SIGMAR1	70	43
O[C@]1(CNOC2CCCC2)CCN(Cc2ccccc2)C1	ZINC000872205592	CE	On-Demand	Anodyne	NPFFR1	43	40
O[C@@]1(CNOC2CCCC2)CCN(Cc2ccccc2)C1	ZINC000872205593	CE	On-Demand	Anodyne	SIGMAR1	70	43
O[C@@]1(CNOC2CCCC2)CCN(Cc2ccccc2)C1	ZINC000872205593	CE	On-Demand	Anodyne	NPFFR1	43	40
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872205602	CF	On-Demand	Anodyne	ADRB2	19	46
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872205602	CF	On-Demand	Anodyne	ADRB1	18	46
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872205603	CF	On-Demand	Anodyne	ADRB2	19	46
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872205603	CF	On-Demand	Anodyne	ADRB1	18	46
CC(C)c1ccc(C[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872205604	CF	On-Demand	Anodyne	ADRB2	19	46
CC(C)c1ccc(C[C@H](C)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872205604	CF	On-Demand	Anodyne	ADRB1	18	46
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872205605	CF	On-Demand	Anodyne	ADRB2	19	46
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872205605	CF	On-Demand	Anodyne	ADRB1	18	46
C#CCOCCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872205702	DD	On-Demand	Mild	ADRB2	24	42
C#CCOCCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872205703	DD	On-Demand	Mild	ADRB2	24	42
C#CCOCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205770	CC	On-Demand	Mild	NPFFR1	41	37
C#CCOCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872205771	CC	On-Demand	Mild	NPFFR1	41	37
COC(=O)c1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872205852	CD	On-Demand	Anodyne	ADRB2	45	44
COC(=O)c1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872205852	CD	On-Demand	Anodyne	ADRB1	63	42
COC(=O)c1cccc(CCNC[C@@H](O)CC(C)(C)O)c1	ZINC000872205852	CD	On-Demand	Anodyne	ADRB3	54	42
COC(=O)c1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872205853	CD	On-Demand	Anodyne	ADRB2	45	44
COC(=O)c1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872205853	CD	On-Demand	Anodyne	ADRB1	63	42
COC(=O)c1cccc(CCNC[C@H](O)CC(C)(C)O)c1	ZINC000872205853	CD	On-Demand	Anodyne	ADRB3	54	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872205978	FD	On-Demand	Mild	ADRB2	27	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872205979	FD	On-Demand	Mild	ADRB2	27	42
CO[C@@H](c1ccccc1F)[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872206038	CE	On-Demand	Anodyne	ADRB2	17	44
CO[C@@H](c1ccccc1F)[C@H](C)NC[C@H](O)COC(C)C	ZINC000872206039	CE	On-Demand	Anodyne	ADRB2	17	44
CO[C@@H](c1ccccc1F)[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872206040	CE	On-Demand	Anodyne	ADRB2	17	44
CO[C@@H](c1ccccc1F)[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872206041	CE	On-Demand	Anodyne	ADRB2	17	44
Cn1nccc1CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206142	EE	On-Demand	Anodyne	ADRB2	43	44
Cn1nccc1CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206142	EE	On-Demand	Anodyne	ADRB1	65	44
Cn1nccc1CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206142	EE	On-Demand	Anodyne	GRIN1	19	45
Cn1nccc1CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206142	EE	On-Demand	Anodyne	ADRB3	47	44
Cn1nccc1CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206143	EE	On-Demand	Anodyne	ADRB2	43	44
Cn1nccc1CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206143	EE	On-Demand	Anodyne	ADRB1	65	44
Cn1nccc1CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206143	EE	On-Demand	Anodyne	GRIN1	19	45
Cn1nccc1CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206143	EE	On-Demand	Anodyne	ADRB3	47	44
CN(C)c1noc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000872206158	EC	On-Demand	Anodyne	NPFFR1	42	36
CN(C)c1noc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000872206159	EC	On-Demand	Anodyne	NPFFR1	42	36
CO[C@@H](c1ccccc1Cl)[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872206244	DF	On-Demand	Anodyne	ADRB2	20	44
CO[C@@H](c1ccccc1Cl)[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872206244	DF	On-Demand	Anodyne	CASR	17	41
CO[C@@H](c1ccccc1Cl)[C@H](C)NC[C@H](O)COC(C)C	ZINC000872206245	DF	On-Demand	Anodyne	ADRB2	20	44
CO[C@@H](c1ccccc1Cl)[C@H](C)NC[C@H](O)COC(C)C	ZINC000872206245	DF	On-Demand	Anodyne	CASR	17	41
CO[C@@H](c1ccccc1Cl)[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872206246	DF	On-Demand	Anodyne	ADRB2	20	44
CO[C@@H](c1ccccc1Cl)[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872206246	DF	On-Demand	Anodyne	CASR	17	41
CO[C@@H](c1ccccc1Cl)[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872206247	DF	On-Demand	Anodyne	ADRB2	20	44
CO[C@@H](c1ccccc1Cl)[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872206247	DF	On-Demand	Anodyne	CASR	17	41
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872206258	FF	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872206259	FF	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872206260	FF	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@H](O)COC(C)C	ZINC000872206261	FF	On-Demand	Anodyne	ADRB2	15	46
C=CCS(=O)(=O)CCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206304	EC	On-Demand	Mild	NPFFR1	41	37
C=CCS(=O)(=O)CCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206305	EC	On-Demand	Mild	NPFFR1	41	37
O[C@]1(CNOC2CCOCC2)CCN(Cc2ccccc2)C1	ZINC000872206316	DD	On-Demand	Anodyne	SIGMAR1	59	37
O[C@@]1(CNOC2CCOCC2)CCN(Cc2ccccc2)C1	ZINC000872206317	DD	On-Demand	Anodyne	SIGMAR1	59	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206384	GE	On-Demand	Anodyne	SIGMAR1	43	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206384	GE	On-Demand	Anodyne	CACNA1I	55	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206384	GE	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206384	GE	On-Demand	Anodyne	NPFFR1	43	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206385	GE	On-Demand	Anodyne	SIGMAR1	43	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206385	GE	On-Demand	Anodyne	CACNA1I	55	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206385	GE	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206385	GE	On-Demand	Anodyne	NPFFR1	43	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206386	GE	On-Demand	Anodyne	SIGMAR1	43	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206386	GE	On-Demand	Anodyne	CACNA1I	55	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206386	GE	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206386	GE	On-Demand	Anodyne	NPFFR1	43	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206387	GE	On-Demand	Anodyne	SIGMAR1	43	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206387	GE	On-Demand	Anodyne	CACNA1I	55	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206387	GE	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206387	GE	On-Demand	Anodyne	NPFFR1	43	36
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872206392	CE	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872206393	CE	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872206394	CE	On-Demand	Anodyne	ADRB2	15	46
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@H](O)COC(C)C	ZINC000872206395	CE	On-Demand	Anodyne	ADRB2	15	46
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)COC(C)C)cc1	ZINC000872206458	DE	On-Demand	Anodyne	ADRB2	25	46
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)COC(C)C)cc1	ZINC000872206458	DE	On-Demand	Anodyne	ADRB1	17	41
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)COC(C)C)cc1	ZINC000872206459	DE	On-Demand	Anodyne	ADRB2	25	46
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)COC(C)C)cc1	ZINC000872206459	DE	On-Demand	Anodyne	ADRB1	17	41
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)COC(C)C)cc1	ZINC000872206460	DE	On-Demand	Anodyne	ADRB2	25	46
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)COC(C)C)cc1	ZINC000872206460	DE	On-Demand	Anodyne	ADRB1	17	41
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)COC(C)C)cc1	ZINC000872206461	DE	On-Demand	Anodyne	ADRB2	25	46
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)COC(C)C)cc1	ZINC000872206461	DE	On-Demand	Anodyne	ADRB1	17	41
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)CC(C)(C)O)C2	ZINC000872206532	CD	On-Demand	Anodyne	ADRB3	20	45
COc1ccc2c(c1)CC[C@H](NC[C@H](O)CC(C)(C)O)C2	ZINC000872206534	CD	On-Demand	Anodyne	ADRB3	20	45
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	CHRM2	20	40
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	CHRM1	18	45
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	DRD4	31	40
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	CHRM3	19	40
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	SIGMAR1	46	43
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	MLNR	44	39
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	MCHR1	16	40
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	CCR8	50	42
CCOC(=O)N1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206547	ED	On-Demand	Anodyne	NPFFR1	51	41
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	CHRM2	20	40
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	CHRM1	18	45
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	DRD4	31	40
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	CHRM3	19	40
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	SIGMAR1	46	43
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	MLNR	44	39
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	MCHR1	16	40
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	CCR8	50	42
CCOC(=O)N1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206548	ED	On-Demand	Anodyne	NPFFR1	51	41
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	CHRM2	20	40
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	CHRM1	18	45
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	DRD4	31	40
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	CHRM3	19	40
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	SIGMAR1	46	43
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	MLNR	44	39
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	MCHR1	16	40
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	CCR8	50	42
CCOC(=O)N1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206549	ED	On-Demand	Anodyne	NPFFR1	51	41
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	CHRM2	20	40
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	CHRM1	18	45
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	DRD4	31	40
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	CHRM3	19	40
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	SIGMAR1	46	43
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	MLNR	44	39
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	MCHR1	16	40
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	CCR8	50	42
CCOC(=O)N1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872206550	ED	On-Demand	Anodyne	NPFFR1	51	41
O=C1OCCN1c1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872206605	GE	On-Demand	Anodyne	NPFFR1	40	37
O=C1OCCN1c1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872206606	GE	On-Demand	Anodyne	NPFFR1	40	37
COCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206681	CC	On-Demand	Anodyne	SIGMAR1	66	41
COCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206681	CC	On-Demand	Anodyne	NPFFR1	45	40
COCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206682	CC	On-Demand	Anodyne	SIGMAR1	66	41
COCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206682	CC	On-Demand	Anodyne	NPFFR1	45	40
N#CCCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206701	CE	On-Demand	Mild	ADRB2	33	45
N#CCCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206701	CE	On-Demand	Mild	ADRB1	53	41
N#CCCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206701	CE	On-Demand	Mild	ADRB3	28	41
N#CCCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206702	CE	On-Demand	Mild	ADRB2	33	45
N#CCCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206702	CE	On-Demand	Mild	ADRB1	53	41
N#CCCNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872206702	CE	On-Demand	Mild	ADRB3	28	41
C[C@H](CNC[C@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872206725	CD	On-Demand	Anodyne	CTSK	15	45
C[C@H](CNC[C@@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872206726	CD	On-Demand	Anodyne	CTSK	15	45
C[C@@H](CNC[C@@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872206727	CD	On-Demand	Anodyne	CTSK	15	45
C[C@@H](CNC[C@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872206728	CD	On-Demand	Anodyne	CTSK	15	45
Cc1ccccc1[C@@H]([C@@H](C)NC[C@@H](O)COC(C)C)N(C)C	ZINC000872206811	DE	On-Demand	Anodyne	ADRB2	19	44
Cc1ccccc1[C@@H]([C@@H](C)NC[C@@H](O)COC(C)C)N(C)C	ZINC000872206811	DE	On-Demand	Anodyne	CASR	19	42
Cc1ccccc1[C@@H]([C@H](C)NC[C@@H](O)COC(C)C)N(C)C	ZINC000872206812	DE	On-Demand	Anodyne	ADRB2	19	44
Cc1ccccc1[C@@H]([C@H](C)NC[C@@H](O)COC(C)C)N(C)C	ZINC000872206812	DE	On-Demand	Anodyne	CASR	19	42
Cc1ccccc1[C@@H]([C@@H](C)NC[C@H](O)COC(C)C)N(C)C	ZINC000872206813	DE	On-Demand	Anodyne	ADRB2	19	44
Cc1ccccc1[C@@H]([C@@H](C)NC[C@H](O)COC(C)C)N(C)C	ZINC000872206813	DE	On-Demand	Anodyne	CASR	19	42
Cc1ccccc1[C@@H]([C@H](C)NC[C@H](O)COC(C)C)N(C)C	ZINC000872206814	DE	On-Demand	Anodyne	ADRB2	19	44
Cc1ccccc1[C@@H]([C@H](C)NC[C@H](O)COC(C)C)N(C)C	ZINC000872206814	DE	On-Demand	Anodyne	CASR	19	42
CSCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206876	CD	On-Demand	Anodyne	SIGMAR1	44	41
CSCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206876	CD	On-Demand	Anodyne	NPFFR1	41	37
CSCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206877	CD	On-Demand	Anodyne	SIGMAR1	44	41
CSCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872206877	CD	On-Demand	Anodyne	NPFFR1	41	37
O[C@@]1(CNOC2CCCCC2)CCN(Cc2ccccc2)C1	ZINC000872206983	DE	On-Demand	Anodyne	SIGMAR1	65	45
O[C@@]1(CNOC2CCCCC2)CCN(Cc2ccccc2)C1	ZINC000872206983	DE	On-Demand	Anodyne	NPFFR1	42	39
O[C@]1(CNOC2CCCCC2)CCN(Cc2ccccc2)C1	ZINC000872206984	DE	On-Demand	Anodyne	SIGMAR1	65	45
O[C@]1(CNOC2CCCCC2)CCN(Cc2ccccc2)C1	ZINC000872206984	DE	On-Demand	Anodyne	NPFFR1	42	39
COCCONC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872207118	DD	On-Demand	Anodyne	ADRB2	17	41
COCCONC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872207118	DD	On-Demand	Anodyne	ADRB1	18	41
COCCONC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872207125	DD	On-Demand	Anodyne	ADRB2	17	41
COCCONC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872207125	DD	On-Demand	Anodyne	ADRB1	18	41
CSc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872207212	CE	On-Demand	Anodyne	ADRB2	29	45
CSc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872207212	CE	On-Demand	Anodyne	ADRB1	36	41
CSc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872207212	CE	On-Demand	Anodyne	ADRB3	36	41
CSc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872207213	CE	On-Demand	Anodyne	ADRB2	29	45
CSc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872207213	CE	On-Demand	Anodyne	ADRB1	36	41
CSc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872207213	CE	On-Demand	Anodyne	ADRB3	36	41
C[C@@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207287	FE	On-Demand	Anodyne	FPR1	46	37
C[C@@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207287	FE	On-Demand	Anodyne	NPFFR1	41	35
C[C@@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207288	FE	On-Demand	Anodyne	FPR1	46	37
C[C@@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207288	FE	On-Demand	Anodyne	NPFFR1	41	35
C[C@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207289	FE	On-Demand	Anodyne	FPR1	46	37
C[C@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207289	FE	On-Demand	Anodyne	NPFFR1	41	35
C[C@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207290	FE	On-Demand	Anodyne	FPR1	46	37
C[C@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000872207290	FE	On-Demand	Anodyne	NPFFR1	41	35
CCO[C@@H](CNC[C@H](O)CC(C)(C)O)c1ccccc1	ZINC000872207304	CD	On-Demand	Anodyne	CASR	15	40
CCO[C@@H](CNC[C@@H](O)CC(C)(C)O)c1ccccc1	ZINC000872207305	CD	On-Demand	Anodyne	CASR	15	40
O[C@H](CNCc1cccnc1F)COc1cc(Cl)cc(Cl)c1	ZINC000872207373	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCc1cccnc1F)COc1cc(Cl)cc(Cl)c1	ZINC000872207375	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@@]1(CNOC[C@H]2CCOC2)CCN(Cc2ccccc2)C1	ZINC000872207394	DD	On-Demand	Anodyne	SIGMAR1	51	38
O[C@@]1(CNOC[C@@H]2CCOC2)CCN(Cc2ccccc2)C1	ZINC000872207397	DD	On-Demand	Anodyne	SIGMAR1	51	38
O[C@]1(CNOC[C@H]2CCOC2)CCN(Cc2ccccc2)C1	ZINC000872207399	DD	On-Demand	Anodyne	SIGMAR1	51	38
O[C@]1(CNOC[C@@H]2CCOC2)CCN(Cc2ccccc2)C1	ZINC000872207401	DD	On-Demand	Anodyne	SIGMAR1	51	38
O[C@]1(CNOCCC(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000872207436	DE	On-Demand	Anodyne	SIGMAR1	46	38
O[C@]1(CNOCCC(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000872207436	DE	On-Demand	Anodyne	NPFFR1	40	37
O[C@@]1(CNOCCC(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000872207438	DE	On-Demand	Anodyne	SIGMAR1	46	38
O[C@@]1(CNOCCC(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000872207438	DE	On-Demand	Anodyne	NPFFR1	40	37
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207554	EG	On-Demand	Anodyne	ADRB2	20	44
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207554	EG	On-Demand	Anodyne	ADRB3	15	43
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207554	EG	On-Demand	Anodyne	CASR	26	40
C[C@H](NC[C@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207558	EG	On-Demand	Anodyne	ADRB2	20	44
C[C@H](NC[C@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207558	EG	On-Demand	Anodyne	ADRB3	15	43
C[C@H](NC[C@H](O)CC(C)(C)O)c1cccc(OCc2ccccc2)c1	ZINC000872207558	EG	On-Demand	Anodyne	CASR	26	40
CCOC(=O)N1CCC([C@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207649	GE	On-Demand	Anodyne	SIGMAR1	41	43
CCOC(=O)N1CCC([C@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207649	GE	On-Demand	Anodyne	NPFFR2	37	41
CCOC(=O)N1CCC([C@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207649	GE	On-Demand	Anodyne	NPFFR1	49	41
CCOC(=O)N1CCC([C@@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207650	GE	On-Demand	Anodyne	SIGMAR1	41	43
CCOC(=O)N1CCC([C@@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207650	GE	On-Demand	Anodyne	NPFFR2	37	41
CCOC(=O)N1CCC([C@@H](C)NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207650	GE	On-Demand	Anodyne	NPFFR1	49	41
CCOC(=O)N1CCC([C@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207651	GE	On-Demand	Anodyne	SIGMAR1	41	43
CCOC(=O)N1CCC([C@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207651	GE	On-Demand	Anodyne	NPFFR2	37	41
CCOC(=O)N1CCC([C@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207651	GE	On-Demand	Anodyne	NPFFR1	49	41
CCOC(=O)N1CCC([C@@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207652	GE	On-Demand	Anodyne	SIGMAR1	41	43
CCOC(=O)N1CCC([C@@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207652	GE	On-Demand	Anodyne	NPFFR2	37	41
CCOC(=O)N1CCC([C@@H](C)NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872207652	GE	On-Demand	Anodyne	NPFFR1	49	41
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)CC(C)(C)O	ZINC000872207719	DF	On-Demand	Anodyne	CCR2	38	46
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)CC(C)(C)O	ZINC000872207720	DF	On-Demand	Anodyne	CCR2	38	46
CC[C@H](C)CONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208047	CE	On-Demand	Anodyne	SIGMAR1	40	38
CC[C@H](C)CONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208047	CE	On-Demand	Anodyne	NPFFR1	44	37
CC[C@@H](C)CONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208048	CE	On-Demand	Anodyne	SIGMAR1	40	38
CC[C@@H](C)CONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208048	CE	On-Demand	Anodyne	NPFFR1	44	37
CC[C@H](C)CONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208049	CE	On-Demand	Anodyne	SIGMAR1	40	38
CC[C@H](C)CONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208049	CE	On-Demand	Anodyne	NPFFR1	44	37
CC[C@@H](C)CONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208050	CE	On-Demand	Anodyne	SIGMAR1	40	38
CC[C@@H](C)CONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872208050	CE	On-Demand	Anodyne	NPFFR1	44	37
C=Cc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208209	CD	On-Demand	Anodyne	ADRB2	30	41
C=Cc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208209	CD	On-Demand	Anodyne	ADRB1	36	41
C=Cc1ccc(CCNC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208209	CD	On-Demand	Anodyne	ADRB3	34	41
C=Cc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872208210	CD	On-Demand	Anodyne	ADRB2	30	41
C=Cc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872208210	CD	On-Demand	Anodyne	ADRB1	36	41
C=Cc1ccc(CCNC[C@H](O)CC(C)(C)O)cc1	ZINC000872208210	CD	On-Demand	Anodyne	ADRB3	34	41
Cc1nnc(CCNC[C@@]2(O)CCN(Cc3ccccc3)C2)s1	ZINC000872208271	ED	On-Demand	Anodyne	NPFFR1	41	39
Cc1nnc(CCNC[C@]2(O)CCN(Cc3ccccc3)C2)s1	ZINC000872208272	ED	On-Demand	Anodyne	NPFFR1	41	39
Cc1cc(Cl)nc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208333	EF	On-Demand	Anodyne	NPFFR1	41	35
Cc1cc(Cl)nc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208334	EF	On-Demand	Anodyne	NPFFR1	41	35
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	DRD2	15	42
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	DRD4	32	42
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	ACHE	44	41
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	GRIN2B	47	41
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	SIGMAR1	67	44
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	NPFFR2	37	40
COC(=O)N1CCC(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208348	FD	On-Demand	Anodyne	NPFFR1	48	40
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	DRD2	15	42
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	DRD4	32	42
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	ACHE	44	41
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	GRIN2B	47	41
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	SIGMAR1	67	44
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	NPFFR2	37	40
COC(=O)N1CCC(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872208353	FD	On-Demand	Anodyne	NPFFR1	48	40
C#C[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C(C)C	ZINC000872208364	CD	On-Demand	Mild	NPFFR1	45	38
C#C[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C(C)C	ZINC000872208366	CD	On-Demand	Mild	NPFFR1	45	38
C#C[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C(C)C	ZINC000872208367	CD	On-Demand	Mild	NPFFR1	45	38
C#C[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C(C)C	ZINC000872208369	CD	On-Demand	Mild	NPFFR1	45	38
COC(=O)Nc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208380	FF	On-Demand	Anodyne	HTR1D	21	42
COC(=O)Nc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208380	FF	On-Demand	Anodyne	HTR1B	17	42
COC(=O)Nc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208380	FF	On-Demand	Anodyne	SIGMAR1	40	38
COC(=O)Nc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208380	FF	On-Demand	Anodyne	NPFFR2	37	42
COC(=O)Nc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208380	FF	On-Demand	Anodyne	NPFFR1	48	42
COC(=O)Nc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208382	FF	On-Demand	Anodyne	HTR1D	21	42
COC(=O)Nc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208382	FF	On-Demand	Anodyne	HTR1B	17	42
COC(=O)Nc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208382	FF	On-Demand	Anodyne	SIGMAR1	40	38
COC(=O)Nc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208382	FF	On-Demand	Anodyne	NPFFR2	37	42
COC(=O)Nc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872208382	FF	On-Demand	Anodyne	NPFFR1	48	42
COc1ccc([C@@H](Cc2ccccc2)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208478	EG	On-Demand	Anodyne	ADRB2	18	55
COc1ccc([C@@H](Cc2ccccc2)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208478	EG	On-Demand	Anodyne	ADRB3	31	55
COc1ccc([C@H](Cc2ccccc2)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208479	EG	On-Demand	Anodyne	ADRB2	18	55
COc1ccc([C@H](Cc2ccccc2)NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872208479	EG	On-Demand	Anodyne	ADRB3	31	55
COc1ccc([C@H](Cc2ccccc2)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872208480	EG	On-Demand	Anodyne	ADRB2	18	55
COc1ccc([C@H](Cc2ccccc2)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872208480	EG	On-Demand	Anodyne	ADRB3	31	55
COc1ccc([C@@H](Cc2ccccc2)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872208482	EG	On-Demand	Anodyne	ADRB2	18	55
COc1ccc([C@@H](Cc2ccccc2)NC[C@H](O)CC(C)(C)O)cc1	ZINC000872208482	EG	On-Demand	Anodyne	ADRB3	31	55
N#Cc1ccc(CNC[C@H](O)COc2cc(Cl)cc(Cl)c2)nc1	ZINC000872208484	FF	On-Demand	Mild	ADRB1	40	32
N#Cc1ccc(CNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)nc1	ZINC000872208489	FF	On-Demand	Mild	ADRB1	40	32
Cc1nnc(CCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208525	FF	On-Demand	Anodyne	ADRB2	36	44
Cc1nnc(CCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208525	FF	On-Demand	Anodyne	ADRB1	47	41
Cc1nnc(CCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208525	FF	On-Demand	Anodyne	ADRB3	35	41
Cc1nnc(CCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208526	FF	On-Demand	Anodyne	ADRB2	36	44
Cc1nnc(CCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208526	FF	On-Demand	Anodyne	ADRB1	47	41
Cc1nnc(CCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)s1	ZINC000872208526	FF	On-Demand	Anodyne	ADRB3	35	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208811	FD	On-Demand	Anodyne	DRD4	15	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208811	FD	On-Demand	Anodyne	ACHE	15	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208811	FD	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208811	FD	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208811	FD	On-Demand	Anodyne	CCR3	17	47
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208812	FD	On-Demand	Anodyne	DRD4	15	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208812	FD	On-Demand	Anodyne	ACHE	15	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208812	FD	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208812	FD	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)CC(C)(C)O)CC2)cc1	ZINC000872208812	FD	On-Demand	Anodyne	CCR3	17	47
O[C@H](CNOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872208829	DF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNOC1CCC1)COc1cc(Cl)cc(Cl)c1	ZINC000872208830	DF	On-Demand	Anodyne	ADRB1	29	42
COC(=O)c1ccc(CCNC[C@@H](O)CC(C)(C)O)c(OC)c1	ZINC000872208837	ED	On-Demand	Anodyne	ADRB2	15	44
COC(=O)c1ccc(CCNC[C@H](O)CC(C)(C)O)c(OC)c1	ZINC000872208838	ED	On-Demand	Anodyne	ADRB2	15	44
O[C@]1(CNOCC2CC2)CCN(Cc2ccccc2)C1	ZINC000872208976	CD	On-Demand	Anodyne	SIGMAR1	77	46
O[C@]1(CNOCC2CC2)CCN(Cc2ccccc2)C1	ZINC000872208976	CD	On-Demand	Anodyne	NPFFR1	42	39
O[C@@]1(CNOCC2CC2)CCN(Cc2ccccc2)C1	ZINC000872208977	CD	On-Demand	Anodyne	SIGMAR1	77	46
O[C@@]1(CNOCC2CC2)CCN(Cc2ccccc2)C1	ZINC000872208977	CD	On-Demand	Anodyne	NPFFR1	42	39
C[C@H](NC[C@H](O)CC(C)(C)O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872208980	DD	On-Demand	Anodyne	CTSK	15	44
C[C@H](NC[C@H](O)CC(C)(C)O)[C@H](C)NC(=O)OC(C)(C)C	ZINC000872208986	DD	On-Demand	Anodyne	CTSK	15	44
C=C(CNC[C@@H](O)CC(C)(C)O)c1ccccc1	ZINC000872209046	BD	On-Demand	Mild	AOC3	32	44
C=C(CNC[C@H](O)CC(C)(C)O)c1ccccc1	ZINC000872209048	BD	On-Demand	Mild	AOC3	32	44
O[C@H](CNOCC1CC1)COc1cc(Cl)cc(Cl)c1	ZINC000872209062	DF	On-Demand	Anodyne	ADRB1	16	44
O[C@@H](CNOCC1CC1)COc1cc(Cl)cc(Cl)c1	ZINC000872209063	DF	On-Demand	Anodyne	ADRB1	16	44
O[C@]1(CNOC/C=C/Cl)CCN(Cc2ccccc2)C1	ZINC000872209077	CD	On-Demand	Anodyne	SIGMAR1	42	36
O[C@]1(CNOC/C=C/Cl)CCN(Cc2ccccc2)C1	ZINC000872209077	CD	On-Demand	Anodyne	NPFFR1	41	37
O[C@@]1(CNOC/C=C/Cl)CCN(Cc2ccccc2)C1	ZINC000872209078	CD	On-Demand	Anodyne	SIGMAR1	42	36
O[C@@]1(CNOC/C=C/Cl)CCN(Cc2ccccc2)C1	ZINC000872209078	CD	On-Demand	Anodyne	NPFFR1	41	37
O[C@@]1(CNOC/C=C\Cl)CCN(Cc2ccccc2)C1	ZINC000872209079	CD	On-Demand	Anodyne	SIGMAR1	42	36
O[C@@]1(CNOC/C=C\Cl)CCN(Cc2ccccc2)C1	ZINC000872209079	CD	On-Demand	Anodyne	NPFFR1	41	37
O[C@]1(CNOC/C=C\Cl)CCN(Cc2ccccc2)C1	ZINC000872209080	CD	On-Demand	Anodyne	SIGMAR1	42	36
O[C@]1(CNOC/C=C\Cl)CCN(Cc2ccccc2)C1	ZINC000872209080	CD	On-Demand	Anodyne	NPFFR1	41	37
C[C@@H](CCCc1cccnc1)NC[C@H](O)CC(C)(C)O	ZINC000872209103	CD	On-Demand	Anodyne	PTAFR	30	44
C[C@@H](CCCc1cccnc1)NC[C@@H](O)CC(C)(C)O	ZINC000872209110	CD	On-Demand	Anodyne	PTAFR	30	44
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209242	EF	On-Demand	Anodyne	SIGMAR1	44	38
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209242	EF	On-Demand	Anodyne	NPFFR1	47	39
C[C@@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209243	EF	On-Demand	Anodyne	SIGMAR1	44	38
C[C@@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209243	EF	On-Demand	Anodyne	NPFFR1	47	39
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209244	EF	On-Demand	Anodyne	SIGMAR1	44	38
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209244	EF	On-Demand	Anodyne	NPFFR1	47	39
C[C@@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209245	EF	On-Demand	Anodyne	SIGMAR1	44	38
C[C@@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1(Cl)Cl	ZINC000872209245	EF	On-Demand	Anodyne	NPFFR1	47	39
COCCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209290	CD	On-Demand	Anodyne	SIGMAR1	52	38
COCCCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209290	CD	On-Demand	Anodyne	NPFFR1	41	37
COCCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209291	CD	On-Demand	Anodyne	SIGMAR1	52	38
COCCCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209291	CD	On-Demand	Anodyne	NPFFR1	41	37
C[C@@H]1[C@@H](NC[C@H](O)CC(C)(C)O)CCN1Cc1ccccc1	ZINC000872209320	DD	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H]1[C@@H](NC[C@@H](O)CC(C)(C)O)CCN1Cc1ccccc1	ZINC000872209323	DD	On-Demand	Anodyne	SIGMAR1	15	40
Cn1ncc(CCCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209550	FE	On-Demand	Anodyne	ADRB2	21	40
Cn1ncc(CCCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209550	FE	On-Demand	Anodyne	ADRB1	31	40
Cn1ncc(CCCNC[C@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209550	FE	On-Demand	Anodyne	ADRB3	24	40
Cn1ncc(CCCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209553	FE	On-Demand	Anodyne	ADRB2	21	40
Cn1ncc(CCCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209553	FE	On-Demand	Anodyne	ADRB1	31	40
Cn1ncc(CCCNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)n1	ZINC000872209553	FE	On-Demand	Anodyne	ADRB3	24	40
O[C@]1(CNOC2CCC2)CCN(Cc2ccccc2)C1	ZINC000872209572	CD	On-Demand	Anodyne	SIGMAR1	68	41
O[C@]1(CNOC2CCC2)CCN(Cc2ccccc2)C1	ZINC000872209572	CD	On-Demand	Anodyne	NPFFR1	43	40
O[C@@]1(CNOC2CCC2)CCN(Cc2ccccc2)C1	ZINC000872209573	CD	On-Demand	Anodyne	SIGMAR1	68	41
O[C@@]1(CNOC2CCC2)CCN(Cc2ccccc2)C1	ZINC000872209573	CD	On-Demand	Anodyne	NPFFR1	43	40
CC[C@@H](CNC[C@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872209613	DD	On-Demand	Anodyne	CTSK	16	50
CC[C@@H](CNC[C@@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872209614	DD	On-Demand	Anodyne	CTSK	16	50
C=CCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209718	CD	On-Demand	Mild	SIGMAR1	52	41
C=CCONC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209718	CD	On-Demand	Mild	NPFFR1	42	38
C=CCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209719	CD	On-Demand	Mild	SIGMAR1	52	41
C=CCONC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872209719	CD	On-Demand	Mild	NPFFR1	42	38
C#Cc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872209832	DE	On-Demand	Mild	NPFFR1	41	36
C#Cc1cccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872209833	DE	On-Demand	Mild	NPFFR1	41	36
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872209899	DD	On-Demand	Anodyne	ACE	19	40
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872209899	DD	On-Demand	Anodyne	TPP2	66	40
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872209900	DD	On-Demand	Anodyne	ACE	19	40
C[C@H](NC[C@H](O)CC(C)(C)O)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872209900	DD	On-Demand	Anodyne	TPP2	66	40
CC(=O)N1CCc2cc(NC[C@@H](O)CC(C)(C)O)ccc21	ZINC000872209928	CD	On-Demand	Anodyne	HSD17B3	49	40
CC(=O)N1CCc2cc(NC[C@H](O)CC(C)(C)O)ccc21	ZINC000872209929	CD	On-Demand	Anodyne	HSD17B3	49	40
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)C1CC1	ZINC000872209944	FD	On-Demand	Anodyne	ADRB2	32	43
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)C1CC1	ZINC000872209944	FD	On-Demand	Anodyne	ADRB1	59	41
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1)C1CC1	ZINC000872209945	FD	On-Demand	Anodyne	ADRB2	32	43
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)cc(Cl)c1)C1CC1	ZINC000872209945	FD	On-Demand	Anodyne	ADRB1	59	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)CC2(O)CCOCC2)C1	ZINC000872210036	FC	On-Demand	Anodyne	TGM2	28	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)CC2(O)CCOCC2)C1	ZINC000872210036	FC	On-Demand	Anodyne	F13A1	28	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)CC2(O)CCOCC2)C1	ZINC000872210037	FC	On-Demand	Anodyne	TGM2	28	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)CC2(O)CCOCC2)C1	ZINC000872210037	FC	On-Demand	Anodyne	F13A1	28	41
COc1ccc(N2CC[C@H](CNC[C@@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210064	GF	On-Demand	Clean	DRD4	21	40
COc1ccc(N2CC[C@H](CNC[C@@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210064	GF	On-Demand	Clean	ACHE	25	43
COc1ccc(N2CC[C@H](CNC[C@@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210064	GF	On-Demand	Clean	SIGMAR1	42	46
COc1ccc(N2CC[C@H](CNC[C@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210067	GF	On-Demand	Clean	DRD4	21	40
COc1ccc(N2CC[C@H](CNC[C@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210067	GF	On-Demand	Clean	ACHE	25	43
COc1ccc(N2CC[C@H](CNC[C@]3(O)CCN(Cc4ccccc4)C3)C2)cc1	ZINC000872210067	GF	On-Demand	Clean	SIGMAR1	42	46
CC(=O)Nc1cccc(NC[C@H](O)CC(C)(C)O)c1	ZINC000872210092	CD	On-Demand	Anodyne	KCNK3	94	35
CC(=O)Nc1cccc(NC[C@H](O)CC(C)(C)O)c1	ZINC000872210092	CD	On-Demand	Anodyne	KCNK9	66	35
CC(=O)Nc1cccc(NC[C@@H](O)CC(C)(C)O)c1	ZINC000872210093	CD	On-Demand	Anodyne	KCNK3	94	35
CC(=O)Nc1cccc(NC[C@@H](O)CC(C)(C)O)c1	ZINC000872210093	CD	On-Demand	Anodyne	KCNK9	66	35
C[C@@](O)(C[C@H](O)CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000872210098	EH	On-Demand	Anodyne	LTA4H	21	43
C[C@@](O)(C[C@@H](O)CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000872210099	EH	On-Demand	Anodyne	LTA4H	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210129	GE	On-Demand	Anodyne	NPFFR1	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210130	GE	On-Demand	Anodyne	NPFFR1	41	35
CCOc1ccccc1NC[C@H](O)CC1(O)CCOCC1	ZINC000872210150	CD	On-Demand	Clean	HCN1	48	40
CCOc1ccccc1NC[C@@H](O)CC1(O)CCOCC1	ZINC000872210151	CD	On-Demand	Clean	HCN1	48	40
O[C@H](CNc1ccc(N2CCCCCC2)cc1)CC1(O)CCOCC1	ZINC000872210192	EF	On-Demand	Anodyne	STAT6	42	31
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)CC1(O)CCOCC1	ZINC000872210193	EF	On-Demand	Anodyne	STAT6	42	31
O[C@]1(CNc2ccc3c(c2)OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210208	EF	On-Demand	Anodyne	SIGMAR1	40	40
O[C@]1(CNc2ccc3c(c2)OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210208	EF	On-Demand	Anodyne	NPFFR1	48	39
O[C@@]1(CNc2ccc3c(c2)OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210209	EF	On-Demand	Anodyne	SIGMAR1	40	40
O[C@@]1(CNc2ccc3c(c2)OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210209	EF	On-Demand	Anodyne	NPFFR1	48	39
C[C@@](O)(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210211	ED	On-Demand	Anodyne	GRIN2B	21	42
C[C@@](O)(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210211	ED	On-Demand	Anodyne	AMY2	43	30
C[C@@](O)(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210211	ED	On-Demand	Anodyne	CAPN2	44	32
C[C@@](O)(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210211	ED	On-Demand	Anodyne	TGM2	36	41
C[C@@](O)(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210211	ED	On-Demand	Anodyne	F13A1	30	41
C[C@@](O)(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210213	ED	On-Demand	Anodyne	GRIN2B	21	42
C[C@@](O)(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210213	ED	On-Demand	Anodyne	AMY2	43	30
C[C@@](O)(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210213	ED	On-Demand	Anodyne	CAPN2	44	32
C[C@@](O)(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210213	ED	On-Demand	Anodyne	TGM2	36	41
C[C@@](O)(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872210213	ED	On-Demand	Anodyne	F13A1	30	41
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872210214	EC	On-Demand	Anodyne	SIGMAR1	46	38
O=S(=O)(CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872210214	EC	On-Demand	Anodyne	NPFFR1	42	41
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872210215	EC	On-Demand	Anodyne	SIGMAR1	46	38
O=S(=O)(CCNC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872210215	EC	On-Demand	Anodyne	NPFFR1	42	41
O[C@@H](CNc1ccc(N2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872210272	EE	On-Demand	Anodyne	STAT6	42	31
O[C@H](CNc1ccc(N2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872210273	EE	On-Demand	Anodyne	STAT6	42	31
CCOc1ccccc1NC[C@H](O)CC(C)(C)O	ZINC000872210308	CE	On-Demand	Clean	ADRB2	17	41
CCOc1ccccc1NC[C@@H](O)CC(C)(C)O	ZINC000872210309	CE	On-Demand	Clean	ADRB2	17	41
O=C1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)[C@H](c2ccccc2)N1	ZINC000872210324	GE	On-Demand	Anodyne	SIGMAR1	47	38
O=C1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)[C@H](c2ccccc2)N1	ZINC000872210325	GE	On-Demand	Anodyne	SIGMAR1	47	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210356	FD	On-Demand	Anodyne	NPFFR1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210357	FD	On-Demand	Anodyne	NPFFR1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210358	FD	On-Demand	Anodyne	NPFFR1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872210359	FD	On-Demand	Anodyne	NPFFR1	42	36
COc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210454	FF	On-Demand	Anodyne	ACHE	18	48
COc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210454	FF	On-Demand	Anodyne	SIGMAR1	45	48
COc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210454	FF	On-Demand	Anodyne	NPFFR2	35	41
COc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210454	FF	On-Demand	Anodyne	NPFFR1	47	41
COc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210455	FF	On-Demand	Anodyne	ACHE	18	48
COc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210455	FF	On-Demand	Anodyne	SIGMAR1	45	48
COc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210455	FF	On-Demand	Anodyne	NPFFR2	35	41
COc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	ZINC000872210455	FF	On-Demand	Anodyne	NPFFR1	47	41
CC(=O)N1CCCc2cc(NC[C@@H](O)CC(C)(C)O)ccc21	ZINC000872210550	DD	On-Demand	Anodyne	AVPR2	17	40
CC(=O)N1CCCc2cc(NC[C@@H](O)CC(C)(C)O)ccc21	ZINC000872210550	DD	On-Demand	Anodyne	HSD17B3	49	40
CC(=O)N1CCCc2cc(NC[C@H](O)CC(C)(C)O)ccc21	ZINC000872210551	DD	On-Demand	Anodyne	AVPR2	17	40
CC(=O)N1CCCc2cc(NC[C@H](O)CC(C)(C)O)ccc21	ZINC000872210551	DD	On-Demand	Anodyne	HSD17B3	49	40
COc1cccc(Oc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)c1	ZINC000872210562	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(Oc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)c1	ZINC000872210562	EG	On-Demand	Anodyne	MTNR1B	28	51
COc1cccc(Oc2ccc(NC[C@H](O)CC(C)(C)O)cc2)c1	ZINC000872210563	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(Oc2ccc(NC[C@H](O)CC(C)(C)O)cc2)c1	ZINC000872210563	EG	On-Demand	Anodyne	MTNR1B	28	51
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)CC1(O)CCOCC1	ZINC000872210618	FD	On-Demand	Anodyne	NPY2R	52	34
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)CC1(O)CCOCC1	ZINC000872210619	FD	On-Demand	Anodyne	NPY2R	52	34
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CC(C)(C)O	ZINC000872210648	FG	On-Demand	Mild	MAOB	22	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CC(C)(C)O	ZINC000872210648	FG	On-Demand	Mild	FFAR1	24	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CC(C)(C)O	ZINC000872210649	FG	On-Demand	Mild	MAOB	22	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CC(C)(C)O	ZINC000872210649	FG	On-Demand	Mild	FFAR1	24	44
Cc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c(OCC(=O)N(C)C)c1	ZINC000872210663	GF	On-Demand	Anodyne	NPFFR1	40	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C[C@](C)(O)C1CC1	ZINC000872210740	FE	On-Demand	Anodyne	L3MBTL3	58	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000872210741	FE	On-Demand	Anodyne	L3MBTL3	58	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C[C@@](C)(O)C1CC1	ZINC000872210742	FE	On-Demand	Anodyne	L3MBTL3	58	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C[C@](C)(O)C1CC1	ZINC000872210743	FE	On-Demand	Anodyne	L3MBTL3	58	36
COc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210762	GE	On-Demand	Anodyne	ACHE	23	42
COc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210762	GE	On-Demand	Anodyne	NPFFR2	34	40
COc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210762	GE	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210762	GE	On-Demand	Anodyne	NPFFR1	45	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210763	GE	On-Demand	Anodyne	ACHE	23	42
COc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210763	GE	On-Demand	Anodyne	NPFFR2	34	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210763	GE	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210763	GE	On-Demand	Anodyne	NPFFR1	45	40
C[C@@](O)(C[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000872210780	GH	On-Demand	Anodyne	ERBB2	37	41
C[C@@](O)(C[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000872210783	GH	On-Demand	Anodyne	ERBB2	37	41
COCCOc1ccccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210784	FF	On-Demand	Anodyne	NPFFR1	42	38
COCCOc1ccccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210784	FF	On-Demand	Anodyne	HCN1	60	33
COCCOc1ccccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210784	FF	On-Demand	Anodyne	HCN4	48	32
COCCOc1ccccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210785	FF	On-Demand	Anodyne	NPFFR1	42	38
COCCOc1ccccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210785	FF	On-Demand	Anodyne	HCN1	60	33
COCCOc1ccccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872210785	FF	On-Demand	Anodyne	HCN4	48	32
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CC(C)(C)O	ZINC000872210802	FD	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CC(C)(C)O	ZINC000872210803	FD	On-Demand	Anodyne	LRRK2	34	44
O[C@]1(CNc2cccc3c2OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210812	EF	On-Demand	Anodyne	SIGMAR1	29	40
O[C@@]1(CNc2cccc3c2OCCO3)CCN(Cc2ccccc2)C1	ZINC000872210813	EF	On-Demand	Anodyne	SIGMAR1	29	40
COCCOc1ccccc1NC[C@@H](O)COC(C)C	ZINC000872210852	CD	On-Demand	Clean	ADRB2	28	43
COCCOc1ccccc1NC[C@H](O)COC(C)C	ZINC000872210853	CD	On-Demand	Clean	ADRB2	28	43
C[C@@](O)(C[C@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1)C1CC1	ZINC000872210894	FD	On-Demand	Anodyne	NPY2R	42	36
C[C@@](O)(C[C@@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1)C1CC1	ZINC000872210897	FD	On-Demand	Anodyne	NPY2R	42	36
Cc1ccc(NC[C@H](O)CC(C)(C)O)cc1NS(C)(=O)=O	ZINC000872210900	DD	On-Demand	Anodyne	GRIN1	18	41
Cc1ccc(NC[C@@H](O)CC(C)(C)O)cc1NS(C)(=O)=O	ZINC000872210901	DD	On-Demand	Anodyne	GRIN1	18	41
CN(C)CCOc1ccc(NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872210970	CD	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@H](O)CC(C)(C)O)cc1	ZINC000872210971	CD	On-Demand	Anodyne	ESRRG	47	35
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C[C@](C)(O)C3CC3)cc2)C1	ZINC000872211040	FF	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C[C@](C)(O)C3CC3)cc2)C1	ZINC000872211040	FF	On-Demand	Anodyne	EBP	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C[C@@](C)(O)C3CC3)cc2)C1	ZINC000872211041	FF	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C[C@@](C)(O)C3CC3)cc2)C1	ZINC000872211041	FF	On-Demand	Anodyne	EBP	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C[C@@](C)(O)C3CC3)cc2)C1	ZINC000872211042	FF	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C[C@@](C)(O)C3CC3)cc2)C1	ZINC000872211042	FF	On-Demand	Anodyne	EBP	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C[C@](C)(O)C3CC3)cc2)C1	ZINC000872211043	FF	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C[C@](C)(O)C3CC3)cc2)C1	ZINC000872211043	FF	On-Demand	Anodyne	EBP	17	43
CCOC(=O)N(C)c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211064	GG	On-Demand	Anodyne	SIGMAR1	21	41
CCOC(=O)N(C)c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211064	GG	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N(C)c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211064	GG	On-Demand	Anodyne	NPFFR1	50	41
CCOC(=O)N(C)c1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211065	GG	On-Demand	Anodyne	SIGMAR1	21	41
CCOC(=O)N(C)c1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211065	GG	On-Demand	Anodyne	NPFFR2	40	41
CCOC(=O)N(C)c1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211065	GG	On-Demand	Anodyne	NPFFR1	50	41
O[C@@]1(CNc2ccc(N3CCOCC3)c(F)c2)CCN(Cc2ccccc2)C1	ZINC000872211082	GF	On-Demand	Anodyne	NPY2R	46	34
O[C@]1(CNc2ccc(N3CCOCC3)c(F)c2)CCN(Cc2ccccc2)C1	ZINC000872211083	GF	On-Demand	Anodyne	NPY2R	46	34
Cc1ccc(NC[C@@H](O)CC(C)(C)O)cc1NC(=O)c1ccncc1	ZINC000872211094	EF	On-Demand	Anodyne	MAPK14	24	42
Cc1ccc(NC[C@H](O)CC(C)(C)O)cc1NC(=O)c1ccncc1	ZINC000872211095	EF	On-Demand	Anodyne	MAPK14	24	42
C[C@@](O)(C[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000872211104	ED	On-Demand	Anodyne	NPY2R	72	40
C[C@@](O)(C[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000872211105	ED	On-Demand	Anodyne	NPY2R	72	40
C[C@@](O)(C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000872211116	EG	On-Demand	Anodyne	NPY2R	57	41
C[C@@](O)(C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000872211117	EG	On-Demand	Anodyne	NPY2R	57	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211156	EE	On-Demand	Anodyne	ESR1	23	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211156	EE	On-Demand	Anodyne	HRH3	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211156	EE	On-Demand	Anodyne	EBP	19	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211157	EE	On-Demand	Anodyne	ESR1	23	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211157	EE	On-Demand	Anodyne	HRH3	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(C)(C)O)cc2)C1	ZINC000872211157	EE	On-Demand	Anodyne	EBP	19	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211158	EE	On-Demand	Anodyne	ESR1	23	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211158	EE	On-Demand	Anodyne	HRH3	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211158	EE	On-Demand	Anodyne	EBP	19	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211159	EE	On-Demand	Anodyne	ESR1	23	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211159	EE	On-Demand	Anodyne	HRH3	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)C1	ZINC000872211159	EE	On-Demand	Anodyne	EBP	19	45
C[C@@](O)(C[C@@H](O)CNc1ccc(OCC(F)F)cc1)C1CC1	ZINC000872211162	DF	On-Demand	Anodyne	ADRB1	28	40
C[C@@](O)(C[C@H](O)CNc1ccc(OCC(F)F)cc1)C1CC1	ZINC000872211163	DF	On-Demand	Anodyne	ADRB1	28	40
CN(C)CCCOc1ccc(NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872211168	DD	On-Demand	Anodyne	ESRRG	42	30
CN(C)CCCOc1ccc(NC[C@H](O)CC(C)(C)O)cc1	ZINC000872211169	DD	On-Demand	Anodyne	ESRRG	42	30
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC3(O)CCOCC3)cc2)C1	ZINC000872211204	GE	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC3(O)CCOCC3)cc2)C1	ZINC000872211205	GE	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC3(O)CCOCC3)cc2)C1	ZINC000872211206	GE	On-Demand	Anodyne	ESR1	26	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC3(O)CCOCC3)cc2)C1	ZINC000872211207	GE	On-Demand	Anodyne	ESR1	26	42
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CC(C)(C)O	ZINC000872211228	FF	On-Demand	Anodyne	HCN1	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CC(C)(C)O	ZINC000872211228	FF	On-Demand	Anodyne	HCN4	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CC(C)(C)O	ZINC000872211229	FF	On-Demand	Anodyne	HCN1	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CC(C)(C)O	ZINC000872211229	FF	On-Demand	Anodyne	HCN4	40	32
CC(C)(O)COc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211230	FF	On-Demand	Anodyne	NPFFR1	41	36
CC(C)(O)COc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211231	FF	On-Demand	Anodyne	NPFFR1	41	36
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)C[C@](C)(O)C3CC3)ccc21	ZINC000872211260	GH	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)C[C@](C)(O)C3CC3)ccc21	ZINC000872211261	GH	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)C[C@@](C)(O)C3CC3)ccc21	ZINC000872211262	GH	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)C[C@@](C)(O)C3CC3)ccc21	ZINC000872211263	GH	On-Demand	Anodyne	GPR119	22	44
CN1CCN(c2ccc(NC[C@H](O)C[C@](C)(O)C3CC3)cc2Cl)CC1	ZINC000872211264	FE	On-Demand	Anodyne	NPY2R	52	40
CN1CCN(c2ccc(NC[C@H](O)C[C@@](C)(O)C3CC3)cc2Cl)CC1	ZINC000872211267	FE	On-Demand	Anodyne	NPY2R	52	40
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC1(O)CCOCC1	ZINC000872211270	GG	On-Demand	Anodyne	ERBB2	37	42
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC1(O)CCOCC1	ZINC000872211271	GG	On-Demand	Anodyne	ERBB2	37	42
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	HTR1D	23	40
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	HTR1B	17	40
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	SIGMAR1	40	38
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	NPFFR2	38	43
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	NPFFR1	50	43
COCCOC(=O)Nc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211277	GF	On-Demand	Anodyne	KCNK3	42	33
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C[C@](C)(O)C1CC1	ZINC000872211278	GD	On-Demand	Anodyne	LRRK2	33	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000872211279	GD	On-Demand	Anodyne	LRRK2	33	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C[C@@](C)(O)C1CC1	ZINC000872211280	GD	On-Demand	Anodyne	LRRK2	33	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C[C@](C)(O)C1CC1	ZINC000872211281	GD	On-Demand	Anodyne	LRRK2	33	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)C[C@@](C)(O)C3CC3)ccc21	ZINC000872211308	GG	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)C[C@@](C)(O)C3CC3)ccc21	ZINC000872211309	GG	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)C[C@](C)(O)C3CC3)ccc21	ZINC000872211310	GG	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)C[C@](C)(O)C3CC3)ccc21	ZINC000872211311	GG	On-Demand	Anodyne	GPR119	22	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)CC(C)(C)O)c1	ZINC000872211313	DD	On-Demand	Anodyne	KCNK3	50	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)CC(C)(C)O)c1	ZINC000872211313	DD	On-Demand	Anodyne	KCNK9	45	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)CC(C)(C)O)c1	ZINC000872211315	DD	On-Demand	Anodyne	KCNK3	50	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)CC(C)(C)O)c1	ZINC000872211315	DD	On-Demand	Anodyne	KCNK9	45	35
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	ESR1	78	37
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	ESR2	56	39
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	LTA4H	55	47
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	HRH3	61	46
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	PSMB2	47	44
C[C@@](O)(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211372	FF	On-Demand	Anodyne	PSMB1	53	49
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	ESR1	78	37
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	ESR2	56	39
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	LTA4H	55	47
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	HRH3	61	46
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	PSMB2	47	44
C[C@@](O)(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000872211374	FF	On-Demand	Anodyne	PSMB1	53	49
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	ESR1	81	38
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	ESR2	59	38
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	LTA4H	46	47
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	HRH3	42	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	PSMB2	46	45
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211424	GE	On-Demand	Anodyne	PSMB1	50	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	ESR1	81	38
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	ESR2	59	38
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	LTA4H	46	47
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	HRH3	42	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	PSMB2	46	45
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC1(O)CCOCC1	ZINC000872211428	GE	On-Demand	Anodyne	PSMB1	50	43
Cc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1N1CCOC1=O	ZINC000872211457	GG	On-Demand	Anodyne	NPFFR1	42	36
OC[C@H](O)c1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211474	ED	On-Demand	Anodyne	NPFFR1	43	37
OC[C@@H](O)c1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211479	ED	On-Demand	Anodyne	NPFFR1	43	37
OC[C@H](O)c1cccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211480	ED	On-Demand	Anodyne	NPFFR1	43	37
OC[C@@H](O)c1cccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872211481	ED	On-Demand	Anodyne	NPFFR1	43	37
Cc1nc2cc(NC[C@H](O)CC(C)(C)O)ccc2s1	ZINC000872211484	CF	On-Demand	Anodyne	ACOX1	87	37
Cc1nc2cc(NC[C@@H](O)CC(C)(C)O)ccc2s1	ZINC000872211485	CF	On-Demand	Anodyne	ACOX1	87	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C[C@](C)(O)C1CC1	ZINC000872211524	GG	On-Demand	Anodyne	L3MBTL3	46	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C[C@](C)(O)C1CC1	ZINC000872211525	GG	On-Demand	Anodyne	L3MBTL3	46	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000872211526	GG	On-Demand	Anodyne	L3MBTL3	46	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C[C@@](C)(O)C1CC1	ZINC000872211527	GG	On-Demand	Anodyne	L3MBTL3	46	34
Cc1nc2cc(NC[C@@H](O)C[C@](C)(O)C3CC3)ccc2s1	ZINC000872211549	DF	On-Demand	Anodyne	ACOX1	87	36
Cc1nc2cc(NC[C@H](O)C[C@](C)(O)C3CC3)ccc2s1	ZINC000872211552	DF	On-Demand	Anodyne	ACOX1	87	36
Cc1nc2cc(NC[C@H](O)C[C@@](C)(O)C3CC3)ccc2s1	ZINC000872211554	DF	On-Demand	Anodyne	ACOX1	87	36
Cc1nc2cc(NC[C@@H](O)C[C@@](C)(O)C3CC3)ccc2s1	ZINC000872211556	DF	On-Demand	Anodyne	ACOX1	87	36
COC(=O)NCc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211595	FF	On-Demand	Anodyne	SIGMAR1	45	42
COC(=O)NCc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211595	FF	On-Demand	Anodyne	NPFFR2	42	42
COC(=O)NCc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211595	FF	On-Demand	Anodyne	NPFFR1	53	44
COC(=O)NCc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211595	FF	On-Demand	Anodyne	PDS	42	33
COC(=O)NCc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211596	FF	On-Demand	Anodyne	SIGMAR1	45	42
COC(=O)NCc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211596	FF	On-Demand	Anodyne	NPFFR2	42	42
COC(=O)NCc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211596	FF	On-Demand	Anodyne	NPFFR1	53	44
COC(=O)NCc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872211596	FF	On-Demand	Anodyne	PDS	42	33
O[C@]1(CNc2ccc(OC3COC3)cc2)CCN(Cc2ccccc2)C1	ZINC000872211657	FF	On-Demand	Anodyne	NPFFR1	40	35
O[C@@]1(CNc2ccc(OC3COC3)cc2)CCN(Cc2ccccc2)C1	ZINC000872211658	FF	On-Demand	Anodyne	NPFFR1	40	35
CCOc1cc(O)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211763	EF	On-Demand	Anodyne	DRD4	15	40
CCOc1cc(O)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211763	EF	On-Demand	Anodyne	NPFFR1	41	36
CCOc1cc(O)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211763	EF	On-Demand	Anodyne	HCN1	55	34
CCOc1cc(O)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211763	EF	On-Demand	Anodyne	HCN4	43	34
CCOc1cc(O)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211764	EF	On-Demand	Anodyne	DRD4	15	40
CCOc1cc(O)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211764	EF	On-Demand	Anodyne	NPFFR1	41	36
CCOc1cc(O)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211764	EF	On-Demand	Anodyne	HCN1	55	34
CCOc1cc(O)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872211764	EF	On-Demand	Anodyne	HCN4	43	34
C[C@@](O)(C[C@H](O)CNc1ccc(OCC2CC2)cc1)C1CC1	ZINC000872211909	DF	On-Demand	Anodyne	ADRB1	17	40
C[C@@](O)(C[C@@H](O)CNc1ccc(OCC2CC2)cc1)C1CC1	ZINC000872211910	DF	On-Demand	Anodyne	ADRB1	17	40
Cc1nc2cc(NC[C@@H](O)COC(C)C)ccc2s1	ZINC000872212078	CF	On-Demand	Anodyne	ACOX1	94	40
Cc1nc2cc(NC[C@H](O)COC(C)C)ccc2s1	ZINC000872212079	CF	On-Demand	Anodyne	ACOX1	94	40
CCCOc1ccccc1NC[C@@H](O)COC(C)C	ZINC000872212148	CF	On-Demand	Clean	ADRB2	28	43
CCCOc1ccccc1NC[C@H](O)COC(C)C	ZINC000872212149	CF	On-Demand	Clean	ADRB2	28	43
Cc1cc(-c2ccccc2)ccc1NC[C@@H](O)CC(C)(C)O	ZINC000872212178	CH	On-Demand	Anodyne	SLC1A1	15	47
Cc1cc(-c2ccccc2)ccc1NC[C@H](O)CC(C)(C)O	ZINC000872212179	CH	On-Demand	Anodyne	SLC1A1	15	47
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)CC1(O)CCOCC1	ZINC000872212202	EE	On-Demand	Anodyne	NPY2R	48	35
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)CC1(O)CCOCC1	ZINC000872212203	EE	On-Demand	Anodyne	NPY2R	48	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212224	GF	On-Demand	Anodyne	NPFFR1	42	36
CCOc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212224	GF	On-Demand	Anodyne	HCN1	55	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212224	GF	On-Demand	Anodyne	HCN4	43	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212225	GF	On-Demand	Anodyne	NPFFR1	42	36
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212225	GF	On-Demand	Anodyne	HCN1	55	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212225	GF	On-Demand	Anodyne	HCN4	43	35
C[C@@](O)(C[C@@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000872212228	FG	On-Demand	Anodyne	NPY2R	49	39
C[C@@](O)(C[C@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000872212229	FG	On-Demand	Anodyne	NPY2R	49	39
CC(=O)N(Cc1ccc(NC[C@@H](O)COC(C)C)cc1)C1CC1	ZINC000872212236	DE	On-Demand	Anodyne	ADRB1	15	40
CC(=O)N(Cc1ccc(NC[C@H](O)COC(C)C)cc1)C1CC1	ZINC000872212237	DE	On-Demand	Anodyne	ADRB1	15	40
COC(=O)NCc1ccc(NC[C@H](O)CC(C)(C)O)cc1	ZINC000872212250	CD	On-Demand	Anodyne	PDS	41	33
COC(=O)NCc1ccc(NC[C@@H](O)CC(C)(C)O)cc1	ZINC000872212251	CD	On-Demand	Anodyne	PDS	41	33
CN(C)CCOc1ccc(NC[C@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872212268	DD	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872212269	DD	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@H](O)C[C@@](C)(O)C2CC2)cc1	ZINC000872212270	DD	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@@H](O)C[C@](C)(O)C2CC2)cc1	ZINC000872212271	DD	On-Demand	Anodyne	ESRRG	43	32
COCCOc1cc(NC[C@H](O)CC(C)(C)O)ccc1OC	ZINC000872212452	DD	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)CC(C)(C)O)ccc1OC	ZINC000872212453	DD	On-Demand	Anodyne	DRTS_TRYCR	50	36
O[C@]1(CNc2ccc3c(c2)CCO3)CCN(Cc2ccccc2)C1	ZINC000872212468	DF	On-Demand	Anodyne	SIGMAR1	29	42
O[C@]1(CNc2ccc3c(c2)CCO3)CCN(Cc2ccccc2)C1	ZINC000872212468	DF	On-Demand	Anodyne	NPFFR1	44	38
O[C@@]1(CNc2ccc3c(c2)CCO3)CCN(Cc2ccccc2)C1	ZINC000872212469	DF	On-Demand	Anodyne	SIGMAR1	29	42
O[C@@]1(CNc2ccc3c(c2)CCO3)CCN(Cc2ccccc2)C1	ZINC000872212469	DF	On-Demand	Anodyne	NPFFR1	44	38
Cc1cc(-n2cccn2)ccc1NC[C@@H](O)CC(C)(C)O	ZINC000872212492	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
Cc1cc(-n2cccn2)ccc1NC[C@H](O)CC(C)(C)O	ZINC000872212493	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
N#CCOc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212506	FF	On-Demand	Mild	NPFFR1	42	35
N#CCOc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212507	FF	On-Demand	Mild	NPFFR1	42	35
Cc1nc2cc(NC[C@H](O)CC3(O)CCOCC3)ccc2s1	ZINC000872212512	DE	On-Demand	Anodyne	ACOX1	84	35
Cc1nc2cc(NC[C@@H](O)CC3(O)CCOCC3)ccc2s1	ZINC000872212513	DE	On-Demand	Anodyne	ACOX1	84	35
O[C@@H]1CCOc2c(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cccc21	ZINC000872212532	FF	On-Demand	Anodyne	SIGMAR1	29	40
O[C@H]1CCOc2c(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cccc21	ZINC000872212533	FF	On-Demand	Anodyne	SIGMAR1	29	40
O[C@H]1CCOc2c(NC[C@]3(O)CCN(Cc4ccccc4)C3)cccc21	ZINC000872212534	FF	On-Demand	Anodyne	SIGMAR1	29	40
O[C@@H]1CCOc2c(NC[C@]3(O)CCN(Cc4ccccc4)C3)cccc21	ZINC000872212535	FF	On-Demand	Anodyne	SIGMAR1	29	40
O=C1OCCN1Cc1cccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872212576	GF	On-Demand	Anodyne	NPFFR1	45	36
O=C1OCCN1Cc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872212577	GF	On-Demand	Anodyne	NPFFR1	45	36
COc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212588	EF	On-Demand	Anodyne	ACHE	31	42
COc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212588	EF	On-Demand	Anodyne	SIGMAR1	64	42
COc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212588	EF	On-Demand	Anodyne	CCR3	34	41
COc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212588	EF	On-Demand	Anodyne	NPFFR2	31	41
COc1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212588	EF	On-Demand	Anodyne	NPFFR1	42	41
COc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212589	EF	On-Demand	Anodyne	ACHE	31	42
COc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212589	EF	On-Demand	Anodyne	SIGMAR1	64	42
COc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212589	EF	On-Demand	Anodyne	CCR3	34	41
COc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212589	EF	On-Demand	Anodyne	NPFFR2	31	41
COc1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872212589	EF	On-Demand	Anodyne	NPFFR1	42	41
C[C@@](O)(C[C@H](O)CNc1ccccc1OCC(F)F)C1CC1	ZINC000872212613	DF	On-Demand	Clean	ADRB2	16	40
C[C@@](O)(C[C@@H](O)CNc1ccccc1OCC(F)F)C1CC1	ZINC000872212617	DF	On-Demand	Clean	ADRB2	16	40
CNC(=O)COc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000872212645	GE	On-Demand	Anodyne	NPFFR1	44	39
CNC(=O)COc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000872212646	GE	On-Demand	Anodyne	NPFFR1	44	39
CO[C@H]1Cc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212667	FF	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@H]1Cc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212667	FF	On-Demand	Anodyne	NPFFR1	40	37
CO[C@@H]1Cc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212668	FF	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@@H]1Cc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212668	FF	On-Demand	Anodyne	NPFFR1	40	37
CO[C@H]1Cc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212669	FF	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@H]1Cc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212669	FF	On-Demand	Anodyne	NPFFR1	40	37
CO[C@@H]1Cc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212670	FF	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@@H]1Cc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2C1	ZINC000872212670	FF	On-Demand	Anodyne	NPFFR1	40	37
CC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1C	ZINC000872212687	FG	On-Demand	Anodyne	ACHE	18	40
CC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1C	ZINC000872212687	FG	On-Demand	Anodyne	NPFFR1	48	39
CC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1C	ZINC000872212688	FG	On-Demand	Anodyne	ACHE	18	40
CC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1C	ZINC000872212688	FG	On-Demand	Anodyne	NPFFR1	48	39
O[C@]1(CNc2cccc3c2OCO3)CCN(Cc2ccccc2)C1	ZINC000872212723	EE	On-Demand	Anodyne	SIGMAR1	28	40
O[C@@]1(CNc2cccc3c2OCO3)CCN(Cc2ccccc2)C1	ZINC000872212725	EE	On-Demand	Anodyne	SIGMAR1	28	40
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	SIGMAR1	36	44
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	NPFFR2	41	42
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	TIMP3	47	32
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	NPFFR1	52	42
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	NOD1	15	41
CCOC(=O)Nc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212846	FG	On-Demand	Anodyne	NOD2	43	41
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	SIGMAR1	36	44
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	NPFFR2	41	42
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	TIMP3	47	32
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	NPFFR1	52	42
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	NOD1	15	41
CCOC(=O)Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212847	FG	On-Demand	Anodyne	NOD2	43	41
OC1CCN(c2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212862	GF	On-Demand	Anodyne	SIGMAR1	43	39
OC1CCN(c2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212862	GF	On-Demand	Anodyne	STAT6	17	41
OC1CCN(c2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212862	GF	On-Demand	Anodyne	NPFFR1	41	39
OC1CCN(c2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212863	GF	On-Demand	Anodyne	SIGMAR1	43	39
OC1CCN(c2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212863	GF	On-Demand	Anodyne	STAT6	17	41
OC1CCN(c2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212863	GF	On-Demand	Anodyne	NPFFR1	41	39
C[C@@](O)(C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000872212932	DF	On-Demand	Anodyne	NPY2R	79	41
C[C@@](O)(C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000872212933	DF	On-Demand	Anodyne	NPY2R	79	41
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	LTA4H	49	43
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	HRH3	15	41
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	SIGMAR1	45	40
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	MMP13	17	44
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	NPFFR2	34	40
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	FAAH	15	40
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	NPFFR1	45	40
COCCOc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212950	FF	On-Demand	Anodyne	NOD2	40	38
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	LTA4H	49	43
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	HRH3	15	41
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	SIGMAR1	45	40
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	MMP13	17	44
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	NPFFR2	34	40
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	FAAH	15	40
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	NPFFR1	45	40
COCCOc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872212951	FF	On-Demand	Anodyne	NOD2	40	38
CN1CCCN(c2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212989	GF	On-Demand	Anodyne	NPFFR1	40	35
CN1CCCN(c2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872212992	GF	On-Demand	Anodyne	NPFFR1	40	35
O=C1OCCN1Cc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872213017	GF	On-Demand	Anodyne	NPFFR1	44	39
O=C1OCCN1Cc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872213019	GF	On-Demand	Anodyne	NPFFR1	44	39
COCCOc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213047	GF	On-Demand	Anodyne	ACHE	16	43
COCCOc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213047	GF	On-Demand	Anodyne	SIGMAR1	32	40
COCCOc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213047	GF	On-Demand	Anodyne	NPFFR2	34	42
COCCOc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213047	GF	On-Demand	Anodyne	NPFFR1	46	42
COCCOc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213047	GF	On-Demand	Anodyne	DRTS_TRYCR	48	35
COCCOc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213049	GF	On-Demand	Anodyne	ACHE	16	43
COCCOc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213049	GF	On-Demand	Anodyne	SIGMAR1	32	40
COCCOc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213049	GF	On-Demand	Anodyne	NPFFR2	34	42
COCCOc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213049	GF	On-Demand	Anodyne	NPFFR1	46	42
COCCOc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872213049	GF	On-Demand	Anodyne	DRTS_TRYCR	48	35
C#Cc1cccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872213051	DF	On-Demand	Mild	NPFFR1	47	38
C#Cc1cccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000872213052	DF	On-Demand	Mild	NPFFR1	47	38
O[C@@H](CNC[C@H](O)CC1(O)CCOCC1)COc1cccc(F)c1	ZINC000872213105	EC	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNC[C@@H](O)CC1(O)CCOCC1)COc1cccc(F)c1	ZINC000872213106	EC	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNC[C@H](O)CC1(O)CCOCC1)COc1cccc(F)c1	ZINC000872213107	EC	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNC[C@@H](O)COc1cccc(F)c1)CC1(O)CCOCC1	ZINC000872213110	EC	On-Demand	Anodyne	ADRB2	19	41
COc1ccc2cc(NC[C@H](O)COC(C)C)ccc2c1	ZINC000872213213	CG	On-Demand	Anodyne	ADRB2	23	45
COc1ccc2cc(NC[C@@H](O)COC(C)C)ccc2c1	ZINC000872213214	CG	On-Demand	Anodyne	ADRB2	23	45
O[C@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213261	FD	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213261	FD	On-Demand	Anodyne	ADRB1	35	40
O[C@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213261	FD	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213262	FD	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213262	FD	On-Demand	Anodyne	ADRB1	35	40
O[C@@H](CNC[C@@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213262	FD	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213263	FD	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213263	FD	On-Demand	Anodyne	ADRB1	35	40
O[C@@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213263	FD	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213264	FD	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213264	FD	On-Demand	Anodyne	ADRB1	35	40
O[C@H](CNC[C@]1(O)CCN(Cc2ccccc2)C1)COc1cccc(F)c1	ZINC000872213264	FD	On-Demand	Anodyne	ADRB3	27	40
O=C1C[C@H](Oc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213277	FD	On-Demand	Anodyne	SIGMAR1	42	37
O=C1C[C@H](Oc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213277	FD	On-Demand	Anodyne	NPFFR1	41	36
O=C1C[C@@H](Oc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213278	FD	On-Demand	Anodyne	SIGMAR1	42	37
O=C1C[C@@H](Oc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213278	FD	On-Demand	Anodyne	NPFFR1	41	36
O=C1C[C@@H](Oc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213279	FD	On-Demand	Anodyne	SIGMAR1	42	37
O=C1C[C@@H](Oc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213279	FD	On-Demand	Anodyne	NPFFR1	41	36
O=C1C[C@H](Oc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213280	FD	On-Demand	Anodyne	SIGMAR1	42	37
O=C1C[C@H](Oc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)N1	ZINC000872213280	FD	On-Demand	Anodyne	NPFFR1	41	36
O[C@@H](CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(F)(F)F	ZINC000872213309	EE	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNC[C@H](O)C(F)(F)F)COc1cc(Cl)cc(Cl)c1	ZINC000872213310	EE	On-Demand	Anodyne	ADRB2	24	41
C[C@H](O)c1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1F	ZINC000872213328	EF	On-Demand	Anodyne	NPFFR1	43	37
C[C@H](O)c1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1F	ZINC000872213330	EF	On-Demand	Anodyne	NPFFR1	43	37
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@@H](O)c1ccccc1	ZINC000872213349	FG	On-Demand	Anodyne	ADRB2	20	64
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@@H](O)c1ccccc1	ZINC000872213349	FG	On-Demand	Anodyne	ADRB3	29	42
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@@H](O)c1ccccc1	ZINC000872213349	FG	On-Demand	Anodyne	AOC3	17	45
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@H](O)c1ccccc1	ZINC000872213350	FG	On-Demand	Anodyne	ADRB2	20	64
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@H](O)c1ccccc1	ZINC000872213350	FG	On-Demand	Anodyne	ADRB3	29	42
C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)[C@H](O)c1ccccc1	ZINC000872213350	FG	On-Demand	Anodyne	AOC3	17	45
OC1(c2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)COC1	ZINC000872213515	FD	On-Demand	Anodyne	NPFFR1	42	38
OC1(c2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)COC1	ZINC000872213516	FD	On-Demand	Anodyne	NPFFR1	42	38
O[C@]1(CNc2ccccc2OCCF)CCN(Cc2ccccc2)C1	ZINC000872213604	EG	On-Demand	Anodyne	NPFFR1	42	38
O[C@@]1(CNc2ccccc2OCCF)CCN(Cc2ccccc2)C1	ZINC000872213605	EG	On-Demand	Anodyne	NPFFR1	42	38
O[C@@H](CNc1ccc(Cl)cc1OCc1ccccc1)CC1(O)CCOCC1	ZINC000872213684	GH	On-Demand	Anodyne	PTGER1	48	39
O[C@H](CNc1ccc(Cl)cc1OCc1ccccc1)CC1(O)CCOCC1	ZINC000872213685	GH	On-Demand	Anodyne	PTGER1	48	39
CC[C@@H](NC[C@H](O)COC(C)C)[C@H](C)O	ZINC000872213762	BC	On-Demand	Anodyne	ADRB2	15	63
CC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](C)O	ZINC000872213763	BC	On-Demand	Anodyne	ADRB2	15	63
CC[C@@H](NC[C@@H](O)COC(C)C)[C@H](C)O	ZINC000872213764	BC	On-Demand	Anodyne	ADRB2	15	63
CC[C@@H](NC[C@H](O)COC(C)C)[C@@H](C)O	ZINC000872213765	BC	On-Demand	Anodyne	ADRB2	15	63
COC[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213842	DD	On-Demand	Anodyne	ADRB2	37	48
COC[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213842	DD	On-Demand	Anodyne	ADRB1	44	42
COC[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213842	DD	On-Demand	Anodyne	ADRB3	23	40
COC[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213843	DD	On-Demand	Anodyne	ADRB2	37	48
COC[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213843	DD	On-Demand	Anodyne	ADRB1	44	42
COC[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872213843	DD	On-Demand	Anodyne	ADRB3	23	40
OC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213874	CC	On-Demand	Anodyne	SIGMAR1	50	42
OC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213874	CC	On-Demand	Anodyne	NPFFR1	41	36
OC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213875	CC	On-Demand	Anodyne	SIGMAR1	50	42
OC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213875	CC	On-Demand	Anodyne	NPFFR1	41	36
OC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213876	CC	On-Demand	Anodyne	SIGMAR1	50	42
OC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213876	CC	On-Demand	Anodyne	NPFFR1	41	36
OC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213877	CC	On-Demand	Anodyne	SIGMAR1	50	42
OC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872213877	CC	On-Demand	Anodyne	NPFFR1	41	36
COc1cccc([C@H](CO)NC[C@@H](O)CC(C)(C)O)c1	ZINC000872213905	CC	On-Demand	Anodyne	CASR	18	40
COc1cccc([C@H](CO)NC[C@H](O)CC(C)(C)O)c1	ZINC000872213906	CC	On-Demand	Anodyne	CASR	18	40
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214009	GD	On-Demand	Anodyne	SIGMAR1	26	42
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214009	GD	On-Demand	Anodyne	NPFFR2	34	40
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214009	GD	On-Demand	Anodyne	NPFFR1	45	39
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214010	GD	On-Demand	Anodyne	SIGMAR1	26	42
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214010	GD	On-Demand	Anodyne	NPFFR2	34	40
CC(C)(C)OC(=O)NC[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214010	GD	On-Demand	Anodyne	NPFFR1	45	39
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214011	GD	On-Demand	Anodyne	SIGMAR1	26	42
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214011	GD	On-Demand	Anodyne	NPFFR2	34	40
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214011	GD	On-Demand	Anodyne	NPFFR1	45	39
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214012	GD	On-Demand	Anodyne	SIGMAR1	26	42
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214012	GD	On-Demand	Anodyne	NPFFR2	34	40
CC(C)(C)OC(=O)NC[C@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214012	GD	On-Demand	Anodyne	NPFFR1	45	39
OCC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccs1	ZINC000872214057	EE	On-Demand	Anodyne	SIGMAR1	19	41
OCC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cccs1	ZINC000872214058	EE	On-Demand	Anodyne	SIGMAR1	19	41
OCC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccs1	ZINC000872214059	EE	On-Demand	Anodyne	SIGMAR1	19	41
OCC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cccs1	ZINC000872214060	EE	On-Demand	Anodyne	SIGMAR1	19	41
OCC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214536	DD	On-Demand	Anodyne	SIGMAR1	43	38
OCC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214536	DD	On-Demand	Anodyne	NPFFR1	40	35
OCC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214537	DD	On-Demand	Anodyne	SIGMAR1	43	38
OCC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214537	DD	On-Demand	Anodyne	NPFFR1	40	35
OCC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214538	DD	On-Demand	Anodyne	SIGMAR1	43	38
OCC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214538	DD	On-Demand	Anodyne	NPFFR1	40	35
OCC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214539	DD	On-Demand	Anodyne	SIGMAR1	43	38
OCC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)C1CC1	ZINC000872214539	DD	On-Demand	Anodyne	NPFFR1	40	35
CCC[C@H](NC[C@@H](O)CC(C)(C)O)[C@H](O)c1ccccc1	ZINC000872214685	CE	On-Demand	Anodyne	AOC3	15	43
CCC[C@H](NC[C@@H](O)CC(C)(C)O)[C@@H](O)c1ccccc1	ZINC000872214686	CE	On-Demand	Anodyne	AOC3	15	43
CCC[C@H](NC[C@H](O)CC(C)(C)O)[C@H](O)c1ccccc1	ZINC000872214687	CE	On-Demand	Anodyne	AOC3	15	43
CCC[C@H](NC[C@H](O)CC(C)(C)O)[C@@H](O)c1ccccc1	ZINC000872214688	CE	On-Demand	Anodyne	AOC3	15	43
O[C@H](c1ccccc1)C1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872214729	FF	On-Demand	Anodyne	NPFFR1	41	36
O[C@H](c1ccccc1)C1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872214730	FF	On-Demand	Anodyne	NPFFR1	41	36
O[C@@H](c1ccccc1)C1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872214731	FF	On-Demand	Anodyne	NPFFR1	41	36
O[C@@H](c1ccccc1)C1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872214732	FF	On-Demand	Anodyne	NPFFR1	41	36
CCC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872214787	CE	On-Demand	Anodyne	ADRB2	23	46
CCC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872214787	CE	On-Demand	Anodyne	CASR	23	41
CCC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872214788	CE	On-Demand	Anodyne	ADRB2	23	46
CCC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872214788	CE	On-Demand	Anodyne	CASR	23	41
CCC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872214789	CE	On-Demand	Anodyne	ADRB2	23	46
CCC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872214789	CE	On-Demand	Anodyne	CASR	23	41
CCC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872214790	CE	On-Demand	Anodyne	ADRB2	23	46
CCC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872214790	CE	On-Demand	Anodyne	CASR	23	41
O[C@@H]1c2ccccc2OC[C@@H]1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214829	FD	On-Demand	Anodyne	SIGMAR1	30	42
O[C@@H]1c2ccccc2OC[C@H]1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214830	FD	On-Demand	Anodyne	SIGMAR1	30	42
O[C@@H]1c2ccccc2OC[C@H]1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214831	FD	On-Demand	Anodyne	SIGMAR1	30	42
O[C@@H]1c2ccccc2OC[C@@H]1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872214832	FD	On-Demand	Anodyne	SIGMAR1	30	42
O[C@@H](CNC[C@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215035	FE	On-Demand	Anodyne	ADRB2	35	46
O[C@@H](CNC[C@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215035	FE	On-Demand	Anodyne	ADRB1	43	39
O[C@@H](CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccccn1	ZINC000872215036	FE	On-Demand	Anodyne	ADRB2	35	46
O[C@@H](CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccccn1	ZINC000872215036	FE	On-Demand	Anodyne	ADRB1	43	39
O[C@H](CNC[C@@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215037	FE	On-Demand	Anodyne	ADRB2	35	46
O[C@H](CNC[C@@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215037	FE	On-Demand	Anodyne	ADRB1	43	39
O[C@@H](CNC[C@@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215038	FE	On-Demand	Anodyne	ADRB2	35	46
O[C@@H](CNC[C@@H](O)c1ccccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872215038	FE	On-Demand	Anodyne	ADRB1	43	39
C#C[C@H](CO)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215089	CC	On-Demand	Mild	NPFFR1	41	36
C#C[C@@H](CO)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215090	CC	On-Demand	Mild	NPFFR1	41	36
C#C[C@H](CO)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215091	CC	On-Demand	Mild	NPFFR1	41	36
C#C[C@@H](CO)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215092	CC	On-Demand	Mild	NPFFR1	41	36
C#CCC[C@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215135	EE	On-Demand	Mild	ADRB2	18	40
C#CCC[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215136	EE	On-Demand	Mild	ADRB2	18	40
C#CCC[C@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215137	EE	On-Demand	Mild	ADRB2	18	40
C#CCC[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215138	EE	On-Demand	Mild	ADRB2	18	40
C#CCC[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215173	DC	On-Demand	Mild	NPFFR1	40	35
C#CCC[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215174	DC	On-Demand	Mild	NPFFR1	40	35
C#CCC[C@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215175	DC	On-Demand	Mild	NPFFR1	40	35
C#CCC[C@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215176	DC	On-Demand	Mild	NPFFR1	40	35
OCC[C@@H](Cc1ccccc1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215193	FE	On-Demand	Anodyne	NPFFR1	43	36
OCC[C@H](Cc1ccccc1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215194	FE	On-Demand	Anodyne	NPFFR1	43	36
OCC[C@@H](Cc1ccccc1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215195	FE	On-Demand	Anodyne	NPFFR1	43	36
OCC[C@H](Cc1ccccc1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215196	FE	On-Demand	Anodyne	NPFFR1	43	36
C[C@H](C[C@@H](O)c1cccs1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215199	FF	On-Demand	Anodyne	SIGMAR1	20	47
C[C@H](C[C@@H](O)c1cccs1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215200	FF	On-Demand	Anodyne	SIGMAR1	20	47
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215233	FF	On-Demand	Anodyne	SLC6A3	19	40
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215233	FF	On-Demand	Anodyne	SIGMAR1	27	47
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215234	FF	On-Demand	Anodyne	SLC6A3	19	40
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215234	FF	On-Demand	Anodyne	SIGMAR1	27	47
C[C@H](C[C@@H](O)c1ccco1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215297	EE	On-Demand	Anodyne	SIGMAR1	17	47
C[C@H](C[C@@H](O)c1ccco1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215298	EE	On-Demand	Anodyne	SIGMAR1	17	47
CNC(=O)[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215326	DB	On-Demand	Anodyne	NPFFR2	39	41
CNC(=O)[C@@H](O)CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215326	DB	On-Demand	Anodyne	NPFFR1	50	41
CNC(=O)[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215327	DB	On-Demand	Anodyne	NPFFR2	39	41
CNC(=O)[C@@H](O)CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872215327	DB	On-Demand	Anodyne	NPFFR1	50	41
CC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1c(F)cccc1F	ZINC000872215365	DE	On-Demand	Anodyne	ADRB2	18	45
CC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1c(F)cccc1F	ZINC000872215366	DE	On-Demand	Anodyne	ADRB2	18	45
CC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1c(F)cccc1F	ZINC000872215367	DE	On-Demand	Anodyne	ADRB2	18	45
CC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1c(F)cccc1F	ZINC000872215368	DE	On-Demand	Anodyne	ADRB2	18	45
CNC(=O)[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215386	EC	On-Demand	Anodyne	ADRB2	37	46
CNC(=O)[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215386	EC	On-Demand	Anodyne	ADRB1	53	38
CNC(=O)[C@@H](O)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215386	EC	On-Demand	Anodyne	GRIN1	15	40
CNC(=O)[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215387	EC	On-Demand	Anodyne	ADRB2	37	46
CNC(=O)[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215387	EC	On-Demand	Anodyne	ADRB1	53	38
CNC(=O)[C@@H](O)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215387	EC	On-Demand	Anodyne	GRIN1	15	40
COc1cccc(Nc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)c1	ZINC000872215573	EG	On-Demand	Clean	MTNR1A	19	51
COc1cccc(Nc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)c1	ZINC000872215573	EG	On-Demand	Clean	MTNR1B	24	51
COc1cccc(Nc2ccc(NC[C@@H](O)CC(C)(C)O)cc2)c1	ZINC000872215573	EG	On-Demand	Clean	AKR1C3	23	44
COc1cccc(Nc2ccc(NC[C@H](O)CC(C)(C)O)cc2)c1	ZINC000872215574	EG	On-Demand	Clean	MTNR1A	19	51
COc1cccc(Nc2ccc(NC[C@H](O)CC(C)(C)O)cc2)c1	ZINC000872215574	EG	On-Demand	Clean	MTNR1B	24	51
COc1cccc(Nc2ccc(NC[C@H](O)CC(C)(C)O)cc2)c1	ZINC000872215574	EG	On-Demand	Clean	AKR1C3	23	44
CC(=O)N(C)c1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872215611	FE	On-Demand	Anodyne	MCHR2	40	32
CC(=O)N(C)c1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872215611	FE	On-Demand	Anodyne	NPFFR1	45	40
CC(=O)N(C)c1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872215612	FE	On-Demand	Anodyne	MCHR2	40	32
CC(=O)N(C)c1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872215612	FE	On-Demand	Anodyne	NPFFR1	45	40
O[C@]1(CNCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872215723	DE	On-Demand	Anodyne	SIGMAR1	52	38
O[C@]1(CNCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872215723	DE	On-Demand	Anodyne	NPFFR1	41	37
O[C@@]1(CNCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872215724	DE	On-Demand	Anodyne	SIGMAR1	52	38
O[C@@]1(CNCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872215724	DE	On-Demand	Anodyne	NPFFR1	41	37
Cn1nccc1C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000872215735	GD	On-Demand	Anodyne	SIGMAR1	40	41
Cn1nccc1C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000872215735	GD	On-Demand	Anodyne	NPFFR1	42	36
Cn1nccc1C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000872215736	GD	On-Demand	Anodyne	SIGMAR1	40	41
Cn1nccc1C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000872215736	GD	On-Demand	Anodyne	NPFFR1	42	36
C#CC[C@H](CCOC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215749	EF	On-Demand	Mild	ADRB1	16	44
C#CC[C@@H](CCOC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215750	EF	On-Demand	Mild	ADRB1	16	44
C#CC[C@H](CCOC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215751	EF	On-Demand	Mild	ADRB1	16	44
C#CC[C@@H](CCOC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872215752	EF	On-Demand	Mild	ADRB1	16	44
COC(=O)C1=CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872215827	ED	On-Demand	Anodyne	SIGMAR1	51	42
COC(=O)C1=CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872215827	ED	On-Demand	Anodyne	NPFFR1	45	41
C[C@@H](CCNC[C@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872215839	DD	On-Demand	Anodyne	CTSK	17	43
C[C@@H](CCNC[C@@H](O)CC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000872215840	DD	On-Demand	Anodyne	CTSK	17	43
OC1CCN(c2ccc(CNC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872215853	GE	On-Demand	Clean	SLC18A3	18	40
OC1CCN(c2ccc(CNC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872215853	GE	On-Demand	Clean	NPFFR1	40	38
OC1CCN(c2ccc(CNC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872215854	GE	On-Demand	Clean	SLC18A3	18	40
OC1CCN(c2ccc(CNC[C@]3(O)CCN(Cc4ccccc4)C3)cc2)CC1	ZINC000872215854	GE	On-Demand	Clean	NPFFR1	40	38
COC(=O)C1=CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872215930	ED	On-Demand	Anodyne	SIGMAR1	51	42
COC(=O)C1=CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872215930	ED	On-Demand	Anodyne	NPFFR1	45	41
CCOC(=O)C1=CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216019	ED	On-Demand	Anodyne	SIGMAR1	34	42
CCOC(=O)C1=CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216019	ED	On-Demand	Anodyne	NPFFR2	40	40
CCOC(=O)C1=CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216019	ED	On-Demand	Anodyne	NPFFR1	50	40
CCOC(=O)C1=CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216020	ED	On-Demand	Anodyne	SIGMAR1	34	42
CCOC(=O)C1=CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216020	ED	On-Demand	Anodyne	NPFFR2	40	40
CCOC(=O)C1=CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216020	ED	On-Demand	Anodyne	NPFFR1	50	40
CCOC(=O)C1=CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216021	ED	On-Demand	Anodyne	SIGMAR1	34	42
CCOC(=O)C1=CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216021	ED	On-Demand	Anodyne	NPFFR2	40	40
CCOC(=O)C1=CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216021	ED	On-Demand	Anodyne	NPFFR1	50	40
CCOC(=O)C1=CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216022	ED	On-Demand	Anodyne	SIGMAR1	34	42
CCOC(=O)C1=CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216022	ED	On-Demand	Anodyne	NPFFR2	40	40
CCOC(=O)C1=CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216022	ED	On-Demand	Anodyne	NPFFR1	50	40
O[C@]1(CNCCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872216075	EE	On-Demand	Anodyne	SIGMAR1	41	37
O[C@]1(CNCCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872216075	EE	On-Demand	Anodyne	NPFFR1	40	38
O[C@@]1(CNCCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872216076	EE	On-Demand	Anodyne	SIGMAR1	41	37
O[C@@]1(CNCCC2SCCS2)CCN(Cc2ccccc2)C1	ZINC000872216076	EE	On-Demand	Anodyne	NPFFR1	40	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216281	GD	On-Demand	Anodyne	NPFFR1	42	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872216282	GD	On-Demand	Anodyne	NPFFR1	42	38
O=C1Nc2ccc(NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2CO1	ZINC000872216425	FF	On-Demand	Anodyne	NPFFR1	40	36
O=C1Nc2ccc(NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2CO1	ZINC000872216426	FF	On-Demand	Anodyne	NPFFR1	40	36
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C[C@@H]1Br	ZINC000872216431	FE	On-Demand	Reactive	SIGMAR1	67	39
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C[C@@H]1Br	ZINC000872216431	FE	On-Demand	Reactive	NPFFR1	44	39
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)C[C@H]1Br	ZINC000872216432	FE	On-Demand	Reactive	SIGMAR1	67	39
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)C[C@H]1Br	ZINC000872216432	FE	On-Demand	Reactive	NPFFR1	44	39
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)C[C@@H]1Br	ZINC000872216433	FE	On-Demand	Reactive	SIGMAR1	67	39
C[C@]1(CNC[C@]2(O)CCN(Cc3ccccc3)C2)C[C@@H]1Br	ZINC000872216433	FE	On-Demand	Reactive	NPFFR1	44	39
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C[C@H]1Br	ZINC000872216434	FE	On-Demand	Reactive	SIGMAR1	67	39
C[C@]1(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C[C@H]1Br	ZINC000872216434	FE	On-Demand	Reactive	NPFFR1	44	39
COC(=O)N(C)CCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872216475	DC	On-Demand	Anodyne	SIGMAR1	49	39
COC(=O)N(C)CCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872216475	DC	On-Demand	Anodyne	NPFFR1	46	40
COC(=O)N(C)CCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872216476	DC	On-Demand	Anodyne	SIGMAR1	49	39
COC(=O)N(C)CCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872216476	DC	On-Demand	Anodyne	NPFFR1	46	40
O[C@H](CNCc1ncccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872216544	EE	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNCc1ncccn1)COc1cc(Cl)cc(Cl)c1	ZINC000872216546	EE	On-Demand	Anodyne	ADRB2	27	42
C[C@@H](NC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccns1	ZINC000872216586	EH	On-Demand	Anodyne	ADRB2	25	43
C[C@@H](NC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccns1	ZINC000872216586	EH	On-Demand	Anodyne	ADRB1	21	40
C[C@H](NC[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccns1	ZINC000872216588	EH	On-Demand	Anodyne	ADRB2	25	43
C[C@H](NC[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccns1	ZINC000872216588	EH	On-Demand	Anodyne	ADRB1	21	40
C#CC[C@@H](COC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216641	EE	On-Demand	Mild	ADRB2	18	46
C#CC[C@@H](COC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216641	EE	On-Demand	Mild	ADRB1	19	43
C#CC[C@H](COC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216642	EE	On-Demand	Mild	ADRB2	18	46
C#CC[C@H](COC)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216642	EE	On-Demand	Mild	ADRB1	19	43
C#CC[C@@H](COC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216643	EE	On-Demand	Mild	ADRB2	18	46
C#CC[C@@H](COC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216643	EE	On-Demand	Mild	ADRB1	19	43
C#CC[C@H](COC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216644	EE	On-Demand	Mild	ADRB2	18	46
C#CC[C@H](COC)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872216644	EE	On-Demand	Mild	ADRB1	19	43
O[C@]1(CNc2cccc3c2OCC3)CCN(Cc2ccccc2)C1	ZINC000872216649	DF	On-Demand	Anodyne	SIGMAR1	28	45
O[C@]1(CNc2cccc3c2OCC3)CCN(Cc2ccccc2)C1	ZINC000872216649	DF	On-Demand	Anodyne	NPFFR1	41	38
O[C@@]1(CNc2cccc3c2OCC3)CCN(Cc2ccccc2)C1	ZINC000872216650	DF	On-Demand	Anodyne	SIGMAR1	28	45
O[C@@]1(CNc2cccc3c2OCC3)CCN(Cc2ccccc2)C1	ZINC000872216650	DF	On-Demand	Anodyne	NPFFR1	41	38
N#Cc1ccc([C@@H](O)CN[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000872216683	DH	On-Demand	Mild	GRIA4	17	46
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216693	EF	On-Demand	Anodyne	ADRB2	42	42
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216693	EF	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216693	EF	On-Demand	Anodyne	ADRB3	43	42
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216694	EF	On-Demand	Anodyne	ADRB2	42	42
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216694	EF	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216694	EF	On-Demand	Anodyne	ADRB3	43	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216695	EF	On-Demand	Anodyne	ADRB2	42	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216695	EF	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216695	EF	On-Demand	Anodyne	ADRB3	43	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216696	EF	On-Demand	Anodyne	ADRB2	42	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216696	EF	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216696	EF	On-Demand	Anodyne	ADRB3	43	42
O[C@]1(CNCC[C@@H]2CCSC2)CCN(Cc2ccccc2)C1	ZINC000872216698	DE	On-Demand	Anodyne	ACHE	25	40
O[C@@]1(CNCC[C@@H]2CCSC2)CCN(Cc2ccccc2)C1	ZINC000872216699	DE	On-Demand	Anodyne	ACHE	25	40
O[C@]1(CNCC[C@H]2CCSC2)CCN(Cc2ccccc2)C1	ZINC000872216700	DE	On-Demand	Anodyne	ACHE	25	40
O[C@@]1(CNCC[C@H]2CCSC2)CCN(Cc2ccccc2)C1	ZINC000872216701	DE	On-Demand	Anodyne	ACHE	25	40
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C)Cc2ccncc2)c1	ZINC000872216722	JH	On-Demand	Anodyne	LIMK2	20	41
O[C@H](CNCC[C@@H]1CCSC1)COc1ccccc1C(F)(F)F	ZINC000872216746	EG	On-Demand	Anodyne	ADRB1	54	35
O[C@@H](CNCC[C@@H]1CCSC1)COc1ccccc1C(F)(F)F	ZINC000872216747	EG	On-Demand	Anodyne	ADRB1	54	35
O[C@H](CNCC[C@H]1CCSC1)COc1ccccc1C(F)(F)F	ZINC000872216748	EG	On-Demand	Anodyne	ADRB1	54	35
O[C@@H](CNCC[C@H]1CCSC1)COc1ccccc1C(F)(F)F	ZINC000872216749	EG	On-Demand	Anodyne	ADRB1	54	35
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216750	DE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216750	DE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216750	DE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216751	DE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216751	DE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216751	DE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216752	DE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216752	DE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216752	DE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216753	DE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216753	DE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216753	DE	On-Demand	Anodyne	ADRB3	48	43
O[C@@H](CN[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1cccnc1	ZINC000872216799	DF	On-Demand	Anodyne	ADRB3	51	41
CN(Cc1ccncc1)C(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1Cl	ZINC000872216827	IH	On-Demand	Anodyne	HSD17B2	15	41
CN(Cc1ccncc1)C(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1Cl	ZINC000872216827	IH	On-Demand	Anodyne	LIMK2	29	46
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1	ZINC000872216832	FG	On-Demand	Bother	SLC27A4	43	32
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1	ZINC000872216833	FG	On-Demand	Bother	SLC27A4	43	32
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216841	EE	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216841	EE	On-Demand	Anodyne	ADRB1	90	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216841	EE	On-Demand	Anodyne	GRIN1	15	41
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216841	EE	On-Demand	Anodyne	ADRB3	58	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216842	EE	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216842	EE	On-Demand	Anodyne	ADRB1	90	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216842	EE	On-Demand	Anodyne	GRIN1	15	41
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216842	EE	On-Demand	Anodyne	ADRB3	58	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216843	EE	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216843	EE	On-Demand	Anodyne	ADRB1	90	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216843	EE	On-Demand	Anodyne	GRIN1	15	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872216843	EE	On-Demand	Anodyne	ADRB3	58	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216844	EE	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216844	EE	On-Demand	Anodyne	ADRB1	90	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216844	EE	On-Demand	Anodyne	GRIN1	15	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872216844	EE	On-Demand	Anodyne	ADRB3	58	57
C#CCNC(=O)CCNCCc1ccccc1OCc1ccccc1	ZINC000872216929	EF	On-Demand	Mild	PTGER2	15	45
C#CCNC(=O)CCNCCc1ccccc1OCc1ccccc1	ZINC000872216929	EF	On-Demand	Mild	PTGER1	38	45
C#CCNC(=O)CCNCCc1ccccc1OCc1ccccc1	ZINC000872216929	EF	On-Demand	Mild	PTGER3	17	42
CN(Cc1ccncc1)C(=O)c1nn(C)c(=O)c2ccccc12	ZINC000872216947	DD	On-Demand	Anodyne	TSPO	21	43
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000872216962	EG	On-Demand	Anodyne	GRIA4	15	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000872216963	EG	On-Demand	Anodyne	GRIA4	15	40
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872216986	DE	On-Demand	Mild	ADRB2	24	53
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872216986	DE	On-Demand	Mild	ADRB1	72	51
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872216986	DE	On-Demand	Mild	CASR	42	45
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872216986	DE	On-Demand	Mild	CYP2D6	18	47
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872216987	DE	On-Demand	Mild	ADRB2	24	53
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872216987	DE	On-Demand	Mild	ADRB1	72	51
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872216987	DE	On-Demand	Mild	CASR	42	45
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872216987	DE	On-Demand	Mild	CYP2D6	18	47
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872216988	DE	On-Demand	Mild	ADRB2	24	53
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872216988	DE	On-Demand	Mild	ADRB1	72	51
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872216988	DE	On-Demand	Mild	CASR	42	45
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872216988	DE	On-Demand	Mild	CYP2D6	18	47
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872216989	DE	On-Demand	Mild	ADRB2	24	53
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872216989	DE	On-Demand	Mild	ADRB1	72	51
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872216989	DE	On-Demand	Mild	CASR	42	45
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872216989	DE	On-Demand	Mild	CYP2D6	18	47
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216993	DE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216993	DE	On-Demand	Anodyne	ADRB1	75	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216993	DE	On-Demand	Anodyne	ADRB3	47	40
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216993	DE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216994	DE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216994	DE	On-Demand	Anodyne	ADRB1	75	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216994	DE	On-Demand	Anodyne	ADRB3	47	40
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216994	DE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216995	DE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216995	DE	On-Demand	Anodyne	ADRB1	75	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216995	DE	On-Demand	Anodyne	ADRB3	47	40
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872216995	DE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216996	DE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216996	DE	On-Demand	Anodyne	ADRB1	75	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216996	DE	On-Demand	Anodyne	ADRB3	47	40
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872216996	DE	On-Demand	Anodyne	ABCB1	20	45
OC[C@@H](NC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217029	EE	On-Demand	Anodyne	ADRB1	17	43
OC[C@@H](NC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217029	EE	On-Demand	Anodyne	ADRB3	55	43
OC[C@H](NC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217030	EE	On-Demand	Anodyne	ADRB1	17	43
OC[C@H](NC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217030	EE	On-Demand	Anodyne	ADRB3	55	43
OC[C@@H](NC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217031	EE	On-Demand	Anodyne	ADRB1	17	43
OC[C@@H](NC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217031	EE	On-Demand	Anodyne	ADRB3	55	43
OC[C@H](NC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217032	EE	On-Demand	Anodyne	ADRB1	17	43
OC[C@H](NC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000872217032	EE	On-Demand	Anodyne	ADRB3	55	43
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c(C)c1	ZINC000872217033	DF	On-Demand	Anodyne	ADRB2	18	43
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c(C)c1	ZINC000872217034	DF	On-Demand	Anodyne	ADRB2	18	43
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c(C)c1	ZINC000872217035	DF	On-Demand	Anodyne	ADRB2	18	43
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)c(C)c1	ZINC000872217036	DF	On-Demand	Anodyne	ADRB2	18	43
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217039	DE	On-Demand	Mild	ADRB2	38	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217039	DE	On-Demand	Mild	ADRB1	71	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217039	DE	On-Demand	Mild	ADRB3	46	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217040	DE	On-Demand	Mild	ADRB2	38	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217040	DE	On-Demand	Mild	ADRB1	71	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217040	DE	On-Demand	Mild	ADRB3	46	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217041	DE	On-Demand	Mild	ADRB2	38	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217041	DE	On-Demand	Mild	ADRB1	71	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217041	DE	On-Demand	Mild	ADRB3	46	45
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217042	DE	On-Demand	Mild	ADRB2	38	45
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217042	DE	On-Demand	Mild	ADRB1	71	45
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217042	DE	On-Demand	Mild	ADRB3	46	45
O[C@@H](CN[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccccc1	ZINC000872217072	DG	On-Demand	Anodyne	SLC6A3	15	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCO[C@H]2c2ccccc2)CC1	ZINC000872217080	GG	On-Demand	Anodyne	GPR119	48	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCO[C@H]2c2ccccc2)CC1	ZINC000872217081	GG	On-Demand	Anodyne	GPR119	48	50
O[C@@H](CN[C@@H]1CCO[C@H]1c1ccccc1)c1cccnc1	ZINC000872217136	CE	On-Demand	Anodyne	ADRB3	62	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872217141	EE	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872217141	EE	On-Demand	Bother	ADRB1	45	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872217142	EE	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872217142	EE	On-Demand	Bother	ADRB1	45	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872217143	EE	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872217143	EE	On-Demand	Bother	ADRB1	45	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872217144	EE	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872217144	EE	On-Demand	Bother	ADRB1	45	35
O[C@H](CN[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]21)c1cccnc1	ZINC000872217156	EF	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CN[C@@H]1[C@@H]2Cc3c(Br)cccc3[C@@H]21)c1cccnc1	ZINC000872217157	EF	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CN[C@@H]1[C@H]2Cc3c(Br)cccc3[C@@H]21)c1cccnc1	ZINC000872217158	EF	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CN[C@@H]1[C@H]2Cc3c(Br)cccc3[C@H]21)c1cccnc1	ZINC000872217159	EF	On-Demand	Anodyne	ADRB3	37	41
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217179	DF	On-Demand	Anodyne	ADRB2	20	60
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217179	DF	On-Demand	Anodyne	ADRB1	50	55
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217179	DF	On-Demand	Anodyne	HTR1A	16	60
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217179	DF	On-Demand	Anodyne	SLC6A4	19	43
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217180	DF	On-Demand	Anodyne	ADRB2	20	60
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217180	DF	On-Demand	Anodyne	ADRB1	50	55
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217180	DF	On-Demand	Anodyne	HTR1A	16	60
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217180	DF	On-Demand	Anodyne	SLC6A4	19	43
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217181	DF	On-Demand	Anodyne	ADRB2	20	60
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217181	DF	On-Demand	Anodyne	ADRB1	50	55
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217181	DF	On-Demand	Anodyne	HTR1A	16	60
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217181	DF	On-Demand	Anodyne	SLC6A4	19	43
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217182	DF	On-Demand	Anodyne	ADRB2	20	60
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217182	DF	On-Demand	Anodyne	ADRB1	50	55
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217182	DF	On-Demand	Anodyne	HTR1A	16	60
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2[nH]ccc12	ZINC000872217182	DF	On-Demand	Anodyne	SLC6A4	19	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872217199	EE	On-Demand	Anodyne	ADRB2	28	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872217199	EE	On-Demand	Anodyne	ADRB1	47	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@H]1CCSC1	ZINC000872217199	EE	On-Demand	Anodyne	ADRB3	16	40
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872217200	EE	On-Demand	Anodyne	ADRB2	28	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872217200	EE	On-Demand	Anodyne	ADRB1	47	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@H]1CCSC1	ZINC000872217200	EE	On-Demand	Anodyne	ADRB3	16	40
COc1cccc(OC)c1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872217201	EE	On-Demand	Anodyne	ADRB2	28	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872217201	EE	On-Demand	Anodyne	ADRB1	47	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@H]1CCSC1	ZINC000872217201	EE	On-Demand	Anodyne	ADRB3	16	40
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872217202	EE	On-Demand	Anodyne	ADRB2	28	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872217202	EE	On-Demand	Anodyne	ADRB1	47	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@H]1CCSC1	ZINC000872217202	EE	On-Demand	Anodyne	ADRB3	16	40
OCC[C@@H](NC[C@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217209	DF	On-Demand	Anodyne	ADRB1	18	40
OCC[C@@H](NC[C@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217209	DF	On-Demand	Anodyne	ADRB3	51	39
OCC[C@H](NC[C@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217210	DF	On-Demand	Anodyne	ADRB1	18	40
OCC[C@H](NC[C@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217210	DF	On-Demand	Anodyne	ADRB3	51	39
OCC[C@@H](NC[C@@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217211	DF	On-Demand	Anodyne	ADRB1	18	40
OCC[C@@H](NC[C@@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217211	DF	On-Demand	Anodyne	ADRB3	51	39
OCC[C@H](NC[C@@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217212	DF	On-Demand	Anodyne	ADRB1	18	40
OCC[C@H](NC[C@@H](O)c1cccnc1)c1ccc(Cl)c(F)c1	ZINC000872217212	DF	On-Demand	Anodyne	ADRB3	51	39
O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)C1CC1	ZINC000872217230	BF	On-Demand	Anodyne	GRIA4	18	47
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217243	DE	On-Demand	Mild	ADRB2	31	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217243	DE	On-Demand	Mild	ADRB1	65	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217243	DE	On-Demand	Mild	ADRB3	35	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217244	DE	On-Demand	Mild	ADRB2	31	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217244	DE	On-Demand	Mild	ADRB1	65	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217244	DE	On-Demand	Mild	ADRB3	35	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217245	DE	On-Demand	Mild	ADRB2	31	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217245	DE	On-Demand	Mild	ADRB1	65	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217245	DE	On-Demand	Mild	ADRB3	35	42
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217246	DE	On-Demand	Mild	ADRB2	31	42
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217246	DE	On-Demand	Mild	ADRB1	65	42
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217246	DE	On-Demand	Mild	ADRB3	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCC23CC3)CC1	ZINC000872217257	EF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCC23CC3)CC1	ZINC000872217258	EF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCC23CC3)CC1	ZINC000872217259	EF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCC23CC3)CC1	ZINC000872217260	EF	On-Demand	Anodyne	GPR119	29	40
CN(Cc1ccncc1)C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000872217265	HE	On-Demand	Anodyne	MERTK	25	41
CN(Cc1ccncc1)C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000872217265	HE	On-Demand	Anodyne	NAMPT	45	44
O[C@H](CNCC[C@@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217278	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@H](CNCC[C@@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217278	CG	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CNCC[C@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217279	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@@H](CNCC[C@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217279	CG	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CNCC[C@@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217280	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@@H](CNCC[C@@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217280	CG	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CNCC[C@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217281	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@H](CNCC[C@H]1CCSC1)c1cccc(Cl)c1	ZINC000872217281	CG	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000872217342	CG	On-Demand	Anodyne	ADRB2	19	47
O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000872217342	CG	On-Demand	Anodyne	ADRB1	25	47
O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000872217342	CG	On-Demand	Anodyne	ADRB3	72	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCO[C@H]2c2ccccc2)cc1	ZINC000872217348	FE	On-Demand	Anodyne	PTGS2	17	41
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217360	ED	On-Demand	Anodyne	ADRB2	48	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217360	ED	On-Demand	Anodyne	ADRB1	83	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217360	ED	On-Demand	Anodyne	ADRB3	54	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217361	ED	On-Demand	Anodyne	ADRB2	48	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217361	ED	On-Demand	Anodyne	ADRB1	83	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217361	ED	On-Demand	Anodyne	ADRB3	54	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217362	ED	On-Demand	Anodyne	ADRB2	48	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217362	ED	On-Demand	Anodyne	ADRB1	83	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217362	ED	On-Demand	Anodyne	ADRB3	54	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217363	ED	On-Demand	Anodyne	ADRB2	48	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217363	ED	On-Demand	Anodyne	ADRB1	83	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217363	ED	On-Demand	Anodyne	ADRB3	54	48
COc1ccc(OC)c([C@H](O)CNCC(C)(C)F)c1	ZINC000872217369	CE	On-Demand	Anodyne	MTNR1A	20	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](CO)c1cccc(C(F)(F)F)c1	ZINC000872217371	GF	On-Demand	Anodyne	PDS	44	38
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](CO)c1cccc(C(F)(F)F)c1	ZINC000872217372	GF	On-Demand	Anodyne	PDS	44	38
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](CO)c1cccc(C(F)(F)F)c1	ZINC000872217373	GF	On-Demand	Anodyne	PDS	44	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](CO)c1cccc(C(F)(F)F)c1	ZINC000872217374	GF	On-Demand	Anodyne	PDS	44	38
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217406	ED	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217407	ED	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217408	ED	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217409	ED	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217428	EG	On-Demand	Anodyne	ADRB2	39	56
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217428	EG	On-Demand	Anodyne	ADRB1	62	51
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217428	EG	On-Demand	Anodyne	ADRB3	25	51
O[C@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217428	EG	On-Demand	Anodyne	ABCB1	16	41
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217429	EG	On-Demand	Anodyne	ADRB2	39	56
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217429	EG	On-Demand	Anodyne	ADRB1	62	51
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217429	EG	On-Demand	Anodyne	ADRB3	25	51
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217429	EG	On-Demand	Anodyne	ABCB1	16	41
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217430	EG	On-Demand	Anodyne	ADRB2	39	56
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217430	EG	On-Demand	Anodyne	ADRB1	62	51
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217430	EG	On-Demand	Anodyne	ADRB3	25	51
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217430	EG	On-Demand	Anodyne	ABCB1	16	41
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217431	EG	On-Demand	Anodyne	ADRB2	39	56
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217431	EG	On-Demand	Anodyne	ADRB1	62	51
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217431	EG	On-Demand	Anodyne	ADRB3	25	51
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc2ccccc12	ZINC000872217431	EG	On-Demand	Anodyne	ABCB1	16	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217433	EE	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217433	EE	On-Demand	Bother	ADRB1	46	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217433	EE	On-Demand	Bother	ADRB3	31	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217434	EE	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217434	EE	On-Demand	Bother	ADRB1	46	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCSC2)c1	ZINC000872217434	EE	On-Demand	Bother	ADRB3	31	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217435	EE	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217435	EE	On-Demand	Bother	ADRB1	46	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217435	EE	On-Demand	Bother	ADRB3	31	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217436	EE	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217436	EE	On-Demand	Bother	ADRB1	46	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCSC2)c1	ZINC000872217436	EE	On-Demand	Bother	ADRB3	31	48
O[C@H](CNCC[C@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217457	EG	On-Demand	Anodyne	ADRB1	41	46
O[C@H](CNCC[C@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217457	EG	On-Demand	Anodyne	PDS	44	37
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217458	EG	On-Demand	Anodyne	ADRB1	41	46
O[C@@H](CNCC[C@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217458	EG	On-Demand	Anodyne	PDS	44	37
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217459	EG	On-Demand	Anodyne	ADRB1	41	46
O[C@@H](CNCC[C@@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217459	EG	On-Demand	Anodyne	PDS	44	37
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217460	EG	On-Demand	Anodyne	ADRB1	41	46
O[C@H](CNCC[C@@H]1CCSC1)COc1cccc(C(F)(F)F)c1	ZINC000872217460	EG	On-Demand	Anodyne	PDS	44	37
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000872217493	EH	On-Demand	Bother	GRIA4	16	49
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000872217494	EH	On-Demand	Bother	GRIA4	16	49
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217508	EF	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217508	EF	On-Demand	Anodyne	ADRB1	70	43
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217508	EF	On-Demand	Anodyne	ADRB3	45	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217509	EF	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217509	EF	On-Demand	Anodyne	ADRB1	70	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217509	EF	On-Demand	Anodyne	ADRB3	45	43
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217510	EF	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217510	EF	On-Demand	Anodyne	ADRB1	70	43
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCSC2)cc1	ZINC000872217510	EF	On-Demand	Anodyne	ADRB3	45	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217511	EF	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217511	EF	On-Demand	Anodyne	ADRB1	70	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCSC2)cc1	ZINC000872217511	EF	On-Demand	Anodyne	ADRB3	45	43
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000872217523	EH	On-Demand	Bother	CACNA1C	50	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000872217523	EH	On-Demand	Bother	CACNA1D	71	37
O[C@@H](CN[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1cccnc1	ZINC000872217546	DF	On-Demand	Anodyne	ADRB3	45	40
O[C@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217557	EG	On-Demand	Anodyne	ADRB2	46	51
O[C@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217557	EG	On-Demand	Anodyne	ADRB1	71	42
O[C@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217557	EG	On-Demand	Anodyne	ADRB3	47	42
O[C@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217558	EG	On-Demand	Anodyne	ADRB2	46	51
O[C@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217558	EG	On-Demand	Anodyne	ADRB1	71	42
O[C@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217558	EG	On-Demand	Anodyne	ADRB3	47	42
O[C@@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217559	EG	On-Demand	Anodyne	ADRB2	46	51
O[C@@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217559	EG	On-Demand	Anodyne	ADRB1	71	42
O[C@@H](CNCC[C@@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217559	EG	On-Demand	Anodyne	ADRB3	47	42
O[C@@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217560	EG	On-Demand	Anodyne	ADRB2	46	51
O[C@@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217560	EG	On-Demand	Anodyne	ADRB1	71	42
O[C@@H](CNCC[C@H]1CCSC1)COc1ccc2ccccc2c1	ZINC000872217560	EG	On-Demand	Anodyne	ADRB3	47	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872217586	DD	On-Demand	Anodyne	ADRB1	35	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872217586	DD	On-Demand	Anodyne	ADRB3	53	48
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872217586	DD	On-Demand	Anodyne	CYP3A4	49	39
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872217587	DD	On-Demand	Anodyne	ADRB1	35	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872217587	DD	On-Demand	Anodyne	ADRB3	53	48
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872217587	DD	On-Demand	Anodyne	CYP3A4	49	39
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217590	EC	On-Demand	Mild	ADRB2	26	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217590	EC	On-Demand	Mild	ADRB1	30	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217590	EC	On-Demand	Mild	ADRB3	25	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217591	EC	On-Demand	Mild	ADRB2	26	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217591	EC	On-Demand	Mild	ADRB1	30	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872217591	EC	On-Demand	Mild	ADRB3	25	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000872217592	FE	On-Demand	Anodyne	SFRP1	41	37
CC(C)(O)CN1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000872217593	FE	On-Demand	Anodyne	SFRP1	41	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COC[C@@H]2O)CC1	ZINC000872217635	EC	On-Demand	Anodyne	GPR119	37	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COC[C@@H]2O)CC1	ZINC000872217636	EC	On-Demand	Anodyne	GPR119	37	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217637	FD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217637	FD	On-Demand	Anodyne	ADRB1	39	44
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217637	FD	On-Demand	Anodyne	ADRB3	30	45
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217638	FD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217638	FD	On-Demand	Anodyne	ADRB1	39	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872217638	FD	On-Demand	Anodyne	ADRB3	30	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872217644	EC	On-Demand	Mild	ADRB2	34	51
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872217644	EC	On-Demand	Mild	ADRB1	59	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872217644	EC	On-Demand	Mild	ADRB3	21	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872217644	EC	On-Demand	Mild	CASR	44	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872217644	EC	On-Demand	Mild	CYP2D6	21	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872217645	EC	On-Demand	Mild	ADRB2	34	51
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872217645	EC	On-Demand	Mild	ADRB1	59	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872217645	EC	On-Demand	Mild	ADRB3	21	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872217645	EC	On-Demand	Mild	CASR	44	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872217645	EC	On-Demand	Mild	CYP2D6	21	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872217673	DC	On-Demand	Anodyne	ADRB2	50	49
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872217673	DC	On-Demand	Anodyne	ADRB1	60	49
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872217673	DC	On-Demand	Anodyne	ADRB3	46	48
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872217673	DC	On-Demand	Anodyne	CASR	17	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872217674	DC	On-Demand	Anodyne	ADRB2	50	49
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872217674	DC	On-Demand	Anodyne	ADRB1	60	49
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872217674	DC	On-Demand	Anodyne	ADRB3	46	48
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872217674	DC	On-Demand	Anodyne	CASR	17	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000872217684	CD	On-Demand	Anodyne	SIGMAR1	19	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000872217685	CD	On-Demand	Anodyne	SIGMAR1	19	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872217691	ED	On-Demand	Anodyne	ADRB2	37	53
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872217691	ED	On-Demand	Anodyne	ADRB1	33	53
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872217691	ED	On-Demand	Anodyne	ADRB3	26	47
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872217691	ED	On-Demand	Anodyne	ABCB1	35	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872217692	ED	On-Demand	Anodyne	ADRB2	37	53
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872217692	ED	On-Demand	Anodyne	ADRB1	33	53
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872217692	ED	On-Demand	Anodyne	ADRB3	26	47
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872217692	ED	On-Demand	Anodyne	ABCB1	35	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@H](O)c1cccnc1	ZINC000872217705	EE	On-Demand	Anodyne	ADRB2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@H](O)c1cccnc1	ZINC000872217705	EE	On-Demand	Anodyne	ADRB3	84	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000872217706	EE	On-Demand	Anodyne	ADRB2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000872217706	EE	On-Demand	Anodyne	ADRB3	84	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000872217707	EE	On-Demand	Anodyne	ADRB2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000872217707	EE	On-Demand	Anodyne	ADRB3	84	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000872217708	EE	On-Demand	Anodyne	ADRB2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000872217708	EE	On-Demand	Anodyne	ADRB3	84	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217709	ED	On-Demand	Anodyne	ADRB2	29	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217709	ED	On-Demand	Anodyne	ADRB1	38	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217709	ED	On-Demand	Anodyne	ADRB3	33	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217709	ED	On-Demand	Anodyne	EBP	19	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217710	ED	On-Demand	Anodyne	ADRB2	29	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217710	ED	On-Demand	Anodyne	ADRB1	38	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217710	ED	On-Demand	Anodyne	ADRB3	33	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872217710	ED	On-Demand	Anodyne	EBP	19	46
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H](CO)C2)c1	ZINC000872217713	CC	On-Demand	Bother	CACNA1C	41	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H](CO)C2)c1	ZINC000872217713	CC	On-Demand	Bother	CACNA1D	62	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H](CO)C2)c1	ZINC000872217714	CC	On-Demand	Bother	CACNA1C	41	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H](CO)C2)c1	ZINC000872217714	CC	On-Demand	Bother	CACNA1D	62	36
CSCCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000872217721	CG	On-Demand	Anodyne	ADRB2	15	40
CSCCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000872217721	CG	On-Demand	Anodyne	ADRB3	71	42
CSCCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000872217722	CG	On-Demand	Anodyne	ADRB2	15	40
CSCCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000872217722	CG	On-Demand	Anodyne	ADRB3	71	42
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000872217728	DD	On-Demand	Anodyne	DRD4	17	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217755	GG	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217755	GG	On-Demand	Anodyne	ADRB1	80	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217755	GG	On-Demand	Anodyne	ADRB3	56	48
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217756	GG	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217756	GG	On-Demand	Anodyne	ADRB1	80	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872217756	GG	On-Demand	Anodyne	ADRB3	56	48
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000872217767	EE	On-Demand	Anodyne	RBP4	45	31
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000872217767	EE	On-Demand	Anodyne	SFRP1	70	39
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000872217774	EE	On-Demand	Anodyne	RBP4	45	31
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000872217774	EE	On-Demand	Anodyne	SFRP1	70	39
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217807	EE	On-Demand	Anodyne	ADRB2	46	61
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217807	EE	On-Demand	Anodyne	ADRB1	69	61
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217807	EE	On-Demand	Anodyne	ADRB3	45	42
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217808	EE	On-Demand	Anodyne	ADRB2	46	61
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217808	EE	On-Demand	Anodyne	ADRB1	69	61
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217808	EE	On-Demand	Anodyne	ADRB3	45	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217809	DE	On-Demand	Anodyne	ADRB2	36	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217809	DE	On-Demand	Anodyne	ADRB1	49	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217809	DE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217810	DE	On-Demand	Anodyne	ADRB2	36	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217810	DE	On-Demand	Anodyne	ADRB1	49	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872217810	DE	On-Demand	Anodyne	ABCB1	18	45
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	ADRB2	18	46
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	DRD2	28	40
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	ADRA1D	35	40
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	ADRA1A	29	40
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	ADRA1B	26	40
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	DRD3	23	40
COc1ccccc1COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217839	GF	On-Demand	Mild	ADRB3	18	41
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	ADRB2	18	46
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	DRD2	28	40
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	ADRA1D	35	40
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	ADRA1A	29	40
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	ADRA1B	26	40
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	DRD3	23	40
COc1ccccc1COC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872217840	GF	On-Demand	Mild	ADRB3	18	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2ccccc2F)CC1	ZINC000872217849	GF	On-Demand	Mild	ADRB2	15	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000872217850	GF	On-Demand	Mild	ADRB2	15	41
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217853	FG	On-Demand	Anodyne	ADRB2	33	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217853	FG	On-Demand	Anodyne	ADRB1	44	40
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217853	FG	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217853	FG	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217854	FG	On-Demand	Anodyne	ADRB2	33	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217854	FG	On-Demand	Anodyne	ADRB1	44	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217854	FG	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)c1	ZINC000872217854	FG	On-Demand	Anodyne	ABCB1	16	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217858	DE	On-Demand	Anodyne	ADRB2	27	49
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217859	DE	On-Demand	Anodyne	ADRB2	27	49
N#Cc1ccccc1N1CCC(NCCC(N)=O)CC1	ZINC000872217860	CC	On-Demand	Mild	DRD4	17	47
N#Cc1ccccc1N1CCC(NCCC(N)=O)CC1	ZINC000872217860	CC	On-Demand	Mild	NPY1R	23	45
N#Cc1ccccc1N1CCC(NCCC(N)=O)CC1	ZINC000872217860	CC	On-Demand	Mild	DPP4	15	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217875	EF	On-Demand	Anodyne	ADRB2	50	44
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217875	EF	On-Demand	Anodyne	ADRB1	75	50
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217875	EF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217875	EF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217876	EF	On-Demand	Anodyne	ADRB2	50	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217876	EF	On-Demand	Anodyne	ADRB1	75	50
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217876	EF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872217876	EF	On-Demand	Anodyne	ABCB1	19	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872217881	GE	On-Demand	Anodyne	ADRB2	21	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872217881	GE	On-Demand	Anodyne	ADRB1	19	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872217882	GE	On-Demand	Anodyne	ADRB2	21	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872217882	GE	On-Demand	Anodyne	ADRB1	19	44
CCC[C@@H](CCO)NC[C@H](O)c1cccc(Cl)c1	ZINC000872217887	CF	On-Demand	Anodyne	ADRB1	30	46
CCC[C@@H](CCO)NC[C@H](O)c1cccc(Cl)c1	ZINC000872217887	CF	On-Demand	Anodyne	ADRB3	45	46
CCC[C@H](CCO)NC[C@H](O)c1cccc(Cl)c1	ZINC000872217888	CF	On-Demand	Anodyne	ADRB1	30	46
CCC[C@H](CCO)NC[C@H](O)c1cccc(Cl)c1	ZINC000872217888	CF	On-Demand	Anodyne	ADRB3	45	46
CCC[C@@H](CCO)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872217889	CF	On-Demand	Anodyne	ADRB1	30	46
CCC[C@@H](CCO)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872217889	CF	On-Demand	Anodyne	ADRB3	45	46
CCC[C@H](CCO)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872217890	CF	On-Demand	Anodyne	ADRB1	30	46
CCC[C@H](CCO)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872217890	CF	On-Demand	Anodyne	ADRB3	45	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000872217891	GE	On-Demand	Anodyne	ADRB2	17	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000872217892	GE	On-Demand	Anodyne	ADRB2	17	45
CC(C)(O)CN1CC[C@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872217930	ED	On-Demand	Anodyne	SIGMAR1	48	40
CC(C)(O)CN1CC[C@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872217932	ED	On-Demand	Anodyne	SIGMAR1	48	40
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000872217942	EG	On-Demand	Mild	NPY1R	27	50
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000872217942	EG	On-Demand	Mild	NPY2R	23	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000872217961	DC	On-Demand	Anodyne	ADRB2	17	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000872217961	DC	On-Demand	Anodyne	ADRB1	15	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000872217961	DC	On-Demand	Anodyne	SIGMAR1	17	40
CC(C)(O)CN1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000872217962	DC	On-Demand	Anodyne	ADRB2	17	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000872217962	DC	On-Demand	Anodyne	ADRB1	15	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000872217962	DC	On-Demand	Anodyne	SIGMAR1	17	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872217973	FC	On-Demand	Anodyne	ADRB3	20	42
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217974	FE	On-Demand	Anodyne	ADRB2	34	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217974	FE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217974	FE	On-Demand	Anodyne	ADRB3	42	40
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872217975	FC	On-Demand	Anodyne	ADRB3	20	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217977	FE	On-Demand	Anodyne	ADRB2	34	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217977	FE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872217977	FE	On-Demand	Anodyne	ADRB3	42	40
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217979	FC	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217979	FC	On-Demand	Anodyne	ADRB1	27	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217979	FC	On-Demand	Anodyne	ADRB3	23	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217980	GF	On-Demand	Mild	ADRB2	32	50
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217980	GF	On-Demand	Mild	ADRB1	59	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217980	GF	On-Demand	Mild	ADRB3	42	50
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217980	GF	On-Demand	Mild	NPY1R	19	41
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217980	GF	On-Demand	Mild	ABCB1	38	55
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217981	FC	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217981	FC	On-Demand	Anodyne	ADRB1	27	42
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCN(CC(C)(C)O)C1	ZINC000872217981	FC	On-Demand	Anodyne	ADRB3	23	43
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217983	GF	On-Demand	Mild	ADRB2	32	50
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217983	GF	On-Demand	Mild	ADRB1	59	43
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217983	GF	On-Demand	Mild	ADRB3	42	50
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217983	GF	On-Demand	Mild	NPY1R	19	41
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872217983	GF	On-Demand	Mild	ABCB1	38	55
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217996	CE	On-Demand	Anodyne	ADRB2	37	48
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217996	CE	On-Demand	Anodyne	ADRB1	47	36
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217996	CE	On-Demand	Anodyne	ABCB1	15	44
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217997	CE	On-Demand	Anodyne	ADRB2	37	48
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217997	CE	On-Demand	Anodyne	ADRB1	47	36
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1F	ZINC000872217997	CE	On-Demand	Anodyne	ABCB1	15	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000872218007	CD	On-Demand	Anodyne	SLC6A3	26	44
N#CCc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218028	GF	On-Demand	Mild	ADRB2	36	47
N#CCc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218028	GF	On-Demand	Mild	ADRB1	61	46
N#CCc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218028	GF	On-Demand	Mild	ADRB3	42	50
N#CCc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218029	GF	On-Demand	Mild	ADRB2	36	47
N#CCc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218029	GF	On-Demand	Mild	ADRB1	61	46
N#CCc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218029	GF	On-Demand	Mild	ADRB3	42	50
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218030	EE	On-Demand	Anodyne	ADRB2	50	50
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218030	EE	On-Demand	Anodyne	ADRB1	66	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218030	EE	On-Demand	Anodyne	ADRB3	43	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218031	EE	On-Demand	Anodyne	ADRB2	50	50
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218031	EE	On-Demand	Anodyne	ADRB1	66	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218031	EE	On-Demand	Anodyne	ADRB3	43	41
Cc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218035	EG	On-Demand	Anodyne	ADRB2	40	50
Cc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218035	EG	On-Demand	Anodyne	ADRB1	45	48
Cc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218035	EG	On-Demand	Anodyne	ADRB3	27	44
Cc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218036	EG	On-Demand	Anodyne	ADRB2	40	50
Cc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218036	EG	On-Demand	Anodyne	ADRB1	45	48
Cc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218036	EG	On-Demand	Anodyne	ADRB3	27	44
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218060	GG	On-Demand	Anodyne	ADRB2	35	50
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218060	GG	On-Demand	Anodyne	ADRB1	32	50
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218060	GG	On-Demand	Anodyne	ADRB3	21	43
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218061	GG	On-Demand	Anodyne	ADRB2	35	50
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218061	GG	On-Demand	Anodyne	ADRB1	32	50
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872218061	GG	On-Demand	Anodyne	ADRB3	21	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000872218163	CD	On-Demand	Anodyne	SLC6A3	26	44
CCC[C@H](CCO)NC[C@@H](O)c1cccnc1	ZINC000872218174	BD	On-Demand	Anodyne	ADRB1	20	46
CCC[C@H](CCO)NC[C@@H](O)c1cccnc1	ZINC000872218174	BD	On-Demand	Anodyne	ADRB3	62	46
CCC[C@H](CCO)NC[C@H](O)c1cccnc1	ZINC000872218175	BD	On-Demand	Anodyne	ADRB1	20	46
CCC[C@H](CCO)NC[C@H](O)c1cccnc1	ZINC000872218175	BD	On-Demand	Anodyne	ADRB3	62	46
CCC[C@@H](CCO)NC[C@@H](O)c1cccnc1	ZINC000872218176	BD	On-Demand	Anodyne	ADRB1	20	46
CCC[C@@H](CCO)NC[C@@H](O)c1cccnc1	ZINC000872218176	BD	On-Demand	Anodyne	ADRB3	62	46
CCC[C@@H](CCO)NC[C@H](O)c1cccnc1	ZINC000872218177	BD	On-Demand	Anodyne	ADRB1	20	46
CCC[C@@H](CCO)NC[C@H](O)c1cccnc1	ZINC000872218177	BD	On-Demand	Anodyne	ADRB3	62	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218178	GF	On-Demand	Anodyne	ADRB2	16	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218178	GF	On-Demand	Anodyne	SLC6A3	39	47
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218178	GF	On-Demand	Anodyne	CASR	17	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218179	GF	On-Demand	Anodyne	ADRB2	16	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218179	GF	On-Demand	Anodyne	SLC6A3	39	47
CC(C)(O)CN1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872218179	GF	On-Demand	Anodyne	CASR	17	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218183	GD	On-Demand	Anodyne	ADRB2	35	52
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218183	GD	On-Demand	Anodyne	ADRB1	26	52
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218183	GD	On-Demand	Anodyne	ABCB1	37	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218184	GD	On-Demand	Anodyne	ADRB2	35	52
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218184	GD	On-Demand	Anodyne	ADRB1	26	52
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872218184	GD	On-Demand	Anodyne	ABCB1	37	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218186	GD	On-Demand	Anodyne	ADRB2	22	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218186	GD	On-Demand	Anodyne	ADRB1	21	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218186	GD	On-Demand	Anodyne	ADRB3	22	40
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218186	GD	On-Demand	Anodyne	PDS	43	37
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218187	GD	On-Demand	Anodyne	ADRB2	22	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218187	GD	On-Demand	Anodyne	ADRB1	21	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218187	GD	On-Demand	Anodyne	ADRB3	22	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872218187	GD	On-Demand	Anodyne	PDS	43	37
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872218189	FE	On-Demand	Anodyne	ADRB2	43	52
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872218189	FE	On-Demand	Anodyne	ADRB1	34	52
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872218189	FE	On-Demand	Anodyne	ADRB3	27	49
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872218189	FE	On-Demand	Anodyne	CYP2D6	19	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872218189	FE	On-Demand	Anodyne	ABCB1	42	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872218190	FE	On-Demand	Anodyne	ADRB2	43	52
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872218190	FE	On-Demand	Anodyne	ADRB1	34	52
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872218190	FE	On-Demand	Anodyne	ADRB3	27	49
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872218190	FE	On-Demand	Anodyne	CYP2D6	19	46
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872218190	FE	On-Demand	Anodyne	ABCB1	42	40
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218214	FG	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218214	FG	On-Demand	Anodyne	ADRB1	51	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218214	FG	On-Demand	Anodyne	ADRB3	38	43
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218216	FG	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218216	FG	On-Demand	Anodyne	ADRB1	51	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218216	FG	On-Demand	Anodyne	ADRB3	38	43
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2ccccc2F)CC1	ZINC000872218220	FG	On-Demand	Mild	KCNQ2	51	39
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2ccccc2F)CC1	ZINC000872218220	FG	On-Demand	Mild	NPY1R	21	42
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872218228	DF	On-Demand	Mild	ADRB3	34	43
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872218228	DF	On-Demand	Mild	NPY1R	16	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872218230	DF	On-Demand	Mild	ADRB3	34	43
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872218230	DF	On-Demand	Mild	NPY1R	16	40
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218233	DD	On-Demand	Anodyne	ADRB2	33	45
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218233	DD	On-Demand	Anodyne	ADRB1	37	44
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218233	DD	On-Demand	Anodyne	ADRB3	30	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218234	GF	On-Demand	Mild	ADRB2	36	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218234	GF	On-Demand	Mild	ADRB1	62	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218234	GF	On-Demand	Mild	ADRB3	44	47
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218234	GF	On-Demand	Mild	ABCB1	36	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218235	DD	On-Demand	Anodyne	ADRB2	33	45
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218235	DD	On-Demand	Anodyne	ADRB1	37	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218235	DD	On-Demand	Anodyne	ADRB3	30	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218236	GF	On-Demand	Mild	ADRB2	36	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218236	GF	On-Demand	Mild	ADRB1	62	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218236	GF	On-Demand	Mild	ADRB3	44	47
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218236	GF	On-Demand	Mild	ABCB1	36	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218237	FD	On-Demand	Anodyne	ADRB2	33	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218237	FD	On-Demand	Anodyne	ADRB1	69	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218237	FD	On-Demand	Anodyne	ADRB3	42	47
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218241	FD	On-Demand	Anodyne	ADRB2	33	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218241	FD	On-Demand	Anodyne	ADRB1	69	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218241	FD	On-Demand	Anodyne	ADRB3	42	47
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218251	EE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218251	EE	On-Demand	Anodyne	ADRB1	33	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218252	EE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218252	EE	On-Demand	Anodyne	ADRB1	33	42
CCOc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218262	GF	On-Demand	Mild	ADRB2	38	48
CCOc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218262	GF	On-Demand	Mild	ADRB1	54	39
CCOc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218262	GF	On-Demand	Mild	ADRB3	37	47
CCOc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218262	GF	On-Demand	Mild	ABCB1	25	41
CCOc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218263	GF	On-Demand	Mild	ADRB2	38	48
CCOc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218263	GF	On-Demand	Mild	ADRB1	54	39
CCOc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218263	GF	On-Demand	Mild	ADRB3	37	47
CCOc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218263	GF	On-Demand	Mild	ABCB1	25	41
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)Cc1ccc(F)cc1	ZINC000872218270	CF	On-Demand	Anodyne	SSTR3	20	41
O[C@H](CN[C@@H]1CCCC[C@@H]1F)Cc1ccc(F)cc1	ZINC000872218271	CF	On-Demand	Anodyne	SSTR3	20	41
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218275	GF	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218275	GF	On-Demand	Anodyne	ADRB1	62	45
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218275	GF	On-Demand	Anodyne	ADRB3	49	45
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218277	GF	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218277	GF	On-Demand	Anodyne	ADRB1	62	45
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)cc1	ZINC000872218277	GF	On-Demand	Anodyne	ADRB3	49	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218306	ED	On-Demand	Anodyne	ADRB2	29	66
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218306	ED	On-Demand	Anodyne	ADRB1	30	66
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218306	ED	On-Demand	Anodyne	HTR1A	19	66
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218306	ED	On-Demand	Anodyne	SLC6A4	20	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218306	ED	On-Demand	Anodyne	ADRB3	23	53
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218308	ED	On-Demand	Anodyne	ADRB2	29	66
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218308	ED	On-Demand	Anodyne	ADRB1	30	66
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218308	ED	On-Demand	Anodyne	HTR1A	19	66
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218308	ED	On-Demand	Anodyne	SLC6A4	20	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872218308	ED	On-Demand	Anodyne	ADRB3	23	53
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2ccccc2Cl)CC1	ZINC000872218332	GG	On-Demand	Mild	ADRB2	15	41
CC(C)(O)CN1CC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000872218333	EC	On-Demand	Anodyne	SFRP1	87	40
CC(C)(O)CN1CC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000872218333	EC	On-Demand	Anodyne	WNT3	53	35
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2ccccc2Cl)CC1	ZINC000872218334	GG	On-Demand	Mild	ADRB2	15	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2ccccc2)CC1	ZINC000872218342	FF	On-Demand	Mild	ADRB2	18	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2ccccc2)CC1	ZINC000872218342	FF	On-Demand	Mild	ADRB3	20	42
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2ccccc2)CC1	ZINC000872218344	FF	On-Demand	Mild	ADRB2	18	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2ccccc2)CC1	ZINC000872218344	FF	On-Demand	Mild	ADRB3	20	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	ADRB2	28	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	ADRB1	30	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	HRH1	25	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	ADRB3	30	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	ACOX1	67	35
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218377	GE	On-Demand	Anodyne	CCR3	29	56
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	ADRB2	28	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	ADRB1	30	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	HRH1	25	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	ADRB3	30	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	ACOX1	67	35
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872218378	GE	On-Demand	Anodyne	CCR3	29	56
O[C@H](CN[C@@H]1CCCC[C@@H]1F)c1ccccc1	ZINC000872218404	BF	On-Demand	Anodyne	ADRB1	15	42
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)c1ccccc1	ZINC000872218406	BF	On-Demand	Anodyne	ADRB1	15	42
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(Cl)cc1	ZINC000872218407	DF	On-Demand	Anodyne	ADRB2	33	40
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(Cl)cc1	ZINC000872218407	DF	On-Demand	Anodyne	ADRB1	47	45
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(Cl)cc1	ZINC000872218409	DF	On-Demand	Anodyne	ADRB2	33	40
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(Cl)cc1	ZINC000872218409	DF	On-Demand	Anodyne	ADRB1	47	45
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000872218416	DD	On-Demand	Anodyne	DRD4	25	42
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872218422	FF	On-Demand	Mild	ADRB2	41	55
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872218422	FF	On-Demand	Mild	ADRB1	65	55
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872218422	FF	On-Demand	Mild	ADRB3	46	55
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872218424	FF	On-Demand	Mild	ADRB2	41	55
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872218424	FF	On-Demand	Mild	ADRB1	65	55
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872218424	FF	On-Demand	Mild	ADRB3	46	55
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218445	FC	On-Demand	Anodyne	ADRB2	35	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218445	FC	On-Demand	Anodyne	ADRB1	49	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218445	FC	On-Demand	Anodyne	ADRB3	38	46
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRB2	30	53
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRB1	57	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRA1D	25	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRA1A	19	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRA1B	18	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ADRB3	25	53
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872218449	FF	On-Demand	Mild	ABCB1	27	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218450	FC	On-Demand	Anodyne	ADRB2	35	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218450	FC	On-Demand	Anodyne	ADRB1	49	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218450	FC	On-Demand	Anodyne	ADRB3	38	46
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000872218454	DD	On-Demand	Anodyne	DRD4	22	45
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000872218454	DD	On-Demand	Anodyne	CCR3	63	39
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000872218454	DD	On-Demand	Anodyne	MLNR	19	40
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218465	CE	On-Demand	Anodyne	ADRB2	62	52
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218465	CE	On-Demand	Anodyne	ADRB1	72	44
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218465	CE	On-Demand	Anodyne	ADRB3	47	44
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218473	CE	On-Demand	Anodyne	ADRB2	62	52
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218473	CE	On-Demand	Anodyne	ADRB1	72	44
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1	ZINC000872218473	CE	On-Demand	Anodyne	ADRB3	47	44
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218477	DF	On-Demand	Anodyne	ADRB2	29	78
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218477	DF	On-Demand	Anodyne	ADRB1	39	78
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218477	DF	On-Demand	Anodyne	HTR1A	17	78
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218477	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218477	DF	On-Demand	Anodyne	ADRB3	15	62
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218478	DF	On-Demand	Anodyne	ADRB2	29	78
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218478	DF	On-Demand	Anodyne	ADRB1	39	78
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218478	DF	On-Demand	Anodyne	HTR1A	17	78
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218478	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1cccc2[nH]ccc12	ZINC000872218478	DF	On-Demand	Anodyne	ADRB3	15	62
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218487	CF	On-Demand	Anodyne	ADRB2	44	56
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218487	CF	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218489	CF	On-Demand	Anodyne	ADRB2	44	56
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218489	CF	On-Demand	Anodyne	ADRB1	50	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H](CO)C2)CC1	ZINC000872218492	ED	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H](CO)C2)CC1	ZINC000872218494	ED	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC(OC(C)(C)C)CC2)CC1	ZINC000872218502	GH	On-Demand	Anodyne	GPR119	31	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218505	FD	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218505	FD	On-Demand	Anodyne	ADRB1	43	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218505	FD	On-Demand	Anodyne	ADRB3	33	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218505	FD	On-Demand	Anodyne	ABCB1	17	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218506	FD	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218506	FD	On-Demand	Anodyne	ADRB1	43	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218506	FD	On-Demand	Anodyne	ADRB3	33	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218506	FD	On-Demand	Anodyne	ABCB1	17	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC(OC(C)(C)C)CC2)CC1	ZINC000872218507	GH	On-Demand	Anodyne	GPR119	31	42
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2cccs2)CC1	ZINC000872218509	FF	On-Demand	Mild	ADRB2	16	43
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2cccs2)CC1	ZINC000872218509	FF	On-Demand	Mild	ADRB3	17	43
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2cccs2)CC1	ZINC000872218510	FF	On-Demand	Mild	ADRB2	16	43
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2cccs2)CC1	ZINC000872218510	FF	On-Demand	Mild	ADRB3	17	43
N#Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218526	GE	On-Demand	Mild	ADRB2	32	49
N#Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218526	GE	On-Demand	Mild	ADRB1	55	40
N#Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218526	GE	On-Demand	Mild	ADRB3	33	49
N#Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218528	GE	On-Demand	Mild	ADRB2	32	49
N#Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218528	GE	On-Demand	Mild	ADRB1	55	40
N#Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218528	GE	On-Demand	Mild	ADRB3	33	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	AVPR2	94	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	AVPR1A	51	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	METAP1	50	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	NPY2R	22	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	PRNP	71	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	TACR3	19	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	GRM4	56	35
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	TGFBR1	16	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	ATR	19	48
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	NR2E3	59	35
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	SHH	22	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	MT-CO2	43	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	L3MBTL3	72	37
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	HPGD	45	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872218536	HJ	On-Demand	Anodyne	MAP3K12	32	40
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000872218543	FG	On-Demand	Mild	NPY1R	27	49
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000872218543	FG	On-Demand	Mild	CCR3	30	40
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000872218543	FG	On-Demand	Mild	KISS1R	41	35
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1cccc(F)c1	ZINC000872218544	CG	On-Demand	Anodyne	CCR3	26	41
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1cccnc1	ZINC000872218545	CE	On-Demand	Anodyne	NAMPT	26	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000872218552	FD	On-Demand	Anodyne	ADRB2	19	42
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000872218552	FD	On-Demand	Anodyne	ADRB1	20	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000872218553	FD	On-Demand	Anodyne	ADRB2	19	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000872218553	FD	On-Demand	Anodyne	ADRB1	20	42
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218559	DF	On-Demand	Anodyne	ADRB2	46	45
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218559	DF	On-Demand	Anodyne	ADRB1	52	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218560	DF	On-Demand	Anodyne	ADRB2	46	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218560	DF	On-Demand	Anodyne	ADRB1	52	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872218562	ED	On-Demand	Anodyne	ADRB2	34	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872218562	ED	On-Demand	Anodyne	ADRB1	40	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872218562	ED	On-Demand	Anodyne	ADRB3	32	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872218562	ED	On-Demand	Anodyne	CCR3	18	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872218563	ED	On-Demand	Anodyne	ADRB2	34	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872218563	ED	On-Demand	Anodyne	ADRB1	40	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872218563	ED	On-Demand	Anodyne	ADRB3	32	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872218563	ED	On-Demand	Anodyne	CCR3	18	44
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218566	FE	On-Demand	Anodyne	ADRB2	38	49
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218566	FE	On-Demand	Anodyne	ADRB1	37	48
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218566	FE	On-Demand	Anodyne	ADRB3	32	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218566	FE	On-Demand	Anodyne	CASR	42	40
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218566	FE	On-Demand	Anodyne	ACOX1	61	36
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218567	FE	On-Demand	Anodyne	ADRB2	38	49
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218567	FE	On-Demand	Anodyne	ADRB1	37	48
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218567	FE	On-Demand	Anodyne	ADRB3	32	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218567	FE	On-Demand	Anodyne	CASR	42	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872218567	FE	On-Demand	Anodyne	ACOX1	61	36
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872218570	FE	On-Demand	Anodyne	DRD4	15	46
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872218570	FE	On-Demand	Anodyne	NPY2R	15	41
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872218570	FE	On-Demand	Anodyne	CCR3	22	45
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872218570	FE	On-Demand	Anodyne	CCR2	66	44
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872218570	FE	On-Demand	Anodyne	EPHX2	19	48
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000872218583	CD	On-Demand	Anodyne	SLC6A3	16	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872218584	CD	On-Demand	Anodyne	SLC6A3	16	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	ADRB2	26	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	ADRB1	31	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	ADRB3	33	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	CCR3	20	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218615	FD	On-Demand	Anodyne	ABCB1	27	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	ADRB2	26	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	ADRB1	31	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	ADRB3	33	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	CCR3	20	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000872218617	FD	On-Demand	Anodyne	ABCB1	27	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218629	GE	On-Demand	Anodyne	ADRB2	18	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218629	GE	On-Demand	Anodyne	ADRB1	18	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218629	GE	On-Demand	Anodyne	CACNA1I	44	36
N#Cc1ccccc1N1CCC(NC[C@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000872218631	GG	On-Demand	Mild	ADRB3	18	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218632	GE	On-Demand	Anodyne	ADRB2	18	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218632	GE	On-Demand	Anodyne	ADRB1	18	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872218632	GE	On-Demand	Anodyne	CACNA1I	44	36
N#Cc1ccccc1N1CCC(NC[C@@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000872218633	GG	On-Demand	Mild	ADRB3	18	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000872218636	DD	On-Demand	Anodyne	ADRB3	21	44
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000872218638	EE	On-Demand	Anodyne	EPHX2	23	41
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000872218638	EE	On-Demand	Anodyne	MCHR1	15	41
O[C@@H](CCc1ccccc1)CN[C@@H]1CCCC[C@@H]1F	ZINC000872218654	CF	On-Demand	Anodyne	SLC18A2	42	36
O[C@H](CCc1ccccc1)CN[C@@H]1CCCC[C@@H]1F	ZINC000872218657	CF	On-Demand	Anodyne	SLC18A2	42	36
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218659	FD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218659	FD	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218659	FD	On-Demand	Anodyne	ADRB3	30	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218660	FD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218660	FD	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218660	FD	On-Demand	Anodyne	ADRB3	30	40
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRB2	21	46
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRB1	45	35
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRA1D	24	41
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRA1A	18	41
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRA1B	18	41
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	ADRB3	21	41
COC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218675	CD	On-Demand	Mild	NPY1R	18	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872218680	FF	On-Demand	Mild	ADRB2	34	53
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872218680	FF	On-Demand	Mild	ADRB1	64	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872218680	FF	On-Demand	Mild	ADRB3	35	53
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872218680	FF	On-Demand	Mild	ABCB1	25	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872218682	FF	On-Demand	Mild	ADRB2	34	53
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872218682	FF	On-Demand	Mild	ADRB1	64	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872218682	FF	On-Demand	Mild	ADRB3	35	53
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872218682	FF	On-Demand	Mild	ABCB1	25	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218706	EC	On-Demand	Mild	ADRB2	28	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218706	EC	On-Demand	Mild	ADRB1	32	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218706	EC	On-Demand	Mild	ADRB3	27	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218708	EC	On-Demand	Mild	ADRB2	28	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218708	EC	On-Demand	Mild	ADRB1	32	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872218708	EC	On-Demand	Mild	ADRB3	27	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000872218736	DD	On-Demand	Anodyne	DRD4	18	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000872218736	DD	On-Demand	Anodyne	SIGMAR1	27	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000872218736	DD	On-Demand	Anodyne	BIRC2	33	40
CC(C)(O)CN1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000872218738	DD	On-Demand	Anodyne	DRD4	18	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000872218738	DD	On-Demand	Anodyne	SIGMAR1	27	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000872218738	DD	On-Demand	Anodyne	BIRC2	33	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218740	FC	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218740	FC	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218740	FC	On-Demand	Anodyne	ADRB3	51	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218750	FC	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218750	FC	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872218750	FC	On-Demand	Anodyne	ADRB3	51	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218753	DE	On-Demand	Anodyne	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218753	DE	On-Demand	Anodyne	ADRB1	84	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218753	DE	On-Demand	Anodyne	ADRB3	53	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218756	DE	On-Demand	Anodyne	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218756	DE	On-Demand	Anodyne	ADRB1	84	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218756	DE	On-Demand	Anodyne	ADRB3	53	49
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000872218766	EE	On-Demand	Anodyne	DRD4	24	43
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000872218766	EE	On-Demand	Anodyne	CCR2	17	40
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000872218766	EE	On-Demand	Anodyne	MCHR1	38	40
CC(C)(O)CN1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000872218766	EE	On-Demand	Anodyne	CACNA1I	43	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872218771	DE	On-Demand	Bother	ADRB2	20	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872218771	DE	On-Demand	Bother	ADRB1	29	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872218772	DE	On-Demand	Bother	ADRB2	20	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)c1	ZINC000872218772	DE	On-Demand	Bother	ADRB1	29	42
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218778	DE	On-Demand	Mild	ADRB2	34	41
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218778	DE	On-Demand	Mild	ADRB1	51	44
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218784	DE	On-Demand	Mild	ADRB2	34	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872218784	DE	On-Demand	Mild	ADRB1	51	44
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218786	DF	On-Demand	Anodyne	ADRB2	34	47
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218786	DF	On-Demand	Anodyne	ADRB1	41	47
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218786	DF	On-Demand	Anodyne	ABCB1	15	44
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218787	DF	On-Demand	Anodyne	ADRB2	34	47
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218787	DF	On-Demand	Anodyne	ADRB1	41	47
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccccc1Cl	ZINC000872218787	DF	On-Demand	Anodyne	ABCB1	15	44
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	ADRB2	30	68
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	ADRB1	68	50
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	HTR1A	20	68
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	SLC6A4	18	44
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	ADRB3	26	50
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218803	GG	On-Demand	Mild	CYP2D6	18	43
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	ADRB2	30	68
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	ADRB1	68	50
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	HTR1A	20	68
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	SLC6A4	18	44
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	ADRB3	26	50
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872218804	GG	On-Demand	Mild	CYP2D6	18	43
N#Cc1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218823	EF	On-Demand	Mild	ADRB3	23	50
N#Cc1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218824	EF	On-Demand	Mild	ADRB3	23	50
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)[C@@H](C)O1	ZINC000872218842	BD	On-Demand	Anodyne	ADRB3	71	43
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)[C@@H](C)O1	ZINC000872218845	BD	On-Demand	Anodyne	ADRB3	71	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872218856	ED	On-Demand	Anodyne	ADRB2	23	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872218856	ED	On-Demand	Anodyne	ADRB1	55	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872218856	ED	On-Demand	Anodyne	ADRB3	32	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872218857	ED	On-Demand	Anodyne	ADRB2	23	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872218857	ED	On-Demand	Anodyne	ADRB1	55	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872218857	ED	On-Demand	Anodyne	ADRB3	32	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872218858	ED	On-Demand	Anodyne	ADRB2	23	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872218858	ED	On-Demand	Anodyne	ADRB1	55	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872218858	ED	On-Demand	Anodyne	ADRB3	32	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872218859	ED	On-Demand	Anodyne	ADRB2	23	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872218859	ED	On-Demand	Anodyne	ADRB1	55	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872218859	ED	On-Demand	Anodyne	ADRB3	32	45
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218862	FF	On-Demand	Mild	ADRB2	39	49
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218862	FF	On-Demand	Mild	ADRB1	55	39
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218862	FF	On-Demand	Mild	ADRB3	35	49
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218862	FF	On-Demand	Mild	ABCB1	33	41
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218863	FF	On-Demand	Mild	ADRB2	39	49
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218863	FF	On-Demand	Mild	ADRB1	55	39
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218863	FF	On-Demand	Mild	ADRB3	35	49
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872218863	FF	On-Demand	Mild	ABCB1	33	41
N#CCCNC1CCN(c2ccccc2C#N)CC1	ZINC000872218879	CE	On-Demand	Mild	NPY1R	15	40
Cc1ccc(OC[C@H](O)CNC2CCC(OC(C)(C)C)CC2)c(C)c1	ZINC000872218880	EH	On-Demand	Anodyne	ADRB2	23	46
Cc1ccc(OC[C@@H](O)CNC2CCC(OC(C)(C)C)CC2)c(C)c1	ZINC000872218881	EH	On-Demand	Anodyne	ADRB2	23	46
O[C@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218907	CC	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218907	CC	On-Demand	Anodyne	ADRB3	45	45
O[C@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218907	CC	On-Demand	Anodyne	CYP3A4	45	36
O[C@@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218909	CC	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218909	CC	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CN[C@@H]1COC[C@@H]1O)c1cccc(Cl)c1	ZINC000872218909	CC	On-Demand	Anodyne	CYP3A4	45	36
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218956	EE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872218958	EE	On-Demand	Anodyne	ADRB2	21	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218964	GE	On-Demand	Mild	DRD2	17	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218964	GE	On-Demand	Mild	NPY1R	21	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218967	GE	On-Demand	Mild	DRD2	17	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872218967	GE	On-Demand	Mild	NPY1R	21	44
COc1ccccc1COC[C@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872219009	FG	On-Demand	Anodyne	ADRB2	15	42
COc1ccccc1COC[C@@H](O)CNC1CCC(OC(C)(C)C)CC1	ZINC000872219010	FG	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COCc1ccccc1	ZINC000872219017	CE	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COCc1ccccc1	ZINC000872219018	CE	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219019	CE	On-Demand	Anodyne	ADRB2	43	45
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219019	CE	On-Demand	Anodyne	ADRB1	52	45
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219019	CE	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219020	CE	On-Demand	Anodyne	ADRB2	43	45
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219020	CE	On-Demand	Anodyne	ADRB1	52	45
O[C@H](CN[C@@H]1CCCC[C@@H]1F)COc1ccc(F)cc1	ZINC000872219020	CE	On-Demand	Anodyne	ADRB3	28	40
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219025	CE	On-Demand	Mild	ADRB2	26	59
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219025	CE	On-Demand	Mild	ADRB1	75	47
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219025	CE	On-Demand	Mild	CASR	44	47
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219025	CE	On-Demand	Mild	CYP2D6	21	48
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219026	CE	On-Demand	Mild	ADRB2	26	59
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219026	CE	On-Demand	Mild	ADRB1	75	47
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219026	CE	On-Demand	Mild	CASR	44	47
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219026	CE	On-Demand	Mild	CYP2D6	21	48
OC[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872219039	CD	On-Demand	Anodyne	ADRB1	31	45
OC[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872219039	CD	On-Demand	Anodyne	ADRB3	50	49
OC[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872219041	CD	On-Demand	Anodyne	ADRB1	31	45
OC[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872219041	CD	On-Demand	Anodyne	ADRB3	50	49
N#Cc1cccc(S(=O)(=O)CCNc2cccc(OCc3ccccc3)c2)c1	ZINC000872219042	GI	On-Demand	Mild	MAOB	25	42
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219045	CE	On-Demand	Mild	ADRB2	25	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219045	CE	On-Demand	Mild	ADRB1	38	43
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219048	CE	On-Demand	Mild	ADRB2	25	41
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219048	CE	On-Demand	Mild	ADRB1	38	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872219070	GD	On-Demand	Anodyne	GPR119	22	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872219072	GD	On-Demand	Anodyne	GPR119	22	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872219080	GE	On-Demand	Anodyne	ADRB2	17	45
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872219080	GE	On-Demand	Anodyne	ADRB1	15	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872219082	GE	On-Demand	Anodyne	ADRB2	17	45
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872219082	GE	On-Demand	Anodyne	ADRB1	15	45
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1cccc2ccccc12	ZINC000872219117	EF	On-Demand	Anodyne	ADRB2	17	48
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1cccc2ccccc12	ZINC000872219117	EF	On-Demand	Anodyne	ADRB1	16	48
CON(C)C(=O)CCNC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000872219120	DD	On-Demand	Anodyne	DRD4	22	49
CON(C)C(=O)CCNC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000872219122	DD	On-Demand	Anodyne	DRD4	22	49
CON(C)C(=O)CCNC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000872219124	DD	On-Demand	Anodyne	DRD4	22	49
CON(C)C(=O)CCNC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000872219126	DD	On-Demand	Anodyne	DRD4	22	49
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219130	FD	On-Demand	Anodyne	ADRB2	26	42
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219130	FD	On-Demand	Anodyne	ADRB1	30	42
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219130	FD	On-Demand	Anodyne	ADRB3	26	43
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1cccc2ccccc12	ZINC000872219131	EF	On-Demand	Anodyne	ADRB2	17	48
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1cccc2ccccc12	ZINC000872219131	EF	On-Demand	Anodyne	ADRB1	16	48
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219132	FD	On-Demand	Anodyne	ADRB2	26	42
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219132	FD	On-Demand	Anodyne	ADRB1	30	42
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000872219132	FD	On-Demand	Anodyne	ADRB3	26	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872219133	GD	On-Demand	Anodyne	ADRB2	24	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872219133	GD	On-Demand	Anodyne	ADRB1	22	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872219133	GD	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1cccc2ccccc12	ZINC000872219134	EF	On-Demand	Anodyne	ADRB2	17	48
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1cccc2ccccc12	ZINC000872219134	EF	On-Demand	Anodyne	ADRB1	16	48
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872219135	GD	On-Demand	Anodyne	ADRB2	24	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872219135	GD	On-Demand	Anodyne	ADRB1	22	42
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872219135	GD	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1cccc2ccccc12	ZINC000872219136	EF	On-Demand	Anodyne	ADRB2	17	48
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1cccc2ccccc12	ZINC000872219136	EF	On-Demand	Anodyne	ADRB1	16	48
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872219152	DD	On-Demand	Anodyne	ADRB2	20	46
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219159	EG	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219159	EG	On-Demand	Anodyne	ADRB3	77	46
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219159	EG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219159	EG	On-Demand	Anodyne	C3AR1	42	42
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219159	EG	On-Demand	Anodyne	BIRC2	21	44
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219160	EG	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219160	EG	On-Demand	Anodyne	ADRB3	77	46
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219160	EG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219160	EG	On-Demand	Anodyne	C3AR1	42	42
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219160	EG	On-Demand	Anodyne	BIRC2	21	44
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219161	EG	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219161	EG	On-Demand	Anodyne	ADRB3	77	46
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219161	EG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219161	EG	On-Demand	Anodyne	C3AR1	42	42
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219161	EG	On-Demand	Anodyne	BIRC2	21	44
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219162	EG	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219162	EG	On-Demand	Anodyne	ADRB3	77	46
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219162	EG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219162	EG	On-Demand	Anodyne	C3AR1	42	42
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000872219162	EG	On-Demand	Anodyne	BIRC2	21	44
CC(C)(O)CN1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000872219170	GE	On-Demand	Anodyne	CYNT	29	42
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872219179	DD	On-Demand	Anodyne	ADRB2	20	46
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872219182	DD	On-Demand	Anodyne	ADRB2	20	46
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872219186	DD	On-Demand	Anodyne	ADRB2	20	46
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRB2	37	55
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRA1D	33	42
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRA1A	26	42
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRA1B	23	42
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ADRB3	26	45
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219194	GE	On-Demand	Mild	ABCB1	40	43
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRB2	37	55
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRA1D	33	42
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRA1A	26	42
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRA1B	23	42
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ADRB3	26	45
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872219195	GE	On-Demand	Mild	ABCB1	40	43
CN(CCC#N)C[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872219205	EF	On-Demand	Mild	MAOB	21	41
CN(CCC#N)C[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872219206	EF	On-Demand	Mild	MAOB	21	41
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219212	EG	On-Demand	Anodyne	DRD4	22	41
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219212	EG	On-Demand	Anodyne	SIGMAR1	27	47
O[C@@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219212	EG	On-Demand	Anodyne	BIRC2	22	46
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219214	EG	On-Demand	Anodyne	DRD4	22	41
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219214	EG	On-Demand	Anodyne	SIGMAR1	27	47
O[C@@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219214	EG	On-Demand	Anodyne	BIRC2	22	46
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219216	EG	On-Demand	Anodyne	DRD4	22	41
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219216	EG	On-Demand	Anodyne	SIGMAR1	27	47
O[C@H](CN[C@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219216	EG	On-Demand	Anodyne	BIRC2	22	46
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219218	EG	On-Demand	Anodyne	DRD4	22	41
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219218	EG	On-Demand	Anodyne	SIGMAR1	27	47
O[C@H](CN[C@@H]1CCCCCN(Cc2ccccc2)C1)c1ccccn1	ZINC000872219218	EG	On-Demand	Anodyne	BIRC2	22	46
O=S1(=O)CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219223	FF	On-Demand	Anodyne	FFAR1	21	42
C=CCCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000872219232	BF	On-Demand	Mild	ADRB1	20	43
C=CCCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000872219232	BF	On-Demand	Mild	ADRB3	82	43
C=CCCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000872219233	BF	On-Demand	Mild	ADRB1	20	43
C=CCCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000872219233	BF	On-Demand	Mild	ADRB3	82	43
O[C@@H](CNCc1nc(C2CCOCC2)n[nH]1)c1cccc(Cl)c1	ZINC000872219264	EE	On-Demand	Anodyne	CYP3A4	47	35
O[C@H](CNCc1nc(C2CCOCC2)n[nH]1)c1cccc(Cl)c1	ZINC000872219265	EE	On-Demand	Anodyne	CYP3A4	47	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	CTSD	108	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	PGC	65	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	PAPA1_CARPA	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	PGA	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	BACE2	54	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	TACR3	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	REN	92	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	REN1	23	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	BACE1	85	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	FPR1	52	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H](CO)C1	ZINC000872219267	FD	On-Demand	Anodyne	PLM1_PLAFA	31	41
C#CCNC(=O)CCNC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000872219310	DD	On-Demand	Mild	DRD4	17	46
C#CCNC(=O)CCNC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000872219312	DD	On-Demand	Mild	DRD4	17	46
C#CCNC(=O)CCNC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000872219313	DD	On-Demand	Mild	DRD4	17	46
C#CCNC(=O)CCNC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000872219315	DD	On-Demand	Mild	DRD4	17	46
CSc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219361	DG	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219361	DG	On-Demand	Anodyne	ADRB1	39	42
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219362	DG	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219362	DG	On-Demand	Anodyne	ADRB1	39	42
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872219371	ED	On-Demand	Anodyne	ADRB2	38	53
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872219371	ED	On-Demand	Anodyne	ADRB1	30	53
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872219371	ED	On-Demand	Anodyne	ADRB3	24	41
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872219371	ED	On-Demand	Anodyne	ABCB1	38	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872219373	ED	On-Demand	Anodyne	ADRB2	38	53
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872219373	ED	On-Demand	Anodyne	ADRB1	30	53
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872219373	ED	On-Demand	Anodyne	ADRB3	24	41
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872219373	ED	On-Demand	Anodyne	ABCB1	38	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@@H](O)C1CC1	ZINC000872219375	CE	On-Demand	Anodyne	DRD4	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@@H](O)C1CC1	ZINC000872219375	CE	On-Demand	Anodyne	SIGMAR1	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@H](O)C1CC1	ZINC000872219377	CE	On-Demand	Anodyne	DRD4	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC[C@H](O)C1CC1	ZINC000872219377	CE	On-Demand	Anodyne	SIGMAR1	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@H](O)C1CC1	ZINC000872219379	CE	On-Demand	Anodyne	DRD4	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@H](O)C1CC1	ZINC000872219379	CE	On-Demand	Anodyne	SIGMAR1	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@@H](O)C1CC1	ZINC000872219380	CE	On-Demand	Anodyne	DRD4	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC[C@@H](O)C1CC1	ZINC000872219380	CE	On-Demand	Anodyne	SIGMAR1	27	46
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872219411	GD	On-Demand	Anodyne	ADRB2	27	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872219411	GD	On-Demand	Anodyne	ADRB1	34	43
CC(C)(O)CN1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872219411	GD	On-Demand	Anodyne	ADRB3	28	44
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872219412	GD	On-Demand	Anodyne	ADRB2	27	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872219412	GD	On-Demand	Anodyne	ADRB1	34	43
CC(C)(O)CN1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872219412	GD	On-Demand	Anodyne	ADRB3	28	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c(C)c1	ZINC000872219451	ED	On-Demand	Anodyne	ADRB2	22	45
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c(C)c1	ZINC000872219451	ED	On-Demand	Anodyne	ADRB1	16	45
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c(C)c1	ZINC000872219454	ED	On-Demand	Anodyne	ADRB2	22	45
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(CC(C)(C)O)C2)c(C)c1	ZINC000872219454	ED	On-Demand	Anodyne	ADRB1	16	45
N#Cc1ccccc1N1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000872219460	EG	On-Demand	Mild	ADRB3	17	40
CCC[C@H](CCO)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872219467	EE	On-Demand	Anodyne	GPR119	28	41
CCC[C@@H](CCO)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872219468	EE	On-Demand	Anodyne	GPR119	28	41
CCC[C@H](CCO)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872219469	EE	On-Demand	Anodyne	GPR119	28	41
CCC[C@@H](CCO)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872219470	EE	On-Demand	Anodyne	GPR119	28	41
N#Cc1ccccc1N1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000872219472	EG	On-Demand	Mild	ADRB3	17	40
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1ccc2ccccc2c1	ZINC000872219474	EF	On-Demand	Anodyne	ADRB2	15	48
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1ccc2ccccc2c1	ZINC000872219477	EF	On-Demand	Anodyne	ADRB2	15	48
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1ccc2ccccc2c1	ZINC000872219480	EF	On-Demand	Anodyne	ADRB2	15	48
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1ccc2ccccc2c1	ZINC000872219481	EF	On-Demand	Anodyne	ADRB2	15	48
O[C@]1(CN[C@@H]2CCCC[C@@H]2F)CCN(Cc2ccccc2)C1	ZINC000872219484	DE	On-Demand	Anodyne	SIGMAR1	54	40
O[C@]1(CN[C@@H]2CCCC[C@@H]2F)CCN(Cc2ccccc2)C1	ZINC000872219484	DE	On-Demand	Anodyne	NPFFR1	43	39
O[C@@]1(CN[C@@H]2CCCC[C@@H]2F)CCN(Cc2ccccc2)C1	ZINC000872219485	DE	On-Demand	Anodyne	SIGMAR1	54	40
O[C@@]1(CN[C@@H]2CCCC[C@@H]2F)CCN(Cc2ccccc2)C1	ZINC000872219485	DE	On-Demand	Anodyne	NPFFR1	43	39
COc1ccc(OC)c([C@H](O)CNCC[C@H](O)C(F)F)c1	ZINC000872219544	DD	On-Demand	Anodyne	ADRB2	15	47
COc1ccc(OC)c([C@H](O)CNCC[C@@H](O)C(F)F)c1	ZINC000872219548	DD	On-Demand	Anodyne	ADRB2	15	47
O=C(/C=C\c1ccco1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872219584	DG	On-Demand	Anodyne	L3MBTL3	52	36
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219590	GH	On-Demand	Anodyne	ADRB2	36	45
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219590	GH	On-Demand	Anodyne	ADRB3	70	45
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219590	GH	On-Demand	Anodyne	PTGER3	45	34
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219590	GH	On-Demand	Anodyne	FFAR1	41	41
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219590	GH	On-Demand	Anodyne	PDS	64	33
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219591	GH	On-Demand	Anodyne	ADRB2	36	45
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219591	GH	On-Demand	Anodyne	ADRB3	70	45
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219591	GH	On-Demand	Anodyne	PTGER3	45	34
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219591	GH	On-Demand	Anodyne	FFAR1	41	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872219591	GH	On-Demand	Anodyne	PDS	64	33
CC(C)(C)OC(=O)N1C[C@H](CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000872219592	GH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(C)OC(=O)N1C[C@H](CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000872219592	GH	On-Demand	Anodyne	ADRB3	95	44
CC(C)(C)OC(=O)N1C[C@H](CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000872219593	GH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(C)OC(=O)N1C[C@H](CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000872219593	GH	On-Demand	Anodyne	ADRB3	95	44
CC(C)(C)OC(=O)N1C[C@@H](CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000872219594	GH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(C)OC(=O)N1C[C@@H](CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000872219594	GH	On-Demand	Anodyne	ADRB3	95	44
CC(C)(C)OC(=O)N1C[C@@H](CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000872219595	GH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(C)OC(=O)N1C[C@@H](CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000872219595	GH	On-Demand	Anodyne	ADRB3	95	44
O[C@@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219601	EG	On-Demand	Anodyne	ADRB2	28	44
O[C@@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219601	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219601	EG	On-Demand	Anodyne	GNRHR	21	46
O[C@@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219601	EG	On-Demand	Anodyne	ADRB3	106	49
O[C@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219602	EG	On-Demand	Anodyne	ADRB2	28	44
O[C@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219602	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219602	EG	On-Demand	Anodyne	GNRHR	21	46
O[C@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1cccnc1	ZINC000872219602	EG	On-Demand	Anodyne	ADRB3	106	49
O[C@@H](CNCc1ccnc(-n2cncn2)c1)COc1cccc(C(F)(F)F)c1	ZINC000872219605	GE	On-Demand	Anodyne	PDS	43	37
O[C@H](CNCc1ccnc(-n2cncn2)c1)COc1cccc(C(F)(F)F)c1	ZINC000872219606	GE	On-Demand	Anodyne	PDS	43	37
CN(Cc1ccncc1)C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	ZINC000872219620	GF	On-Demand	Anodyne	TSPO	22	40
CC(C)(C)OC(=O)COCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000872219642	EE	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)COCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000872219642	EE	On-Demand	Anodyne	ADRB3	35	40
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219669	FE	On-Demand	Anodyne	ADRB2	31	55
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219669	FE	On-Demand	Anodyne	ADRB1	54	55
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219669	FE	On-Demand	Anodyne	ADRB3	34	40
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219670	FE	On-Demand	Anodyne	ADRB2	31	55
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219670	FE	On-Demand	Anodyne	ADRB1	54	55
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)cc1	ZINC000872219670	FE	On-Demand	Anodyne	ADRB3	34	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRB2	31	51
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRB1	55	39
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRA1D	21	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRA1A	16	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRA1B	16	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ADRB3	24	42
N#Cc1ccccc1N1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872219713	GG	On-Demand	Mild	ABCB1	28	41
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRB2	31	51
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRB1	55	39
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRA1D	21	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRA1A	16	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRA1B	16	40
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ADRB3	24	42
N#Cc1ccccc1N1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872219714	GG	On-Demand	Mild	ABCB1	28	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000872219723	EE	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000872219724	EE	On-Demand	Anodyne	ADRB2	19	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	LPL	35	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	CNR2	17	58
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	CPT1A	76	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	CPT2	49	37
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	EPHX2	28	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	CPT1B	43	37
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	F13A1	44	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	LIPG	16	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872219726	JG	On-Demand	Anodyne	L3MBTL3	63	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCC[C@@H]2F)CC1	ZINC000872219729	EF	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCC[C@@H]2F)CC1	ZINC000872219730	EF	On-Demand	Anodyne	GPR119	29	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219754	DE	On-Demand	Bother	ADRB2	28	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219754	DE	On-Demand	Bother	ADRB1	48	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219755	DE	On-Demand	Bother	ADRB2	28	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219755	DE	On-Demand	Bother	ADRB1	48	32
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219774	EE	On-Demand	Anodyne	ADRB2	33	49
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219774	EE	On-Demand	Anodyne	ADRB1	36	49
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219775	EE	On-Demand	Anodyne	ADRB2	33	49
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCCC[C@@H]1F	ZINC000872219775	EE	On-Demand	Anodyne	ADRB1	36	49
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219780	DE	On-Demand	Anodyne	ADRB2	39	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219780	DE	On-Demand	Anodyne	ADRB1	56	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219781	DE	On-Demand	Anodyne	ADRB2	39	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@@H]2F)cc1	ZINC000872219781	DE	On-Demand	Anodyne	ADRB1	56	44
N#Cc1ccccc1N1CCC(NCCS(=O)(=O)c2ccccc2)CC1	ZINC000872219807	FF	On-Demand	Mild	NPY1R	18	40
O[C@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219810	CG	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219810	CG	On-Demand	Anodyne	ADRB3	53	46
O[C@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219810	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219811	CG	On-Demand	Anodyne	ADRB1	41	44
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219811	CG	On-Demand	Anodyne	ADRB3	53	46
O[C@@H](CN[C@@H]1CCCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872219811	CG	On-Demand	Anodyne	CYP3A4	40	33
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1ccccc1	ZINC000872219817	CF	On-Demand	Anodyne	HDAC10	25	42
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1ccccc1	ZINC000872219817	CF	On-Demand	Anodyne	HDAC2	15	42
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1ccccc1	ZINC000872219817	CF	On-Demand	Anodyne	HDAC3	17	42
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1ccccc1	ZINC000872219817	CF	On-Demand	Anodyne	HDAC6	19	42
O=C(CCN[C@H]1CCCC[C@H]1F)Nc1ccccc1	ZINC000872219817	CF	On-Demand	Anodyne	HDAC11	20	42
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219849	CF	On-Demand	Anodyne	ADRB2	49	57
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219849	CF	On-Demand	Anodyne	ADRB1	59	46
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219849	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@H]1C2	ZINC000872219850	CF	On-Demand	Anodyne	ADRB2	49	57
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@H]1C2	ZINC000872219850	CF	On-Demand	Anodyne	ADRB1	59	46
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@H]1C2	ZINC000872219850	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@H]1C2	ZINC000872219851	CF	On-Demand	Anodyne	ADRB2	49	57
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@H]1C2	ZINC000872219851	CF	On-Demand	Anodyne	ADRB1	59	46
C[C@H](NC[C@H](O)COc1ccccc1)[C@@]12CCCC[C@H]1C2	ZINC000872219851	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@@H]1C2	ZINC000872219852	CF	On-Demand	Anodyne	ADRB2	49	57
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@@H]1C2	ZINC000872219852	CF	On-Demand	Anodyne	ADRB1	59	46
C[C@H](NC[C@H](O)COc1ccccc1)[C@]12CCCC[C@@H]1C2	ZINC000872219852	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@H]1C2	ZINC000872219865	EG	On-Demand	Mild	ADRB2	31	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@H]1C2	ZINC000872219865	EG	On-Demand	Mild	ADRB1	39	48
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@H]1C2	ZINC000872219865	EG	On-Demand	Mild	ADRB3	16	40
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219866	EG	On-Demand	Mild	ADRB2	31	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219866	EG	On-Demand	Mild	ADRB1	39	48
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@@]12CCCC[C@@H]1C2	ZINC000872219866	EG	On-Demand	Mild	ADRB3	16	40
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@H]1C2	ZINC000872219867	EG	On-Demand	Mild	ADRB2	31	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@H]1C2	ZINC000872219867	EG	On-Demand	Mild	ADRB1	39	48
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@H]1C2	ZINC000872219867	EG	On-Demand	Mild	ADRB3	16	40
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@@H]1C2	ZINC000872219868	EG	On-Demand	Mild	ADRB2	31	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@@H]1C2	ZINC000872219868	EG	On-Demand	Mild	ADRB1	39	48
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)[C@]12CCCC[C@@H]1C2	ZINC000872219868	EG	On-Demand	Mild	ADRB3	16	40
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@H]1C2	ZINC000872219876	EF	On-Demand	Bother	ADRB2	20	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@H]1C2	ZINC000872219876	EF	On-Demand	Bother	ADRB1	25	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@H]1C2	ZINC000872219877	EF	On-Demand	Bother	ADRB2	20	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@H]1C2	ZINC000872219877	EF	On-Demand	Bother	ADRB1	25	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@@H]1C2	ZINC000872219878	EF	On-Demand	Bother	ADRB2	20	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@@H]1C2	ZINC000872219878	EF	On-Demand	Bother	ADRB1	25	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@@H]1C2	ZINC000872219879	EF	On-Demand	Bother	ADRB2	20	43
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@@H]1C2	ZINC000872219879	EF	On-Demand	Bother	ADRB1	25	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872219920	EF	On-Demand	Anodyne	ADRB2	40	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872219920	EF	On-Demand	Anodyne	ADRB1	68	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872219920	EF	On-Demand	Anodyne	ADRB3	39	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872219921	EF	On-Demand	Anodyne	ADRB2	40	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872219921	EF	On-Demand	Anodyne	ADRB1	68	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872219921	EF	On-Demand	Anodyne	ADRB3	39	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872219922	EF	On-Demand	Anodyne	ADRB2	40	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872219922	EF	On-Demand	Anodyne	ADRB1	68	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872219922	EF	On-Demand	Anodyne	ADRB3	39	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872219923	EF	On-Demand	Anodyne	ADRB2	40	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872219923	EF	On-Demand	Anodyne	ADRB1	68	62
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872219923	EF	On-Demand	Anodyne	ADRB3	39	45
Cc1ncc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000872219926	FG	On-Demand	Anodyne	GPR119	55	44
Cc1ncc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000872219927	FG	On-Demand	Anodyne	GPR119	55	44
Cc1ncc([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000872219929	FG	On-Demand	Anodyne	GPR119	55	44
Cc1ncc([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000872219931	FG	On-Demand	Anodyne	GPR119	55	44
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])[C@]12CCCC[C@@H]1C2	ZINC000872219932	EF	On-Demand	Bother	ADRB2	25	44
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@]12CCCC[C@@H]1C2	ZINC000872219933	EF	On-Demand	Bother	ADRB2	25	44
CCOC(=O)C1CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219935	GI	On-Demand	Anodyne	LTA4H	19	44
CCOC(=O)C1CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219935	GI	On-Demand	Anodyne	ADAM17	22	41
CCOC(=O)C1CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219935	GI	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)C1CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219935	GI	On-Demand	Anodyne	FFAR1	52	36
CCOC(=O)C1CCC(O)(CNc2cccc(OCc3ccccc3)c2)CC1	ZINC000872219935	GI	On-Demand	Anodyne	SLC12A5	43	35
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@]12CCCC[C@H]1C2	ZINC000872219936	EF	On-Demand	Bother	ADRB2	25	44
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	DRD4	34	45
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	HRH2	40	43
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	SLC6A1	49	31
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	HRH3	17	44
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	SIGMAR1	36	48
C#CCNC(=O)CCN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219937	EE	On-Demand	Mild	BIRC2	27	49
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])[C@]12CCCC[C@H]1C2	ZINC000872219938	EF	On-Demand	Bother	ADRB2	25	44
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	DRD4	34	45
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	HRH2	40	43
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	SLC6A1	49	31
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	HRH3	17	44
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	SIGMAR1	36	48
C#CCNC(=O)CCN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000872219939	EE	On-Demand	Mild	BIRC2	27	49
CN(Cc1ccncc1)C(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	ZINC000872219984	GG	On-Demand	Anodyne	TSPO	22	40
CC(C)(C)OC(=O)COCCNC[C@H](O)c1ccccc1	ZINC000872219993	CD	On-Demand	Anodyne	ADRB2	43	37
CC(C)(C)OC(=O)COCCNC[C@H](O)c1ccccc1	ZINC000872219993	CD	On-Demand	Anodyne	ADRB1	53	43
CC(C)(C)OC(=O)COCCNC[C@H](O)c1ccccc1	ZINC000872219993	CD	On-Demand	Anodyne	ADRB3	65	49
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1ccccc1	ZINC000872219994	CD	On-Demand	Anodyne	ADRB2	43	37
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1ccccc1	ZINC000872219994	CD	On-Demand	Anodyne	ADRB1	53	43
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1ccccc1	ZINC000872219994	CD	On-Demand	Anodyne	ADRB3	65	49
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872219999	EE	On-Demand	Anodyne	ADRB2	60	44
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872219999	EE	On-Demand	Anodyne	ADRB1	68	50
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872219999	EE	On-Demand	Anodyne	ADRB3	80	50
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872220000	EE	On-Demand	Anodyne	ADRB2	60	44
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872220000	EE	On-Demand	Anodyne	ADRB1	68	50
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872220000	EE	On-Demand	Anodyne	ADRB3	80	50
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220010	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220010	GF	On-Demand	Anodyne	ADRB1	71	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220010	GF	On-Demand	Anodyne	ADRB3	45	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220011	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220011	GF	On-Demand	Anodyne	ADRB1	71	43
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220011	GF	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C#N)C[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220020	DH	On-Demand	Mild	MAOB	21	40
CC(C)(C#N)C[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220020	DH	On-Demand	Mild	PDS	59	35
CC(C)(C#N)C[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220021	DH	On-Demand	Mild	MAOB	21	40
CC(C)(C#N)C[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220021	DH	On-Demand	Mild	PDS	59	35
O[C@@H](CNC[C@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220022	DH	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNC[C@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220022	DH	On-Demand	Anodyne	ADRB3	83	43
O[C@H](CNC[C@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220023	DH	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNC[C@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220023	DH	On-Demand	Anodyne	ADRB3	83	43
O[C@H](CNC[C@@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220024	DH	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNC[C@@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220024	DH	On-Demand	Anodyne	ADRB3	83	43
O[C@@H](CNC[C@@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220025	DH	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNC[C@@]1(Cc2ccccc2)C=CCCC1)c1cccnc1	ZINC000872220025	DH	On-Demand	Anodyne	ADRB3	83	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872220079	EG	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872220079	EG	On-Demand	Anodyne	ADRB1	42	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872220080	EG	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872220080	EG	On-Demand	Anodyne	ADRB1	42	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872220081	EG	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872220081	EG	On-Demand	Anodyne	ADRB1	42	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872220082	EG	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872220082	EG	On-Demand	Anodyne	ADRB1	42	44
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@H]1C2	ZINC000872220098	DG	On-Demand	Bother	CACNA1D	40	33
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@@H]1C2	ZINC000872220099	DG	On-Demand	Bother	CACNA1D	40	33
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@]12CCCC[C@@H]1C2	ZINC000872220100	DG	On-Demand	Bother	CACNA1D	40	33
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@]12CCCC[C@H]1C2	ZINC000872220101	DG	On-Demand	Bother	CACNA1D	40	33
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872220111	FD	On-Demand	Anodyne	ADRB3	48	45
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872220112	FD	On-Demand	Anodyne	ADRB3	48	45
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872220113	EG	On-Demand	Anodyne	ADRB2	40	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872220113	EG	On-Demand	Anodyne	ADRB1	58	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)cc1	ZINC000872220113	EG	On-Demand	Anodyne	ADRB3	32	44
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872220114	EG	On-Demand	Anodyne	ADRB2	40	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872220114	EG	On-Demand	Anodyne	ADRB1	58	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000872220114	EG	On-Demand	Anodyne	ADRB3	32	44
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872220115	EG	On-Demand	Anodyne	ADRB2	40	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872220115	EG	On-Demand	Anodyne	ADRB1	58	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)cc1	ZINC000872220115	EG	On-Demand	Anodyne	ADRB3	32	44
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872220116	EG	On-Demand	Anodyne	ADRB2	40	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872220116	EG	On-Demand	Anodyne	ADRB1	58	63
COCCc1ccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)cc1	ZINC000872220116	EG	On-Demand	Anodyne	ADRB3	32	44
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(F)cc1C	ZINC000872220128	DC	On-Demand	Anodyne	LEF	68	34
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(F)cc1C	ZINC000872220129	DC	On-Demand	Anodyne	LEF	68	34
O[C@@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1ccccn1	ZINC000872220173	EG	On-Demand	Anodyne	GNRHR	18	42
O[C@H](CNCCc1c(C(F)(F)F)[nH]c2ccccc12)c1ccccn1	ZINC000872220174	EG	On-Demand	Anodyne	GNRHR	18	42
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Br)c1	ZINC000872220189	FE	On-Demand	Anodyne	ADRB2	42	34
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Br)c1	ZINC000872220189	FE	On-Demand	Anodyne	ADRB1	48	36
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(Br)c1	ZINC000872220189	FE	On-Demand	Anodyne	ADRB3	56	38
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872220190	FE	On-Demand	Anodyne	ADRB2	42	34
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872220190	FE	On-Demand	Anodyne	ADRB1	48	36
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872220190	FE	On-Demand	Anodyne	ADRB3	56	38
C[C@@H]1[C@@H](NC[C@@H](O)c2ccccn2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C	ZINC000872220328	FF	On-Demand	Anodyne	GPR119	15	41
C[C@@H]1[C@@H](NC[C@H](O)c2ccccn2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C	ZINC000872220331	FF	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)CC1	ZINC000872220332	EF	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)CC1	ZINC000872220332	EF	On-Demand	Anodyne	ADRB3	83	49
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccnc2)CC1	ZINC000872220333	EF	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccnc2)CC1	ZINC000872220333	EF	On-Demand	Anodyne	ADRB3	83	49
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000872220373	DD	On-Demand	Anodyne	ADRB2	41	34
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000872220373	DD	On-Demand	Anodyne	ADRB1	47	44
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000872220373	DD	On-Demand	Anodyne	ADRB3	54	44
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000872220374	DD	On-Demand	Anodyne	ADRB2	41	34
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000872220374	DD	On-Demand	Anodyne	ADRB1	47	44
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000872220374	DD	On-Demand	Anodyne	ADRB3	54	44
C[C@@H](CNc1cccc(OCc2ccccc2)c1)S(C)(=O)=O	ZINC000872220401	DG	On-Demand	Anodyne	ACE2	17	41
C[C@@H](CNc1cccc(OCc2ccccc2)c1)S(C)(=O)=O	ZINC000872220401	DG	On-Demand	Anodyne	ADAMTS4	35	41
C[C@@H](CNc1cccc(OCc2ccccc2)c1)S(C)(=O)=O	ZINC000872220401	DG	On-Demand	Anodyne	PDS	70	35
N#Cc1ccc([C@H](O)CNC[C@@H](n2cncn2)C(F)(F)F)cc1	ZINC000872220421	ED	On-Demand	Mild	CYP19A1	18	49
N#Cc1ccc([C@H](O)CNC[C@H](n2cncn2)C(F)(F)F)cc1	ZINC000872220422	ED	On-Demand	Mild	CYP19A1	18	49
N#Cc1ccc([C@@H](O)CNC[C@@H](n2cncn2)C(F)(F)F)cc1	ZINC000872220423	ED	On-Demand	Mild	CYP19A1	18	49
N#Cc1ccc([C@@H](O)CNC[C@H](n2cncn2)C(F)(F)F)cc1	ZINC000872220424	ED	On-Demand	Mild	CYP19A1	18	49
CNS(=O)(=O)CCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000872220460	DC	On-Demand	Anodyne	LEF	57	34
CNS(=O)(=O)CCCNC[C@H](O)c1cc(F)ccc1F	ZINC000872220461	DC	On-Demand	Anodyne	LEF	57	34
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	AVPR2	88	44
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	DRD3	18	41
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	AVPR1A	51	44
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	NPY2R	20	41
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	PRNP	66	46
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	HDAC1	15	42
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	EPHX2	24	46
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	DPP7	15	41
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	SLC1A2	21	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	MCHR1	17	43
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	DGAT1	25	42
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220495	IH	On-Demand	Anodyne	L3MBTL3	70	39
C[C@@H](CN[C@H]1CCN(C(=O)OC(C)(C)C)CC(C)(C)C1)S(C)(=O)=O	ZINC000872220504	FE	On-Demand	Anodyne	GPR119	31	41
C[C@@H](CN[C@@H]1CCN(C(=O)OC(C)(C)C)CC(C)(C)C1)S(C)(=O)=O	ZINC000872220506	FE	On-Demand	Anodyne	GPR119	31	41
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(F)c1	ZINC000872220512	CC	On-Demand	Anodyne	ADRB1	41	44
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(F)c1	ZINC000872220512	CC	On-Demand	Anodyne	ADRB3	76	44
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(F)c1	ZINC000872220513	CC	On-Demand	Anodyne	ADRB1	41	44
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(F)c1	ZINC000872220513	CC	On-Demand	Anodyne	ADRB3	76	44
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000872220521	FD	On-Demand	Anodyne	LEF	43	32
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000872220522	FD	On-Demand	Anodyne	LEF	43	32
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000872220526	GG	On-Demand	Anodyne	NAMPT	19	48
Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	ZINC000872220560	FF	On-Demand	Bother	AVPR2	38	48
Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	ZINC000872220560	FF	On-Demand	Bother	TAAR1	43	46
Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	ZINC000872220560	FF	On-Demand	Bother	L3MBTL3	67	45
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	ADRB2	32	54
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	ADRB1	83	52
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	MAOB	16	46
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	ADRB3	23	51
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	CASR	51	52
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	CYP2D6	24	52
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	ABCB1	26	41
N#Cc1ccccc1OC[C@@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220581	FH	On-Demand	Mild	PDS	44	36
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	ADRB2	32	54
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	ADRB1	83	52
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	MAOB	16	46
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	ADRB3	23	51
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	CASR	51	52
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	CYP2D6	24	52
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	ABCB1	26	41
N#Cc1ccccc1OC[C@H](O)CNc1cccc(OCc2ccccc2)c1	ZINC000872220582	FH	On-Demand	Mild	PDS	44	36
O[C@@H](CNc1cccc(OCc2ccccc2)c1)COCc1ccccc1F	ZINC000872220585	GI	On-Demand	Anodyne	PDS	52	34
O[C@H](CNc1cccc(OCc2ccccc2)c1)COCc1ccccc1F	ZINC000872220586	GI	On-Demand	Anodyne	PDS	52	34
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	ADRB2	40	42
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	ADRB1	64	39
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	MAOB	29	54
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	ADRB3	38	42
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	CASR	41	38
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	ABCB1	18	40
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	FFAR1	17	40
N#Cc1ccc(OC[C@@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220594	FH	On-Demand	Mild	PDS	64	43
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	ADRB2	40	42
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	ADRB1	64	39
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	MAOB	29	54
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	ADRB3	38	42
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	CASR	41	38
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	ABCB1	18	40
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	FFAR1	17	40
N#Cc1ccc(OC[C@H](O)CNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220595	FH	On-Demand	Mild	PDS	64	43
Cc1ccc(OC[C@@H](O)CNCc2ccnc(-n3cncn3)c2)cc1	ZINC000872220604	ED	On-Demand	Anodyne	ADRB2	21	42
Cc1ccc(OC[C@@H](O)CNCc2ccnc(-n3cncn3)c2)cc1	ZINC000872220604	ED	On-Demand	Anodyne	ADRB1	32	41
Cc1ccc(OC[C@H](O)CNCc2ccnc(-n3cncn3)c2)cc1	ZINC000872220605	ED	On-Demand	Anodyne	ADRB2	21	42
Cc1ccc(OC[C@H](O)CNCc2ccnc(-n3cncn3)c2)cc1	ZINC000872220605	ED	On-Demand	Anodyne	ADRB1	32	41
OC1(CNc2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000872220632	DG	On-Demand	Anodyne	ALOX5	24	45
OC1(CNc2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000872220632	DG	On-Demand	Anodyne	MAOB	26	42
OC1(CNc2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000872220632	DG	On-Demand	Anodyne	ICMT	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000872220716	FG	On-Demand	Mild	ADRB3	16	49
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000872220717	FG	On-Demand	Mild	ADRB3	16	49
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	AVPR2	104	44
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	AVPR1A	54	43
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	LPL	48	33
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	NPY2R	41	41
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	CPT1A	51	38
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	GRM4	35	41
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	NR2E3	61	33
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	SMO	24	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220730	JJ	On-Demand	Anodyne	L3MBTL3	70	37
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872220791	FD	On-Demand	Anodyne	ADRB3	64	39
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(Br)c1	ZINC000872220792	FD	On-Demand	Anodyne	ADRB3	64	39
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@@]12CCCC[C@H]1C2	ZINC000872220796	EG	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@@]12CCCC[C@H]1C2	ZINC000872220796	EG	On-Demand	Anodyne	ADRB1	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@]12CCCC[C@@H]1C2	ZINC000872220797	EG	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@]12CCCC[C@@H]1C2	ZINC000872220797	EG	On-Demand	Anodyne	ADRB1	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@@]12CCCC[C@@H]1C2	ZINC000872220798	EG	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@@]12CCCC[C@@H]1C2	ZINC000872220798	EG	On-Demand	Anodyne	ADRB1	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@]12CCCC[C@H]1C2	ZINC000872220799	EG	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)[C@]12CCCC[C@H]1C2	ZINC000872220799	EG	On-Demand	Anodyne	ADRB1	27	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220870	GF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220870	GF	On-Demand	Anodyne	ADRB1	64	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220870	GF	On-Demand	Anodyne	ABCB1	19	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220870	GF	On-Demand	Anodyne	PDS	46	35
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220871	GF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220871	GF	On-Demand	Anodyne	ADRB1	64	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220871	GF	On-Demand	Anodyne	ABCB1	19	46
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000872220871	GF	On-Demand	Anodyne	PDS	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccccc2)CC1	ZINC000872220889	GG	On-Demand	Anodyne	ACACB	17	48
N#Cc1ccc(S(=O)(=O)CCNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220901	GI	On-Demand	Mild	MAOB	29	41
N#Cc1ccc(S(=O)(=O)CCNc2cccc(OCc3ccccc3)c2)cc1	ZINC000872220901	GI	On-Demand	Mild	ADAMTS4	18	40
CON(C)C(=O)CCNCCc1c(C(F)(F)F)[nH]c2ccccc12	ZINC000872220915	EF	On-Demand	Anodyne	GNRHR	32	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220925	FF	On-Demand	Anodyne	ADRB2	38	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220925	FF	On-Demand	Anodyne	ADRB1	63	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220925	FF	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220926	FF	On-Demand	Anodyne	ADRB2	38	47
Cc1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220926	FF	On-Demand	Anodyne	ADRB1	63	43
Cc1ccc(OC[C@H](O)CNCc2ccc(C3(C)OCCO3)cc2)cc1	ZINC000872220926	FF	On-Demand	Anodyne	ADRB3	37	42
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000872220927	CD	On-Demand	Anodyne	ADRB2	30	49
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000872220927	CD	On-Demand	Anodyne	ADRB1	46	49
CC(C)(C)OC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000872220927	CD	On-Demand	Anodyne	ADRB3	119	50
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000872220928	CD	On-Demand	Anodyne	ADRB2	30	49
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000872220928	CD	On-Demand	Anodyne	ADRB1	46	49
CC(C)(C)OC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000872220928	CD	On-Demand	Anodyne	ADRB3	119	50
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	AVPR2	61	41
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	AVPR1A	31	41
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	CPT1A	60	38
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	PRNP	66	36
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	TAAR1	36	41
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	HCN4	45	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	L3MBTL3	58	42
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	KCNK3	80	45
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872220982	JI	On-Demand	Anodyne	KCNK9	53	45
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220989	IK	On-Demand	Anodyne	AVPR2	81	43
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220989	IK	On-Demand	Anodyne	AVPR1A	47	43
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220989	IK	On-Demand	Anodyne	NPY2R	18	41
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220989	IK	On-Demand	Anodyne	BCHE	15	45
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872220989	IK	On-Demand	Anodyne	L3MBTL3	57	36
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)c1	ZINC000872220996	EG	On-Demand	Anodyne	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)c1	ZINC000872220996	EG	On-Demand	Anodyne	ADRB1	37	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@@H]2C3)c1	ZINC000872220996	EG	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)c1	ZINC000872220997	EG	On-Demand	Anodyne	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)c1	ZINC000872220997	EG	On-Demand	Anodyne	ADRB1	37	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@]23CCCC[C@H]2C3)c1	ZINC000872220997	EG	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)c1	ZINC000872220998	EG	On-Demand	Anodyne	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)c1	ZINC000872220998	EG	On-Demand	Anodyne	ADRB1	37	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@H]2C3)c1	ZINC000872220998	EG	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)c1	ZINC000872220999	EG	On-Demand	Anodyne	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)c1	ZINC000872220999	EG	On-Demand	Anodyne	ADRB1	37	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)[C@@]23CCCC[C@@H]2C3)c1	ZINC000872220999	EG	On-Demand	Anodyne	ABCB1	15	41
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000872221006	ED	On-Demand	Anodyne	ADRB2	18	40
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000872221007	ED	On-Demand	Anodyne	ADRB2	18	40
CNS(=O)(=O)CCCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000872221025	EC	On-Demand	Anodyne	ADRB2	26	44
CNS(=O)(=O)CCCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000872221034	EC	On-Demand	Anodyne	ADRB2	26	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2ccccn2)CC1	ZINC000872221036	EF	On-Demand	Anodyne	ACACB	16	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2ccccn2)CC1	ZINC000872221038	EF	On-Demand	Anodyne	ACACB	16	44
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C	ZINC000872221083	FF	On-Demand	Anodyne	ADRB3	48	42
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C	ZINC000872221084	FF	On-Demand	Anodyne	ADRB3	48	42
O[C@H](CNC[C@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221096	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNC[C@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221096	EE	On-Demand	Anodyne	ADRB3	39	43
O[C@@H](CNC[C@@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221098	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNC[C@@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221098	EE	On-Demand	Anodyne	ADRB3	39	43
O[C@@H](CNC[C@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221099	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNC[C@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221099	EE	On-Demand	Anodyne	ADRB3	39	43
O[C@H](CNC[C@@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221100	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNC[C@@H](n1cncn1)C(F)(F)F)c1cccc(Cl)c1	ZINC000872221100	EE	On-Demand	Anodyne	ADRB3	39	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2ccccc2)CC1	ZINC000872221130	EG	On-Demand	Anodyne	ADRB3	44	39
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2ccccc2)CC1	ZINC000872221130	EG	On-Demand	Anodyne	ACACB	17	47
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2ccccc2)CC1	ZINC000872221131	EG	On-Demand	Anodyne	ADRB3	44	39
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2ccccc2)CC1	ZINC000872221131	EG	On-Demand	Anodyne	ACACB	17	47
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872221132	DC	On-Demand	Anodyne	ADRB2	60	44
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872221132	DC	On-Demand	Anodyne	ADRB1	68	49
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872221132	DC	On-Demand	Anodyne	ADRB3	96	53
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872221134	DC	On-Demand	Anodyne	ADRB2	60	44
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872221134	DC	On-Demand	Anodyne	ADRB1	68	49
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872221134	DC	On-Demand	Anodyne	ADRB3	96	53
C[C@@](O)(C[C@H](O)CNc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000872221164	EH	On-Demand	Anodyne	PDS	49	31
C[C@@](O)(C[C@@H](O)CNc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000872221165	EH	On-Demand	Anodyne	PDS	49	31
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	MME	66	37
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	PGC	55	41
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	PAPA1_CARPA	64	51
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CCKAR	60	37
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CTSK	31	57
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CTSL	28	51
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	PGA	25	41
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CTRB1	42	37
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	TACR3	18	44
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CAPNS1	46	31
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	HLA-DRB1	21	41
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	REN	69	44
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CAPN1	48	44
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CAPN2	45	31
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	FPR1	64	45
CC(C)(O)CNCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221204	EF	On-Demand	Anodyne	CTRB_BOVIN	39	44
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	MME	66	37
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	PGC	55	41
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	PAPA1_CARPA	64	51
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CCKAR	60	37
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CTSK	31	57
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CTSL	28	51
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	PGA	25	41
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CTRB1	42	37
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	TACR3	18	44
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CAPNS1	46	31
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	HLA-DRB1	21	41
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	REN	69	44
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CAPN1	48	44
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CAPN2	45	31
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	FPR1	64	45
CC(C)(O)CNCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872221205	EF	On-Demand	Anodyne	CTRB_BOVIN	39	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3cccnc3c2)CC1	ZINC000872221387	GG	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3cccnc3c2)CC1	ZINC000872221387	GG	On-Demand	Anodyne	GPR119	52	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3cccnc3c2)CC1	ZINC000872221388	GG	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3cccnc3c2)CC1	ZINC000872221388	GG	On-Demand	Anodyne	GPR119	52	46
O=C(/C=C/c1ccc(Br)o1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872221395	GH	On-Demand	Anodyne	L3MBTL3	51	35
O=C(/C=C\c1ccc(Br)o1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872221396	GH	On-Demand	Anodyne	L3MBTL3	51	35
CCOC(=O)C1CCC(O)(CNC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000872221416	GF	On-Demand	Mild	NPY1R	22	43
O[C@@H](CN[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21)c1cccnc1	ZINC000872221449	EF	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CN[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21)c1cccnc1	ZINC000872221450	EF	On-Demand	Anodyne	ADRB3	35	42
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000872221458	EF	On-Demand	Mild	ADRA1D	19	41
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000872221458	EF	On-Demand	Mild	ADRA1B	15	41
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000872221458	EF	On-Demand	Mild	ADRB3	23	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000872221460	EF	On-Demand	Mild	ADRA1D	19	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000872221460	EF	On-Demand	Mild	ADRA1B	15	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000872221460	EF	On-Demand	Mild	ADRB3	23	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)CC2CCCC2)CC1	ZINC000872221509	EG	On-Demand	Mild	ADRA1D	20	41
N#Cc1ccccc1N1CCC(NC[C@@H](O)CC2CCCC2)CC1	ZINC000872221509	EG	On-Demand	Mild	ADRA1A	15	41
N#Cc1ccccc1N1CCC(NC[C@H](O)CC2CCCC2)CC1	ZINC000872221510	EG	On-Demand	Mild	ADRA1D	20	41
N#Cc1ccccc1N1CCC(NC[C@H](O)CC2CCCC2)CC1	ZINC000872221510	EG	On-Demand	Mild	ADRA1A	15	41
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000872221538	FH	On-Demand	Mild	ADRB3	24	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000872221543	FH	On-Demand	Mild	ADRB3	24	40
N#Cc1cccc(S(=O)(=O)CCNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872221544	GE	On-Demand	Mild	NPY1R	18	41
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(C)cc1	ZINC000872221627	CC	On-Demand	Anodyne	ADRB2	24	45
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(C)cc1	ZINC000872221628	CC	On-Demand	Anodyne	ADRB2	24	45
CNS(=O)(=O)CCCNC[C@@H](O)c1ccccc1	ZINC000872221633	CC	On-Demand	Anodyne	ADRB2	48	45
CNS(=O)(=O)CCCNC[C@@H](O)c1ccccc1	ZINC000872221633	CC	On-Demand	Anodyne	ADRB1	54	40
CNS(=O)(=O)CCCNC[C@@H](O)c1ccccc1	ZINC000872221633	CC	On-Demand	Anodyne	ADRB3	104	43
CNS(=O)(=O)CCCNC[C@H](O)c1ccccc1	ZINC000872221634	CC	On-Demand	Anodyne	ADRB2	48	45
CNS(=O)(=O)CCCNC[C@H](O)c1ccccc1	ZINC000872221634	CC	On-Demand	Anodyne	ADRB1	54	40
CNS(=O)(=O)CCCNC[C@H](O)c1ccccc1	ZINC000872221634	CC	On-Demand	Anodyne	ADRB3	104	43
CNS(=O)(=O)CCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000872221644	DC	On-Demand	Anodyne	ADRB3	47	38
CNS(=O)(=O)CCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000872221645	DC	On-Demand	Anodyne	ADRB3	47	38
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@]12CCCC[C@@H]1C2	ZINC000872221660	DF	On-Demand	Mild	ADRB2	26	44
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@]12CCCC[C@@H]1C2	ZINC000872221660	DF	On-Demand	Mild	ADRB1	35	45
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@]12CCCC[C@H]1C2	ZINC000872221661	DF	On-Demand	Mild	ADRB2	26	44
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@]12CCCC[C@H]1C2	ZINC000872221661	DF	On-Demand	Mild	ADRB1	35	45
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@]12CCCC[C@@H]1C2	ZINC000872221662	DF	On-Demand	Mild	ADRB2	26	44
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@]12CCCC[C@@H]1C2	ZINC000872221662	DF	On-Demand	Mild	ADRB1	35	45
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@]12CCCC[C@H]1C2	ZINC000872221663	DF	On-Demand	Mild	ADRB2	26	44
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@]12CCCC[C@H]1C2	ZINC000872221663	DF	On-Demand	Mild	ADRB1	35	45
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1ccccc1	ZINC000872221702	CD	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1ccccc1	ZINC000872221703	CD	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1ccccc1	ZINC000872221704	CD	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1ccccc1	ZINC000872221705	CD	On-Demand	Anodyne	ADRB2	29	43
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872221722	FH	On-Demand	Mild	ADRB3	26	45
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)c1cccc(Cl)c1	ZINC000872221735	CE	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)c1cccc(Cl)c1	ZINC000872221736	CE	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)c1cccc(Cl)c1	ZINC000872221737	CE	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)c1cccc(Cl)c1	ZINC000872221738	CE	On-Demand	Anodyne	ADRB3	38	41
N#Cc1ccccc1N1CCC(NCCC(=O)Nc2cccnc2)CC1	ZINC000872221773	EF	On-Demand	Mild	NPY1R	25	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	AVPR2	70	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	AVPR1A	37	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	LPL	35	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	CPT1A	51	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	CPT2	40	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	EPHX2	22	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	TGM2	63	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	F13A1	80	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	NR2E3	58	31
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	LIPG	17	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	L3MBTL3	84	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000872221805	JI	On-Demand	Anodyne	NAMPT	27	43
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@@H]1C2	ZINC000872221820	DF	On-Demand	Mild	ADRB2	26	63
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@@H]1C2	ZINC000872221820	DF	On-Demand	Mild	ADRB1	70	43
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@@H]1C2	ZINC000872221820	DF	On-Demand	Mild	CASR	43	44
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@@H]1C2	ZINC000872221820	DF	On-Demand	Mild	CYP2D6	20	45
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@H]1C2	ZINC000872221821	DF	On-Demand	Mild	ADRB2	26	63
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@H]1C2	ZINC000872221821	DF	On-Demand	Mild	ADRB1	70	43
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@H]1C2	ZINC000872221821	DF	On-Demand	Mild	CASR	43	44
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@]12CCCC[C@H]1C2	ZINC000872221821	DF	On-Demand	Mild	CYP2D6	20	45
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@@H]1C2	ZINC000872221822	DF	On-Demand	Mild	ADRB2	26	63
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@@H]1C2	ZINC000872221822	DF	On-Demand	Mild	ADRB1	70	43
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@@H]1C2	ZINC000872221822	DF	On-Demand	Mild	CASR	43	44
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@@H]1C2	ZINC000872221822	DF	On-Demand	Mild	CYP2D6	20	45
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@H]1C2	ZINC000872221823	DF	On-Demand	Mild	ADRB2	26	63
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@H]1C2	ZINC000872221823	DF	On-Demand	Mild	ADRB1	70	43
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@H]1C2	ZINC000872221823	DF	On-Demand	Mild	CASR	43	44
C[C@H](NC[C@H](O)COc1ccccc1C#N)[C@@]12CCCC[C@H]1C2	ZINC000872221823	DF	On-Demand	Mild	CYP2D6	20	45
CNS(=O)(=O)CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872221855	ED	On-Demand	Anodyne	ADRB3	62	39
CNS(=O)(=O)CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872221856	ED	On-Demand	Anodyne	ADRB3	62	39
C[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)O1	ZINC000872221891	CD	On-Demand	Bother	CACNA1D	45	33
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)O1	ZINC000872221894	CD	On-Demand	Bother	CACNA1D	45	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	AVPR2	41	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	AVPR1A	22	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	LPL	36	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	CNR2	19	62
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	NPY2R	26	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	CPT1A	80	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	CPT2	49	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	EPHX2	31	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	CPT1B	47	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	F13A1	42	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	TAAR1	30	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	LIPG	17	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872221957	JI	On-Demand	Anodyne	L3MBTL3	69	40
C[C@@H](CNC1CCN(c2ccccc2C#N)CC1)S(C)(=O)=O	ZINC000872221959	DD	On-Demand	Mild	ADRA1D	30	51
C[C@@H](CNC1CCN(c2ccccc2C#N)CC1)S(C)(=O)=O	ZINC000872221959	DD	On-Demand	Mild	ADRA1A	21	51
C[C@@H](CNC1CCN(c2ccccc2C#N)CC1)S(C)(=O)=O	ZINC000872221959	DD	On-Demand	Mild	ADRA1B	24	51
CCOC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872221995	DD	On-Demand	Mild	ADRB2	18	44
CCOC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872221995	DD	On-Demand	Mild	ADRB3	20	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(=O)c2ccccc2o1	ZINC000872222010	FG	On-Demand	Anodyne	AVPR2	54	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(=O)c2ccccc2o1	ZINC000872222010	FG	On-Demand	Anodyne	BCHE	26	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(=O)c2ccccc2o1	ZINC000872222010	FG	On-Demand	Anodyne	TNKS	24	53
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(=O)c2ccccc2o1	ZINC000872222010	FG	On-Demand	Anodyne	L3MBTL3	70	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(=O)c2ccccc2o1	ZINC000872222010	FG	On-Demand	Anodyne	GPR35	56	39
C[C@@](O)(C[C@H](O)CNC1CCN(c2ccccc2C#N)CC1)C1CC1	ZINC000872222035	EE	On-Demand	Mild	ADRA1D	17	41
C[C@@](O)(C[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1)C1CC1	ZINC000872222038	EE	On-Demand	Mild	ADRA1D	17	41
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000872222065	GH	On-Demand	Mild	SFRP1	48	34
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000872222066	GH	On-Demand	Mild	SFRP1	48	34
CC(C)(C)[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222081	DF	On-Demand	Mild	ADRA1D	21	43
CC(C)(C)[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222081	DF	On-Demand	Mild	ADRA1A	15	43
CC(C)(C)[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222081	DF	On-Demand	Mild	ADRA1B	16	43
C#CCNC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222129	DD	On-Demand	Mild	HTR1A	22	40
C#CCNC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222129	DD	On-Demand	Mild	DRD2	22	44
C#CCNC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222129	DD	On-Demand	Mild	DRD3	30	40
C#CCNC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222129	DD	On-Demand	Mild	HTR7	20	40
C#CCNC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222129	DD	On-Demand	Mild	NPY1R	21	45
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	HTR1A	38	41
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	DRD2	39	43
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	DRD4	27	43
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	ADRA1D	38	43
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	ADRA1A	32	43
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	ADRA1B	30	43
COc1ccc(OC)c([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)c1	ZINC000872222131	GF	On-Demand	Mild	DRD3	38	41
CON(C)C(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222176	DD	On-Demand	Mild	DRD2	25	41
CON(C)C(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222176	DD	On-Demand	Mild	NPY1R	28	50
O[C@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222187	BC	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222187	BC	On-Demand	Anodyne	ADRB1	32	47
O[C@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222187	BC	On-Demand	Anodyne	ADRB3	107	49
O[C@@H](CCNC[C@H](O)c1cccnc1)C(F)F	ZINC000872222188	BC	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CCNC[C@H](O)c1cccnc1)C(F)F	ZINC000872222188	BC	On-Demand	Anodyne	ADRB1	32	47
O[C@@H](CCNC[C@H](O)c1cccnc1)C(F)F	ZINC000872222188	BC	On-Demand	Anodyne	ADRB3	107	49
O[C@H](CNCC[C@H](O)C(F)F)c1cccnc1	ZINC000872222189	BC	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNCC[C@H](O)C(F)F)c1cccnc1	ZINC000872222189	BC	On-Demand	Anodyne	ADRB1	32	47
O[C@H](CNCC[C@H](O)C(F)F)c1cccnc1	ZINC000872222189	BC	On-Demand	Anodyne	ADRB3	107	49
O[C@@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222190	BC	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222190	BC	On-Demand	Anodyne	ADRB1	32	47
O[C@@H](CNCC[C@@H](O)C(F)F)c1cccnc1	ZINC000872222190	BC	On-Demand	Anodyne	ADRB3	107	49
O=C(/C=C/c1ccc(I)o1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872222191	IH	On-Demand	Anodyne	L3MBTL3	53	36
O=C(/C=C\c1ccc(I)o1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872222192	IH	On-Demand	Anodyne	L3MBTL3	53	36
CCOC(=O)CC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222220	ED	On-Demand	Mild	NPY1R	21	41
CCOC(=O)CC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222221	ED	On-Demand	Mild	NPY1R	21	41
CN(C[C@H](O)CNC1CCN(c2ccccc2C#N)CC1)C(=O)OC(C)(C)C	ZINC000872222232	GE	On-Demand	Mild	ADRA1D	16	40
CN(C[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1)C(=O)OC(C)(C)C	ZINC000872222233	GE	On-Demand	Mild	ADRA1D	16	40
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222253	ED	On-Demand	Mild	ADRB2	17	44
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222253	ED	On-Demand	Mild	ADRA1D	19	40
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222253	ED	On-Demand	Mild	ADRA1A	15	40
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222255	ED	On-Demand	Mild	ADRB2	17	44
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222255	ED	On-Demand	Mild	ADRA1D	19	40
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222255	ED	On-Demand	Mild	ADRA1A	15	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222282	GE	On-Demand	Mild	DRD2	15	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222282	GE	On-Demand	Mild	ADRA1D	24	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222282	GE	On-Demand	Mild	ADRA1A	21	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222282	GE	On-Demand	Mild	NPY1R	22	42
CC(C)(C)OC(=O)NCC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222283	GE	On-Demand	Mild	DRD2	15	44
CC(C)(C)OC(=O)NCC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222283	GE	On-Demand	Mild	ADRA1D	24	40
CC(C)(C)OC(=O)NCC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222283	GE	On-Demand	Mild	ADRA1A	21	40
CC(C)(C)OC(=O)NCC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222283	GE	On-Demand	Mild	NPY1R	22	42
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000872222284	DD	On-Demand	Mild	ADRB1	59	40
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000872222284	DD	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000872222284	DD	On-Demand	Mild	CYP2D6	16	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000872222285	DD	On-Demand	Mild	ADRB1	59	40
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000872222285	DD	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000872222285	DD	On-Demand	Mild	CYP2D6	16	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000872222286	DD	On-Demand	Mild	ADRB1	59	40
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000872222286	DD	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000872222286	DD	On-Demand	Mild	CYP2D6	16	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000872222287	DD	On-Demand	Mild	ADRB1	59	40
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000872222287	DD	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000872222287	DD	On-Demand	Mild	CYP2D6	16	41
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1ccccc1Cl	ZINC000872222299	FG	On-Demand	Anodyne	OPRL1	30	41
O[C@H](CNCC[C@@H](O)C(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000872222308	EE	On-Demand	Anodyne	ADRB3	15	44
O[C@@H](CNCC[C@@H](O)C(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000872222309	EE	On-Demand	Anodyne	ADRB3	15	44
O[C@@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(F)F	ZINC000872222310	EE	On-Demand	Anodyne	ADRB3	15	44
O[C@H](CNCC[C@H](O)C(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000872222311	EE	On-Demand	Anodyne	ADRB3	15	44
CN(C)c1ccc(NC(=O)CCNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222320	GG	On-Demand	Mild	NPY1R	22	44
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(F)c1	ZINC000872222331	FF	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(F)c1	ZINC000872222331	FF	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(F)c1	ZINC000872222332	FF	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(F)c1	ZINC000872222332	FF	On-Demand	Anodyne	ADRB3	30	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872222357	FD	On-Demand	Anodyne	ADRB1	48	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872222358	FD	On-Demand	Anodyne	ADRB1	48	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872222359	FD	On-Demand	Anodyne	ADRB1	48	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872222360	FD	On-Demand	Anodyne	ADRB1	48	43
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	ADRB1	16	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	ADRA1D	25	44
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	ADRA1A	17	44
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	ADRA1B	20	44
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	ADRB3	30	44
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222401	GE	On-Demand	Mild	CTSF	48	35
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	ADRB1	16	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	ADRA1D	25	44
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	ADRA1A	17	44
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	ADRA1B	20	44
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	ADRB3	30	44
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222402	GE	On-Demand	Mild	CTSF	48	35
Cc1c(F)cccc1NC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222407	GH	On-Demand	Mild	KCNQ2	57	36
Cc1c(F)cccc1NC(=O)CCNC1CCN(c2ccccc2C#N)CC1	ZINC000872222407	GH	On-Demand	Mild	NPY1R	26	45
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1cccc2[nH]ccc12	ZINC000872222408	ED	On-Demand	Anodyne	ADRB1	17	60
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1cccc2[nH]ccc12	ZINC000872222409	ED	On-Demand	Anodyne	ADRB1	17	60
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1cccc2[nH]ccc12	ZINC000872222410	ED	On-Demand	Anodyne	ADRB1	17	60
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1cccc2[nH]ccc12	ZINC000872222411	ED	On-Demand	Anodyne	ADRB1	17	60
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872222430	GH	On-Demand	Mild	ADRB3	21	40
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872222430	GH	On-Demand	Mild	NPY2R	15	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872222431	GH	On-Demand	Mild	ADRB3	21	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872222431	GH	On-Demand	Mild	NPY2R	15	40
N#Cc1ccccc1N1CCC(NCCS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872222436	GF	On-Demand	Mild	ADRA1D	19	40
N#Cc1ccccc1N1CCC(NCCS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872222436	GF	On-Demand	Mild	ADRA1A	15	40
N#Cc1ccccc1N1CCC(NCCS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872222436	GF	On-Demand	Mild	ADRA1B	15	40
CC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222437	CD	On-Demand	Mild	ADRB2	15	41
CC[C@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222437	CD	On-Demand	Mild	ADRA1D	18	41
CC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222438	CD	On-Demand	Mild	ADRB2	15	41
CC[C@@H](O)CNC1CCN(c2ccccc2C#N)CC1	ZINC000872222438	CD	On-Demand	Mild	ADRA1D	18	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	CNR2	20	51
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	CPT1A	67	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	CPT2	46	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	NR1H4	18	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	EPHX2	30	50
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	CPT1B	40	35
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872222506	JE	On-Demand	Anodyne	L3MBTL3	45	37
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222509	FG	On-Demand	Anodyne	ADRB2	21	47
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222509	FG	On-Demand	Anodyne	ADRB1	40	48
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222509	FG	On-Demand	Anodyne	ADRB3	58	48
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222509	FG	On-Demand	Anodyne	CYP3A4	43	35
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222510	FG	On-Demand	Anodyne	ADRB2	21	47
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222510	FG	On-Demand	Anodyne	ADRB1	40	48
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222510	FG	On-Demand	Anodyne	ADRB3	58	48
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccc(Cl)c1	ZINC000872222510	FG	On-Demand	Anodyne	CYP3A4	43	35
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222527	EE	On-Demand	Anodyne	ADRB2	26	44
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222527	EE	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222527	EE	On-Demand	Anodyne	ADRB3	98	45
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222528	EE	On-Demand	Anodyne	ADRB2	26	44
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222528	EE	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1cccnc1	ZINC000872222528	EE	On-Demand	Anodyne	ADRB3	98	45
O[C@@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1ccc(F)c(F)c1	ZINC000872222533	GG	On-Demand	Anodyne	ADRB2	15	47
O[C@H](CNCCC1(O)CCN(c2ccccc2)CC1)c1ccc(F)c(F)c1	ZINC000872222534	GG	On-Demand	Anodyne	ADRB2	15	47
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872222535	ED	On-Demand	Anodyne	ADRB2	17	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872222536	ED	On-Demand	Anodyne	ADRB2	17	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872222537	ED	On-Demand	Anodyne	ADRB2	17	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872222538	ED	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2)COc1cccc(C(F)(F)F)c1	ZINC000872222553	FE	On-Demand	Anodyne	PDS	42	36
O[C@H](CN[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2)COc1cccc(C(F)(F)F)c1	ZINC000872222554	FE	On-Demand	Anodyne	PDS	42	36
O[C@H](CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2)COc1cccc(C(F)(F)F)c1	ZINC000872222555	FE	On-Demand	Anodyne	PDS	42	36
O[C@H](CN[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2)COc1cccc(C(F)(F)F)c1	ZINC000872222556	FE	On-Demand	Anodyne	PDS	42	36
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872222559	FH	On-Demand	Mild	ADRB1	38	47
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872222559	FH	On-Demand	Mild	ADRB3	59	49
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872222559	FH	On-Demand	Mild	IGF1R	28	40
N#Cc1ccccc1N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872222559	FH	On-Demand	Mild	CYP3A4	50	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872222560	FH	On-Demand	Mild	ADRB1	38	47
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872222560	FH	On-Demand	Mild	ADRB3	59	49
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872222560	FH	On-Demand	Mild	IGF1R	28	40
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872222560	FH	On-Demand	Mild	CYP3A4	50	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@@H](O)C(F)F)CC1	ZINC000872222581	FD	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@@H](O)C(F)F)CC1	ZINC000872222582	FD	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@H](O)C(F)F)CC1	ZINC000872222583	FD	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@H](O)C(F)F)CC1	ZINC000872222584	FD	On-Demand	Anodyne	GPR119	31	43
N#Cc1ccccc1N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872222600	GH	On-Demand	Mild	ADRB3	17	48
N#Cc1ccccc1N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872222601	GH	On-Demand	Mild	ADRB3	17	48
CSc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222628	GG	On-Demand	Mild	ADRB2	31	48
CSc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222628	GG	On-Demand	Mild	ADRB1	51	40
CSc1ccc(OC[C@@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222628	GG	On-Demand	Mild	ADRB3	32	48
CSc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222629	GG	On-Demand	Mild	ADRB2	31	48
CSc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222629	GG	On-Demand	Mild	ADRB1	51	40
CSc1ccc(OC[C@H](O)CNC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000872222629	GG	On-Demand	Mild	ADRB3	32	48
N#Cc1ccccc1N1CCC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222639	GF	On-Demand	Mild	DRD4	18	40
N#Cc1ccccc1N1CCC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222639	GF	On-Demand	Mild	SIGMAR1	41	39
N#Cc1ccccc1N1CCC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222639	GF	On-Demand	Mild	NPFFR1	41	36
N#Cc1ccccc1N1CCC(NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222640	GF	On-Demand	Mild	DRD4	18	40
N#Cc1ccccc1N1CCC(NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222640	GF	On-Demand	Mild	SIGMAR1	41	39
N#Cc1ccccc1N1CCC(NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872222640	GF	On-Demand	Mild	NPFFR1	41	36
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872222650	ED	On-Demand	Anodyne	ADRB2	21	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)cc1	ZINC000872222650	ED	On-Demand	Anodyne	ADRB1	39	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872222651	ED	On-Demand	Anodyne	ADRB2	21	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)cc1	ZINC000872222651	ED	On-Demand	Anodyne	ADRB1	39	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872222652	ED	On-Demand	Anodyne	ADRB2	21	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1	ZINC000872222652	ED	On-Demand	Anodyne	ADRB1	39	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872222653	ED	On-Demand	Anodyne	ADRB2	21	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)cc1	ZINC000872222653	ED	On-Demand	Anodyne	ADRB1	39	52
O[C@H](CNCC[C@@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222662	CD	On-Demand	Anodyne	ADRB1	50	51
O[C@H](CNCC[C@@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222662	CD	On-Demand	Anodyne	ADRB3	64	51
O[C@@H](CNCC[C@@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222663	CD	On-Demand	Anodyne	ADRB1	50	51
O[C@@H](CNCC[C@@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222663	CD	On-Demand	Anodyne	ADRB3	64	51
O[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000872222664	CD	On-Demand	Anodyne	ADRB1	50	51
O[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000872222664	CD	On-Demand	Anodyne	ADRB3	64	51
O[C@H](CNCC[C@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222665	CD	On-Demand	Anodyne	ADRB1	50	51
O[C@H](CNCC[C@H](O)C(F)F)c1cccc(Cl)c1	ZINC000872222665	CD	On-Demand	Anodyne	ADRB3	64	51
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	ABL1	15	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	AVPR2	87	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	AVPR1A	42	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	PRNP	57	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	TACR3	22	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	CYP2C9	16	57
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	ATR	23	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	NR2E3	59	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	SMO	35	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	MT-CO2	53	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	L3MBTL3	60	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000872222666	HJ	On-Demand	Anodyne	NAMPT	37	51
C[C@@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)O1	ZINC000872222670	EE	On-Demand	Anodyne	GPR119	24	40
C[C@@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)O1	ZINC000872222671	EE	On-Demand	Anodyne	GPR119	24	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872222685	EF	On-Demand	Bother	ADRB1	58	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872222685	EF	On-Demand	Bother	ADRB3	16	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872222686	EF	On-Demand	Bother	ADRB1	58	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872222686	EF	On-Demand	Bother	ADRB3	16	43
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	ADRB1	41	36
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	DRD2	23	47
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	DRD4	50	44
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	ACHE	64	53
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	DRD3	15	41
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	SLC6A3	38	54
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	HTR4	22	42
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	SIGMAR1	77	47
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	BCHE	21	47
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	ABCB1	22	40
COC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222693	DD	On-Demand	Anodyne	MCHR1	17	43
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	KIT	16	40
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	FLT1	19	46
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	KDR	21	46
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	TEK	30	42
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	BRAF	37	41
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	EPHB4	19	42
O=C(CCNCc1ccnc(F)c1)Nc1cccc(C(F)(F)F)c1	ZINC000872222699	EG	On-Demand	Anodyne	RIPK1	55	42
O=C(CCNCC1CCC2(CC1)CC2)Nc1cccnc1	ZINC000872222700	CF	On-Demand	Anodyne	NAMPT	35	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	DRD2	18	42
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	DRD4	40	45
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	ACHE	61	53
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	SLC6A3	27	55
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	HRH3	16	41
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	SIGMAR1	64	47
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	BCHE	18	48
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222701	EE	On-Demand	Anodyne	ABCB1	22	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	DRD2	18	42
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	DRD4	40	45
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	ACHE	61	53
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	SLC6A3	27	55
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	HRH3	16	41
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	SIGMAR1	64	47
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	BCHE	18	48
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	SLC18A3	15	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CN1CCCC1	ZINC000872222702	EE	On-Demand	Anodyne	ABCB1	22	40
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222706	DD	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222706	DD	On-Demand	Anodyne	ADRB1	58	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222706	DD	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222706	DD	On-Demand	Anodyne	PDS	60	37
CC(=O)c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222707	DD	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222707	DD	On-Demand	Anodyne	ADRB1	58	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222707	DD	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872222707	DD	On-Demand	Anodyne	PDS	60	37
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222719	EF	On-Demand	Mild	ACHE	52	47
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222719	EF	On-Demand	Mild	SLC6A3	20	49
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222719	EF	On-Demand	Mild	SIGMAR1	63	43
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222720	EF	On-Demand	Mild	ACHE	52	47
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222720	EF	On-Demand	Mild	SLC6A3	20	49
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222720	EF	On-Demand	Mild	SIGMAR1	63	43
Cc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222725	EF	On-Demand	Anodyne	ADRB2	51	50
Cc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222725	EF	On-Demand	Anodyne	ADRB1	73	46
Cc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222725	EF	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222725	EF	On-Demand	Anodyne	ACOX1	51	31
Cc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222726	EF	On-Demand	Anodyne	ADRB2	51	50
Cc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222726	EF	On-Demand	Anodyne	ADRB1	73	46
Cc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222726	EF	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872222726	EF	On-Demand	Anodyne	ACOX1	51	31
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222761	FF	On-Demand	Anodyne	ADRB2	49	44
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222761	FF	On-Demand	Anodyne	ADRB1	88	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222761	FF	On-Demand	Anodyne	ADRB3	60	46
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222761	FF	On-Demand	Anodyne	ACOX1	49	33
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222761	FF	On-Demand	Anodyne	ABCB1	29	49
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222762	FF	On-Demand	Anodyne	ADRB2	49	44
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222762	FF	On-Demand	Anodyne	ADRB1	88	41
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222762	FF	On-Demand	Anodyne	ADRB3	60	46
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222762	FF	On-Demand	Anodyne	ACOX1	49	33
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)c1	ZINC000872222762	FF	On-Demand	Anodyne	ABCB1	29	49
CCOc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222768	DE	On-Demand	Anodyne	ADRB2	43	45
CCOc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222768	DE	On-Demand	Anodyne	ADRB1	61	45
CCOc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222768	DE	On-Demand	Anodyne	GRIN1	20	42
CCOc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222768	DE	On-Demand	Anodyne	ADRB3	38	42
CCOc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222769	DE	On-Demand	Anodyne	ADRB2	43	45
CCOc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222769	DE	On-Demand	Anodyne	ADRB1	61	45
CCOc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222769	DE	On-Demand	Anodyne	GRIN1	20	42
CCOc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222769	DE	On-Demand	Anodyne	ADRB3	38	42
Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)c(C)c1	ZINC000872222772	DE	On-Demand	Anodyne	ADRB2	18	45
Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)c(C)c1	ZINC000872222773	DE	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1F	ZINC000872222786	CD	On-Demand	Anodyne	ADRB2	28	44
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1F	ZINC000872222786	CD	On-Demand	Anodyne	ADRB1	55	39
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1F	ZINC000872222787	CD	On-Demand	Anodyne	ADRB2	28	44
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1F	ZINC000872222787	CD	On-Demand	Anodyne	ADRB1	55	39
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	DRD2	18	45
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	DRD4	42	41
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	ACHE	60	50
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	SLC6A3	28	52
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	SIGMAR1	68	46
CCOC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222791	DE	On-Demand	Anodyne	BCHE	18	46
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1Cl	ZINC000872222794	DE	On-Demand	Anodyne	ADRB2	25	47
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1Cl	ZINC000872222794	DE	On-Demand	Anodyne	ADRB1	50	37
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1Cl	ZINC000872222795	DE	On-Demand	Anodyne	ADRB2	25	47
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1Cl	ZINC000872222795	DE	On-Demand	Anodyne	ADRB1	50	37
Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222804	CE	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222804	CE	On-Demand	Anodyne	ADRB1	61	42
Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222804	CE	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222804	CE	On-Demand	Anodyne	ADRB3	38	42
Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222805	CE	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222805	CE	On-Demand	Anodyne	ADRB1	61	42
Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222805	CE	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222805	CE	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222822	EE	On-Demand	Anodyne	ACHE	58	52
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222822	EE	On-Demand	Anodyne	SLC6A3	18	51
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222822	EE	On-Demand	Anodyne	SIGMAR1	48	44
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222822	EE	On-Demand	Anodyne	BCHE	18	50
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222823	EE	On-Demand	Anodyne	ACHE	58	52
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222823	EE	On-Demand	Anodyne	SLC6A3	18	51
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222823	EE	On-Demand	Anodyne	SIGMAR1	48	44
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)Cn1cccn1	ZINC000872222823	EE	On-Demand	Anodyne	BCHE	18	50
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	DRD2	20	51
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	DRD4	46	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	ACHE	64	56
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	SLC6A3	25	62
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	SIGMAR1	74	53
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222837	DF	On-Demand	Anodyne	BCHE	19	51
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	DRD2	20	51
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	DRD4	46	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	ACHE	64	56
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	SLC6A3	25	62
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	SIGMAR1	74	53
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872222838	DF	On-Demand	Anodyne	BCHE	19	51
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	DRD2	15	44
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	DRD4	37	44
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	ACHE	62	55
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	SIGMAR1	67	44
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	BCHE	18	44
O=S1(=O)CCC(O)(CNCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000872222862	GD	On-Demand	Anodyne	CCR3	24	40
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222875	ED	On-Demand	Anodyne	ADRB2	46	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222875	ED	On-Demand	Anodyne	ADRB1	76	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222875	ED	On-Demand	Anodyne	GRIN1	21	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222875	ED	On-Demand	Anodyne	ADRB3	47	46
COC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222876	ED	On-Demand	Anodyne	ADRB2	46	46
COC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222876	ED	On-Demand	Anodyne	ADRB1	76	46
COC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222876	ED	On-Demand	Anodyne	GRIN1	21	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872222876	ED	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C#N)C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222891	EG	On-Demand	Mild	ACHE	56	48
CC(C)(C#N)C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222891	EG	On-Demand	Mild	SLC6A3	19	50
CC(C)(C#N)C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222891	EG	On-Demand	Mild	SIGMAR1	51	44
CC(C)(C#N)C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222891	EG	On-Demand	Mild	BCHE	17	48
CC(C)(C#N)C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222892	EG	On-Demand	Mild	ACHE	56	48
CC(C)(C#N)C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222892	EG	On-Demand	Mild	SLC6A3	19	50
CC(C)(C#N)C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222892	EG	On-Demand	Mild	SIGMAR1	51	44
CC(C)(C#N)C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872222892	EG	On-Demand	Mild	BCHE	17	48
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222898	FH	On-Demand	Anodyne	ADRB2	17	41
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222898	FH	On-Demand	Anodyne	ADRB1	21	42
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222898	FH	On-Demand	Anodyne	ADRB3	57	42
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222898	FH	On-Demand	Anodyne	PRCP	24	57
C[C@H](NC[C@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222899	FH	On-Demand	Anodyne	ADRB2	17	41
C[C@H](NC[C@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222899	FH	On-Demand	Anodyne	ADRB1	21	42
C[C@H](NC[C@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222899	FH	On-Demand	Anodyne	ADRB3	57	42
C[C@H](NC[C@H](O)c1cccnc1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222899	FH	On-Demand	Anodyne	PRCP	24	57
C[C@@H](NC[C@@H](O)c1ccc(F)cn1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222904	FH	On-Demand	Anodyne	PRCP	17	45
C[C@H](NC[C@H](O)c1ccc(F)cn1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222905	FH	On-Demand	Anodyne	PRCP	17	45
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1ccccc1	ZINC000872222910	EE	On-Demand	Anodyne	ADRB3	45	38
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1ccccc1	ZINC000872222911	EE	On-Demand	Anodyne	ADRB3	45	38
C[C@H](NC[C@H](O)C1CC1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222942	DG	On-Demand	Anodyne	PRCP	35	48
C[C@@H](NC[C@@H](O)C1CC1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872222943	DG	On-Demand	Anodyne	PRCP	35	48
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222952	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222952	FF	On-Demand	Anodyne	ADRB1	55	42
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222952	FF	On-Demand	Anodyne	ADRB3	35	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222953	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222953	FF	On-Demand	Anodyne	ADRB1	55	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Br)cc1	ZINC000872222953	FF	On-Demand	Anodyne	ADRB3	35	42
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	DRD2	15	44
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	DRD4	37	45
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	ACHE	59	59
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	SLC6A3	18	52
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	SIGMAR1	51	47
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222968	EG	On-Demand	Anodyne	BCHE	17	48
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	DRD2	15	44
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	DRD4	37	45
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	ACHE	59	59
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	SLC6A3	18	52
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	SIGMAR1	51	47
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)c1ccccn1	ZINC000872222969	EG	On-Demand	Anodyne	BCHE	17	48
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	DRD2	20	46
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	DRD4	49	45
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	ACHE	62	55
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	DRD3	15	43
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	SLC6A3	28	58
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	CHRM3	18	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	SIGMAR1	77	58
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	BCHE	19	53
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	MCHR1	22	44
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	CACNA1G	28	43
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222989	EF	On-Demand	Anodyne	CACNA1I	18	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	DRD2	20	46
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	DRD4	49	45
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	ACHE	62	55
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	DRD3	15	43
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	SLC6A3	28	58
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	CHRM3	18	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	SIGMAR1	77	58
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	BCHE	19	53
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	MCHR1	22	44
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	CACNA1G	28	43
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872222990	EF	On-Demand	Anodyne	CACNA1I	18	40
C[C@@H](NCCS(C)(=O)=O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223001	EF	On-Demand	Anodyne	PRCP	19	46
C[C@@H](NCCS(C)(=O)=O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223001	EF	On-Demand	Anodyne	GLP1R	54	37
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CHRM2	25	43
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CHRM1	16	43
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	DRD2	28	50
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	DRD4	60	46
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	ACHE	74	63
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	HRH1	18	42
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	DRD3	19	46
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	SLC6A3	21	55
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	HTR4	28	41
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CHRM3	30	43
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	GRIN2B	45	38
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	LTA4H	25	42
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	SIGMAR1	84	52
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	BCHE	21	51
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CCR3	38	42
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	NPFFR2	40	38
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	FAAH	15	48
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	MCHR1	32	43
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CACNA1G	35	42
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	CYP2J2	43	30
NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223005	CD	On-Demand	Anodyne	NPFFR1	45	40
C[C@@H](NC[C@@H](O)c1ccccn1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223025	FH	On-Demand	Anodyne	PRCP	26	47
C[C@H](NC[C@H](O)c1ccccn1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223026	FH	On-Demand	Anodyne	PRCP	26	47
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	CHRM2	18	40
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	DRD2	22	46
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	DRD4	52	40
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	ACHE	65	55
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	SLC6A3	21	54
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	CHRM3	21	40
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	SIGMAR1	76	49
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	BCHE	20	50
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	MCHR1	19	40
C[C@@](O)(CNCCC1CCN(Cc2ccccc2)CC1)C(F)(F)F	ZINC000872223032	EG	On-Demand	Anodyne	CACNA1G	30	48
CON(C)C(=O)CCN[C@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223046	EF	On-Demand	Anodyne	PRCP	40	48
CON(C)C(=O)CCN[C@@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223047	EF	On-Demand	Anodyne	PRCP	40	48
O=[N+]([O-])c1ccc([C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223057	DG	On-Demand	Bother	SLC27A4	42	31
O=[N+]([O-])c1ccc([C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223058	DG	On-Demand	Bother	SLC27A4	42	31
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	CHRM2	18	41
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	DRD2	16	42
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	DRD4	38	41
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	ACHE	62	55
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	SLC6A3	15	52
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	CHRM3	19	41
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	SIGMAR1	81	44
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223071	EE	On-Demand	Anodyne	BCHE	18	46
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223088	EE	On-Demand	Anodyne	ADRB2	56	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223088	EE	On-Demand	Anodyne	ADRB1	86	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223088	EE	On-Demand	Anodyne	ADRB3	58	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223089	EE	On-Demand	Anodyne	ADRB2	56	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223089	EE	On-Demand	Anodyne	ADRB1	86	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223089	EE	On-Demand	Anodyne	ADRB3	58	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223090	EE	On-Demand	Anodyne	ADRB2	56	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223090	EE	On-Demand	Anodyne	ADRB1	86	48
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223090	EE	On-Demand	Anodyne	ADRB3	58	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223091	EE	On-Demand	Anodyne	ADRB2	56	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223091	EE	On-Demand	Anodyne	ADRB1	86	48
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223091	EE	On-Demand	Anodyne	ADRB3	58	48
O[C@@H](CNCc1cccc2c1CCOC2)c1cccnc1	ZINC000872223092	CD	On-Demand	Anodyne	ADRB3	75	39
O[C@H](CNCc1cccc2c1CCOC2)c1cccnc1	ZINC000872223093	CD	On-Demand	Anodyne	ADRB3	75	39
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872223100	DE	On-Demand	Mild	ADRB2	30	56
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872223100	DE	On-Demand	Mild	ADRB1	75	53
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872223100	DE	On-Demand	Mild	ADRB3	15	50
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872223100	DE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872223100	DE	On-Demand	Mild	CYP2D6	22	50
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872223101	DE	On-Demand	Mild	ADRB2	30	56
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872223101	DE	On-Demand	Mild	ADRB1	75	53
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872223101	DE	On-Demand	Mild	ADRB3	15	50
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872223101	DE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872223101	DE	On-Demand	Mild	CYP2D6	22	50
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872223102	DE	On-Demand	Mild	ADRB2	30	56
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872223102	DE	On-Demand	Mild	ADRB1	75	53
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872223102	DE	On-Demand	Mild	ADRB3	15	50
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872223102	DE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872223102	DE	On-Demand	Mild	CYP2D6	22	50
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872223103	DE	On-Demand	Mild	ADRB2	30	56
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872223103	DE	On-Demand	Mild	ADRB1	75	53
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872223103	DE	On-Demand	Mild	ADRB3	15	50
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872223103	DE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872223103	DE	On-Demand	Mild	CYP2D6	22	50
CC(=O)c1cccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223110	EG	On-Demand	Anodyne	ADRB2	36	44
CC(=O)c1cccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223110	EG	On-Demand	Anodyne	ADRB1	70	41
CC(=O)c1cccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223110	EG	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223110	EG	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223111	EG	On-Demand	Anodyne	ADRB2	36	44
CC(=O)c1cccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223111	EG	On-Demand	Anodyne	ADRB1	70	41
CC(=O)c1cccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223111	EG	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223111	EG	On-Demand	Anodyne	ABCB1	22	48
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	ADRB2	25	63
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	HTR1A	17	63
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	ADRB3	18	58
O[C@@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223172	DF	On-Demand	Anodyne	CYP2D6	18	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223182	GE	On-Demand	Anodyne	ADRB2	58	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223182	GE	On-Demand	Anodyne	ADRB1	97	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223182	GE	On-Demand	Anodyne	ADRB3	67	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223182	GE	On-Demand	Anodyne	ACOX1	45	34
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223182	GE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223183	GE	On-Demand	Anodyne	ADRB2	58	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223183	GE	On-Demand	Anodyne	ADRB1	97	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223183	GE	On-Demand	Anodyne	ADRB3	67	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223183	GE	On-Demand	Anodyne	ACOX1	45	34
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223183	GE	On-Demand	Anodyne	ABCB1	15	44
C[C@@H](NC[C@@H](O)CC(C)(C)O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223188	EG	On-Demand	Anodyne	PRCP	24	44
C[C@H](NC[C@H](O)CC(C)(C)O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223189	EG	On-Demand	Anodyne	PRCP	24	44
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223194	EG	On-Demand	Anodyne	ADRB1	45	39
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223194	EG	On-Demand	Anodyne	GRIN1	29	48
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223194	EG	On-Demand	Anodyne	ADRB3	30	41
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223195	EG	On-Demand	Anodyne	ADRB1	45	39
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223195	EG	On-Demand	Anodyne	GRIN1	29	48
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)c(Cl)c1	ZINC000872223195	EG	On-Demand	Anodyne	ADRB3	30	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223196	DD	On-Demand	Mild	ADRB2	34	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223196	DD	On-Demand	Mild	ADRB1	56	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223196	DD	On-Demand	Mild	ADRB3	35	41
N#CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223197	DD	On-Demand	Mild	ADRB2	34	41
N#CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223197	DD	On-Demand	Mild	ADRB1	56	41
N#CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223197	DD	On-Demand	Mild	ADRB3	35	41
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	DRD2	24	47
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	DRD4	48	44
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	ACHE	68	57
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	DRD3	19	44
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	HTR4	30	41
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	SIGMAR1	60	47
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	BCHE	20	49
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	CCR3	37	40
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	MCHR1	23	41
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	CACNA1G	37	44
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	CACNA1I	56	39
C#CCNC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223198	EE	On-Demand	Mild	NPFFR1	37	40
Cn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872223201	GE	On-Demand	Anodyne	AVPR2	62	39
Cn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872223201	GE	On-Demand	Anodyne	PRNP	50	36
Cn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872223201	GE	On-Demand	Anodyne	IMDH_CRYPV	27	43
Cn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872223201	GE	On-Demand	Anodyne	L3MBTL3	63	38
Cn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872223201	GE	On-Demand	Anodyne	HPGD	45	37
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	DRD2	19	46
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	DRD4	47	41
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	ACHE	67	55
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	DRD3	15	40
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	SLC6A3	19	57
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	CHRM3	15	40
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	SIGMAR1	75	47
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	BCHE	20	54
N#CCCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223204	CF	On-Demand	Mild	CCR3	17	40
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223223	GF	On-Demand	Mild	ACHE	46	44
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223223	GF	On-Demand	Mild	SLC6A3	17	46
N#CC1(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223223	GF	On-Demand	Mild	SIGMAR1	54	40
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223224	GF	On-Demand	Mild	ACHE	46	44
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223224	GF	On-Demand	Mild	SLC6A3	17	46
N#CC1(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000872223224	GF	On-Demand	Mild	SIGMAR1	54	40
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	DRD2	22	45
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	DRD4	45	39
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	ACHE	64	53
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	SLC6A3	20	55
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	HTR4	23	41
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	SIGMAR1	70	49
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	BCHE	19	48
C[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223236	EE	On-Demand	Anodyne	MCHR1	15	42
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	DRD2	22	45
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	DRD4	45	39
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	ACHE	64	53
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	SLC6A3	20	55
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	HTR4	23	41
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	SIGMAR1	70	49
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	BCHE	19	48
C[C@H](CNCCC1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000872223237	EE	On-Demand	Anodyne	MCHR1	15	42
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223238	GE	On-Demand	Anodyne	ACHE	53	47
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223238	GE	On-Demand	Anodyne	SLC6A3	22	48
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223238	GE	On-Demand	Anodyne	SIGMAR1	50	47
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223238	GE	On-Demand	Anodyne	BCHE	18	43
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223239	GE	On-Demand	Anodyne	ACHE	53	47
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223239	GE	On-Demand	Anodyne	SLC6A3	22	48
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223239	GE	On-Demand	Anodyne	SIGMAR1	50	47
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)COC1CCOCC1	ZINC000872223239	GE	On-Demand	Anodyne	BCHE	18	43
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	CHRM2	19	41
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	DRD2	23	47
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	DRD4	53	44
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	ACHE	68	59
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	DRD3	15	43
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	SLC6A3	17	51
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	CHRM3	20	41
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	SIGMAR1	66	49
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	BCHE	20	47
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	MCHR1	23	40
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	CACNA1G	31	41
NC(=O)NC(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223240	ED	On-Demand	Anodyne	NPFFR1	43	42
C[C@@](O)(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223245	FF	On-Demand	Anodyne	DRD2	15	42
C[C@@](O)(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223245	FF	On-Demand	Anodyne	ACHE	57	49
C[C@@](O)(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223245	FF	On-Demand	Anodyne	SLC6A3	19	51
C[C@@](O)(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223245	FF	On-Demand	Anodyne	SIGMAR1	55	44
C[C@@](O)(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223245	FF	On-Demand	Anodyne	BCHE	17	48
C[C@@](O)(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223246	FF	On-Demand	Anodyne	DRD2	15	42
C[C@@](O)(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223246	FF	On-Demand	Anodyne	ACHE	57	49
C[C@@](O)(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223246	FF	On-Demand	Anodyne	SLC6A3	19	51
C[C@@](O)(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223246	FF	On-Demand	Anodyne	SIGMAR1	55	44
C[C@@](O)(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223246	FF	On-Demand	Anodyne	BCHE	17	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223253	DD	On-Demand	Anodyne	ADRB2	42	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223253	DD	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223253	DD	On-Demand	Anodyne	GRIN1	20	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223253	DD	On-Demand	Anodyne	ADRB3	43	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223254	DD	On-Demand	Anodyne	ADRB2	42	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223254	DD	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223254	DD	On-Demand	Anodyne	GRIN1	20	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223254	DD	On-Demand	Anodyne	ADRB3	43	41
N#Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223265	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223265	DD	On-Demand	Mild	ADRB1	56	40
N#Cc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223265	DD	On-Demand	Mild	ADRB3	31	40
N#Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223266	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223266	DD	On-Demand	Mild	ADRB1	56	40
N#Cc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223266	DD	On-Demand	Mild	ADRB3	31	40
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	ADRB2	25	63
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	HTR1A	17	63
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	ADRB3	18	58
O[C@H](CNCC[C@@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223273	DF	On-Demand	Anodyne	CYP2D6	18	43
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	ADRB2	25	63
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	HTR1A	17	63
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	ADRB3	18	58
O[C@@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223274	DF	On-Demand	Anodyne	CYP2D6	18	43
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	ADRB2	25	63
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	HTR1A	17	63
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	ADRB3	18	58
O[C@H](CNCC[C@H]1CCCS1)COc1cccc2[nH]ccc12	ZINC000872223275	DF	On-Demand	Anodyne	CYP2D6	18	43
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223290	EG	On-Demand	Anodyne	ADRB2	50	42
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223290	EG	On-Demand	Anodyne	ADRB1	69	42
CSc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223290	EG	On-Demand	Anodyne	ADRB3	47	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223291	EG	On-Demand	Anodyne	ADRB2	50	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223291	EG	On-Demand	Anodyne	ADRB1	69	42
CSc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223291	EG	On-Demand	Anodyne	ADRB3	47	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223292	EG	On-Demand	Anodyne	ADRB2	50	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223292	EG	On-Demand	Anodyne	ADRB1	69	42
CSc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223292	EG	On-Demand	Anodyne	ADRB3	47	42
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223293	EG	On-Demand	Anodyne	ADRB2	50	42
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223293	EG	On-Demand	Anodyne	ADRB1	69	42
CSc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223293	EG	On-Demand	Anodyne	ADRB3	47	42
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223321	ED	On-Demand	Anodyne	ADRB2	17	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223321	ED	On-Demand	Anodyne	ADRB3	48	38
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223322	ED	On-Demand	Anodyne	ADRB2	17	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223322	ED	On-Demand	Anodyne	ADRB3	48	38
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223323	ED	On-Demand	Anodyne	ADRB2	17	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223323	ED	On-Demand	Anodyne	ADRB3	48	38
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223324	ED	On-Demand	Anodyne	ADRB2	17	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223324	ED	On-Demand	Anodyne	ADRB3	48	38
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223339	EE	On-Demand	Bother	ADRB2	35	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223339	EE	On-Demand	Bother	ADRB1	53	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223339	EE	On-Demand	Bother	ADRB3	35	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223340	EE	On-Demand	Bother	ADRB2	35	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223340	EE	On-Demand	Bother	ADRB1	53	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223340	EE	On-Demand	Bother	ADRB3	35	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223341	EE	On-Demand	Bother	ADRB2	35	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223341	EE	On-Demand	Bother	ADRB1	53	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223341	EE	On-Demand	Bother	ADRB3	35	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223342	EE	On-Demand	Bother	ADRB2	35	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223342	EE	On-Demand	Bother	ADRB1	53	48
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223342	EE	On-Demand	Bother	ADRB3	35	48
CC(=O)c1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223345	EG	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223345	EG	On-Demand	Anodyne	ADRB1	73	44
CC(=O)c1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223345	EG	On-Demand	Anodyne	ADRB3	45	42
CC(=O)c1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223345	EG	On-Demand	Anodyne	ABCB1	16	55
CC(=O)c1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223346	EG	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223346	EG	On-Demand	Anodyne	ADRB1	73	44
CC(=O)c1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223346	EG	On-Demand	Anodyne	ADRB3	45	42
CC(=O)c1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223346	EG	On-Demand	Anodyne	ABCB1	16	55
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c(C)c1	ZINC000872223371	DF	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c(C)c1	ZINC000872223372	DF	On-Demand	Anodyne	ADRB2	25	45
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	CHRM2	21	41
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	DRD2	20	45
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	DRD4	45	43
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	ACHE	65	58
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	SLC6A3	19	55
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	CHRM3	25	41
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	SIGMAR1	88	46
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	BCHE	20	48
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	CCR3	23	40
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	CACNA1G	16	44
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCC1	ZINC000872223374	DF	On-Demand	Anodyne	NPFFR1	40	38
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	DRD2	17	45
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	DRD4	39	40
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	ACHE	59	53
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	SLC6A3	26	55
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	SIGMAR1	64	50
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	BCHE	18	48
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223391	EG	On-Demand	Anodyne	CACNA1G	22	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	DRD2	17	45
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	DRD4	39	40
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	ACHE	59	53
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	SLC6A3	26	55
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	SIGMAR1	64	50
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	BCHE	18	48
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC(F)(F)F	ZINC000872223392	EG	On-Demand	Anodyne	CACNA1G	22	40
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	DRD2	23	47
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	DRD4	51	40
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	ACHE	66	55
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	DRD3	15	41
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	SLC6A3	28	57
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	HTR4	16	40
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	SIGMAR1	81	50
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	BCHE	20	50
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	SLC18A3	17	43
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	MCHR1	19	41
CC[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223412	CF	On-Demand	Anodyne	CACNA1G	29	41
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	DRD2	23	47
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	DRD4	51	40
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	ACHE	66	55
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	DRD3	15	41
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	SLC6A3	28	57
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	HTR4	16	40
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	SIGMAR1	81	50
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	BCHE	20	50
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	SLC18A3	17	43
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	MCHR1	19	41
CC[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223413	CF	On-Demand	Anodyne	CACNA1G	29	41
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)c(C)c1	ZINC000872223423	DF	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c(C)c1	ZINC000872223425	DF	On-Demand	Anodyne	ADRB2	25	45
O[C@@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223427	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223427	DH	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223429	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223429	DH	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223431	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223431	DH	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223433	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccc(Cl)c1	ZINC000872223433	DH	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNCc1cccc2c1CCOC2)c1cccc(Cl)c1	ZINC000872223436	DG	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCc1cccc2c1CCOC2)c1cccc(Cl)c1	ZINC000872223436	DG	On-Demand	Anodyne	ADRB3	41	44
O[C@@H](CNCc1cccc2c1CCOC2)c1cccc(Cl)c1	ZINC000872223437	DG	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNCc1cccc2c1CCOC2)c1cccc(Cl)c1	ZINC000872223437	DG	On-Demand	Anodyne	ADRB3	41	44
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223440	DE	On-Demand	Mild	ADRB2	45	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223440	DE	On-Demand	Mild	ADRB1	74	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223440	DE	On-Demand	Mild	ADRB3	47	45
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc(F)c1F	ZINC000872223444	EE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc(F)c1F	ZINC000872223445	EE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	CHRM2	20	42
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	DRD2	28	47
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	DRD4	54	45
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	ACHE	74	55
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	HRH1	21	40
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	DRD3	20	44
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	SLC6A3	22	48
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	HTR4	35	41
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	LTA4H	25	41
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	SIGMAR1	75	49
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	BCHE	22	46
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	MCHR1	32	45
CON(C)C(=O)CCNCCC1CCN(Cc2ccccc2)CC1	ZINC000872223448	EE	On-Demand	Anodyne	CACNA1I	46	37
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223461	DE	On-Demand	Anodyne	ADRB2	36	42
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223461	DE	On-Demand	Anodyne	ADRB1	59	42
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223461	DE	On-Demand	Anodyne	GRIN1	25	45
O[C@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223461	DE	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223462	DE	On-Demand	Anodyne	ADRB2	36	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223462	DE	On-Demand	Anodyne	ADRB1	59	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223462	DE	On-Demand	Anodyne	GRIN1	25	45
O[C@@H](CNCc1ccnc(F)c1)COc1ccc(Cl)cc1	ZINC000872223462	DE	On-Demand	Anodyne	ADRB3	37	42
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223468	DE	On-Demand	Mild	ADRB2	45	45
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223468	DE	On-Demand	Mild	ADRB1	74	45
N#CCc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223468	DE	On-Demand	Mild	ADRB3	47	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223469	DE	On-Demand	Mild	ADRB2	45	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223469	DE	On-Demand	Mild	ADRB1	74	45
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223469	DE	On-Demand	Mild	ADRB3	47	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223470	DE	On-Demand	Mild	ADRB2	45	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223470	DE	On-Demand	Mild	ADRB1	74	45
N#CCc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223470	DE	On-Demand	Mild	ADRB3	47	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223531	FF	On-Demand	Anodyne	ADRB2	55	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223531	FF	On-Demand	Anodyne	ADRB1	88	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223531	FF	On-Demand	Anodyne	ADRB3	61	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223531	FF	On-Demand	Anodyne	HRH3	17	41
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223531	FF	On-Demand	Anodyne	ABCB1	21	55
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223533	FF	On-Demand	Anodyne	ADRB2	55	42
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223533	FF	On-Demand	Anodyne	ADRB1	88	45
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223533	FF	On-Demand	Anodyne	ADRB3	61	45
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223533	FF	On-Demand	Anodyne	HRH3	17	41
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCN(C(C)C)CC2)cc1	ZINC000872223533	FF	On-Demand	Anodyne	ABCB1	21	55
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	CHRM2	17	44
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	DRD2	22	45
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	DRD4	45	43
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	ACHE	64	57
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	DRD3	17	42
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	SLC6A3	21	56
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	CHRM3	19	44
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	SIGMAR1	78	49
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	BCHE	19	49
O[C@@H]1CCCC[C@H]1NCCC1CCN(Cc2ccccc2)CC1	ZINC000872223573	DG	On-Demand	Anodyne	SLC18A3	26	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	ADRB2	46	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	GRIN1	27	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	ADRB3	51	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	ABCB1	20	41
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223574	EE	On-Demand	Anodyne	FFAR1	17	42
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	ADRB2	46	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	GRIN1	27	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	ADRB3	51	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	ABCB1	20	41
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223575	EE	On-Demand	Anodyne	FFAR1	17	42
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223576	GE	On-Demand	Anodyne	ACHE	53	47
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223576	GE	On-Demand	Anodyne	SLC6A3	16	49
O[C@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223576	GE	On-Demand	Anodyne	SIGMAR1	61	43
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223577	GE	On-Demand	Anodyne	ACHE	53	47
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223577	GE	On-Demand	Anodyne	SLC6A3	16	49
O[C@@H](CNCCC1CCN(Cc2ccccc2)CC1)CC1(O)CCOCC1	ZINC000872223577	GE	On-Demand	Anodyne	SIGMAR1	61	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223586	DD	On-Demand	Bother	ADRB2	21	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223586	DD	On-Demand	Bother	ADRB1	34	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223586	DD	On-Demand	Bother	ADRB3	25	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223586	DD	On-Demand	Bother	PDS	16	44
O=C(CCNCC[C@@H]1CCCS1)Nc1ccccc1	ZINC000872223590	CF	On-Demand	Anodyne	HDAC11	15	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223591	DD	On-Demand	Bother	ADRB2	21	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223591	DD	On-Demand	Bother	ADRB1	34	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223591	DD	On-Demand	Bother	ADRB3	25	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccnc(F)c2)c1	ZINC000872223591	DD	On-Demand	Bother	PDS	16	44
O=C(CCNCC[C@H]1CCCS1)Nc1ccccc1	ZINC000872223593	CF	On-Demand	Anodyne	HDAC11	15	40
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223612	DF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223612	DF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223612	DF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223612	DF	On-Demand	Anodyne	ABCB1	15	56
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223613	DF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223613	DF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223613	DF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223613	DF	On-Demand	Anodyne	ABCB1	15	56
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223615	DF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223615	DF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223615	DF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223615	DF	On-Demand	Anodyne	ABCB1	15	56
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223616	DG	On-Demand	Bother	CACNA1C	54	37
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223616	DG	On-Demand	Bother	CACNA1D	85	37
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223617	DF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223617	DF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223617	DF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223617	DF	On-Demand	Anodyne	ABCB1	15	56
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223618	DG	On-Demand	Bother	CACNA1C	54	37
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCC3(CC2)CC3)c1	ZINC000872223618	DG	On-Demand	Bother	CACNA1D	85	37
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223620	ED	On-Demand	Anodyne	ADRB2	23	44
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223620	ED	On-Demand	Anodyne	ADRB1	26	44
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223620	ED	On-Demand	Anodyne	ADRB3	93	44
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223623	ED	On-Demand	Anodyne	ADRB2	23	44
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223623	ED	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1cccnc1	ZINC000872223623	ED	On-Demand	Anodyne	ADRB3	93	44
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1cccc(Cl)c1	ZINC000872223627	FG	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCc1ccnc(N2CCSCC2)c1)c1cccc(Cl)c1	ZINC000872223627	FG	On-Demand	Anodyne	ADRB3	48	45
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1cccc(Cl)c1	ZINC000872223629	FG	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCc1ccnc(N2CCSCC2)c1)c1cccc(Cl)c1	ZINC000872223629	FG	On-Demand	Anodyne	ADRB3	48	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000872223638	JH	On-Demand	Bother	AVPR2	33	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000872223638	JH	On-Demand	Bother	TAAR1	36	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223646	EE	On-Demand	Anodyne	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223646	EE	On-Demand	Anodyne	ADRB1	94	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223646	EE	On-Demand	Anodyne	ADRB3	60	57
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cccc(F)c1F	ZINC000872223647	EE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cccc(F)c1F	ZINC000872223648	EE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223650	EE	On-Demand	Anodyne	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223650	EE	On-Demand	Anodyne	ADRB1	94	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223650	EE	On-Demand	Anodyne	ADRB3	60	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223651	EE	On-Demand	Anodyne	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223651	EE	On-Demand	Anodyne	ADRB1	94	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223651	EE	On-Demand	Anodyne	ADRB3	60	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223652	EE	On-Demand	Anodyne	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223652	EE	On-Demand	Anodyne	ADRB1	94	57
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223652	EE	On-Demand	Anodyne	ADRB3	60	57
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223653	DE	On-Demand	Mild	ADRB2	43	42
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223653	DE	On-Demand	Mild	ADRB1	71	42
N#Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223653	DE	On-Demand	Mild	ADRB3	41	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223654	DE	On-Demand	Mild	ADRB2	43	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223654	DE	On-Demand	Mild	ADRB1	71	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872223654	DE	On-Demand	Mild	ADRB3	41	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223656	DE	On-Demand	Mild	ADRB2	43	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223656	DE	On-Demand	Mild	ADRB1	71	42
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223656	DE	On-Demand	Mild	ADRB3	41	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223657	DE	On-Demand	Mild	ADRB2	43	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223657	DE	On-Demand	Mild	ADRB1	71	42
N#Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872223657	DE	On-Demand	Mild	ADRB3	41	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CELA1	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	ELANE	36	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	LTA4H	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	NPR1	55	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTRA_BOVIN	41	30
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CASP3	17	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	BMP1	24	54
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	KCNQ2	31	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	KLK3	82	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTSB	79	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	PAPA1_CARPA	86	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CYSP_TRYCR	56	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	NTSR1	59	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	NTSR2	44	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTSK	55	54
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTSL	59	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	PGA	21	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	PREP	20	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CAPNS1	71	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTSS	29	54
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CAPN1	94	54
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CASP1	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CTRC	19	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CAPN2	140	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	PLAU	26	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CASP6	20	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CASP9	39	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	TGM2	43	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	TPSAB1	40	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	NPR	75	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	CASP10	35	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	PSMB5	50	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	F2RL1	30	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872223658	II	On-Demand	Anodyne	Q6PRC7_IXORI	44	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccnc(F)c2)CC1	ZINC000872223670	FE	On-Demand	Anodyne	GPR119	64	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccnc(F)c2)CC1	ZINC000872223683	FE	On-Demand	Anodyne	GPR119	64	51
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223697	DF	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223697	DF	On-Demand	Anodyne	ADRB1	85	43
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223697	DF	On-Demand	Anodyne	ADRB3	55	40
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223697	DF	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223701	DF	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223701	DF	On-Demand	Anodyne	ADRB1	85	43
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223701	DF	On-Demand	Anodyne	ADRB3	55	40
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H]2CCCS2)c1	ZINC000872223701	DF	On-Demand	Anodyne	ABCB1	19	45
O[C@H](CNCc1ccnc(F)c1)COc1cccc(Br)c1	ZINC000872223703	FF	On-Demand	Anodyne	PDS	34	40
O[C@@H](CNCc1ccnc(F)c1)COc1cccc(Br)c1	ZINC000872223704	FF	On-Demand	Anodyne	PDS	34	40
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223705	DF	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223705	DF	On-Demand	Anodyne	ADRB1	85	43
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223705	DF	On-Demand	Anodyne	ADRB3	55	40
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223705	DF	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223708	DF	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223708	DF	On-Demand	Anodyne	ADRB1	85	43
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223708	DF	On-Demand	Anodyne	ADRB3	55	40
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H]2CCCS2)c1	ZINC000872223708	DF	On-Demand	Anodyne	ABCB1	19	45
O=[N+]([O-])c1cnn(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223721	GE	On-Demand	Bother	DRD4	23	42
O=[N+]([O-])c1cnn(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223721	GE	On-Demand	Bother	ACHE	52	56
O=[N+]([O-])c1cnn(C[C@@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223721	GE	On-Demand	Bother	SIGMAR1	32	45
O=[N+]([O-])c1cnn(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223722	GE	On-Demand	Bother	DRD4	23	42
O=[N+]([O-])c1cnn(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223722	GE	On-Demand	Bother	ACHE	52	56
O=[N+]([O-])c1cnn(C[C@H](O)CNCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000872223722	GE	On-Demand	Bother	SIGMAR1	32	45
N#Cc1ccccc1OC[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223723	DD	On-Demand	Mild	ADRB2	19	54
N#Cc1ccccc1OC[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223723	DD	On-Demand	Mild	ADRB1	72	55
N#Cc1ccccc1OC[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223723	DD	On-Demand	Mild	CASR	45	48
N#Cc1ccccc1OC[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223723	DD	On-Demand	Mild	CYP2D6	20	48
N#Cc1ccccc1OC[C@H](O)CNCc1ccnc(F)c1	ZINC000872223724	DD	On-Demand	Mild	ADRB2	19	54
N#Cc1ccccc1OC[C@H](O)CNCc1ccnc(F)c1	ZINC000872223724	DD	On-Demand	Mild	ADRB1	72	55
N#Cc1ccccc1OC[C@H](O)CNCc1ccnc(F)c1	ZINC000872223724	DD	On-Demand	Mild	CASR	45	48
N#Cc1ccccc1OC[C@H](O)CNCc1ccnc(F)c1	ZINC000872223724	DD	On-Demand	Mild	CYP2D6	20	48
CSc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223773	DE	On-Demand	Anodyne	ADRB2	37	41
CSc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223773	DE	On-Demand	Anodyne	ADRB1	53	41
CSc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223773	DE	On-Demand	Anodyne	GRIN1	16	40
CSc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223773	DE	On-Demand	Anodyne	ADRB3	34	40
CSc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223774	DE	On-Demand	Anodyne	ADRB2	37	41
CSc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223774	DE	On-Demand	Anodyne	ADRB1	53	41
CSc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223774	DE	On-Demand	Anodyne	GRIN1	16	40
CSc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223774	DE	On-Demand	Anodyne	ADRB3	34	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccnc(F)c1	ZINC000872223784	DD	On-Demand	Bother	ADRB1	50	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223785	DD	On-Demand	Bother	ADRB1	50	38
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1C(F)(F)F	ZINC000872223792	EF	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCc1ccnc(F)c1)COc1ccccc1C(F)(F)F	ZINC000872223792	EF	On-Demand	Anodyne	ADRB1	55	36
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1C(F)(F)F	ZINC000872223793	EF	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCc1ccnc(F)c1)COc1ccccc1C(F)(F)F	ZINC000872223793	EF	On-Demand	Anodyne	ADRB1	55	36
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	CHRM2	19	40
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	DRD2	18	44
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	DRD4	42	43
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	ACHE	64	57
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	SLC6A3	17	54
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	CHRM3	23	40
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	SIGMAR1	84	45
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	BCHE	20	47
OC1(CNCCC2CCN(Cc3ccccc3)CC2)CCCC1	ZINC000872223812	DG	On-Demand	Anodyne	CACNA1G	17	44
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(F)c2F)cc1	ZINC000872223834	EE	On-Demand	Anodyne	CTSF	42	31
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(F)c2F)cc1	ZINC000872223835	EE	On-Demand	Anodyne	CTSF	42	31
C#CCNC(=O)CCNCc1cccnc1Oc1cccc(C(F)(F)F)c1	ZINC000872223836	GG	On-Demand	Mild	P2RY1	30	50
C#CCNC(=O)CCNCc1cccnc1Oc1cccc(C(F)(F)F)c1	ZINC000872223836	GG	On-Demand	Mild	PDS	43	41
N#Cc1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223844	DF	On-Demand	Mild	ADRB2	22	57
N#Cc1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223844	DF	On-Demand	Mild	ADRB1	79	54
N#Cc1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223844	DF	On-Demand	Mild	CASR	43	45
N#Cc1ccccc1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223844	DF	On-Demand	Mild	CYP2D6	18	46
N#Cc1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223849	DF	On-Demand	Mild	ADRB2	22	57
N#Cc1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223849	DF	On-Demand	Mild	ADRB1	79	54
N#Cc1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223849	DF	On-Demand	Mild	CASR	43	45
N#Cc1ccccc1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872223849	DF	On-Demand	Mild	CYP2D6	18	46
C#CCNC(=O)CCN[C@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223851	EF	On-Demand	Mild	PRCP	23	50
C#CCNC(=O)CCN[C@@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000872223853	EF	On-Demand	Mild	PRCP	23	50
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	DRD2	17	43
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	DRD4	42	39
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	ACHE	59	50
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	SLC6A3	22	52
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	SIGMAR1	68	47
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	BCHE	18	46
CN(C[C@@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223858	EE	On-Demand	Anodyne	MCHR1	18	40
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	DRD2	17	43
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	DRD4	42	39
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	ACHE	59	50
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	SLC6A3	22	52
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	SIGMAR1	68	47
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	BCHE	18	46
CN(C[C@H](O)CNCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000872223859	EE	On-Demand	Anodyne	MCHR1	18	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223860	ED	On-Demand	Anodyne	ADRB2	47	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223860	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223860	ED	On-Demand	Anodyne	GRIN1	30	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223860	ED	On-Demand	Anodyne	ADRB3	53	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223861	ED	On-Demand	Anodyne	ADRB2	47	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223861	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223861	ED	On-Demand	Anodyne	GRIN1	30	45
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccnc(F)c2)cc1	ZINC000872223861	ED	On-Demand	Anodyne	ADRB3	53	55
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	CTSD	105	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	PGC	55	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	CTSB	20	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	BACE2	49	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	REN	77	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	REN1	20	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	BACE1	109	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccnc(F)c1	ZINC000872223862	GF	On-Demand	Anodyne	FPR1	47	38
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223893	EF	On-Demand	Anodyne	ADRB2	51	58
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223893	EF	On-Demand	Anodyne	ADRB1	91	58
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223893	EF	On-Demand	Anodyne	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223893	EF	On-Demand	Anodyne	ADRB3	59	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223894	EF	On-Demand	Anodyne	ADRB2	51	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223894	EF	On-Demand	Anodyne	ADRB1	91	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223894	EF	On-Demand	Anodyne	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872223894	EF	On-Demand	Anodyne	ADRB3	59	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3c2CCOC3)CC1	ZINC000872223952	GF	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3c2CCOC3)CC1	ZINC000872223953	GF	On-Demand	Anodyne	GPR119	39	49
O=C(CCNCC[C@H]1CCCS1)Nc1cccnc1	ZINC000872224009	CE	On-Demand	Anodyne	NAMPT	16	40
O=C(CCNCC[C@@H]1CCCS1)Nc1cccnc1	ZINC000872224010	CE	On-Demand	Anodyne	NAMPT	16	40
CCOC[C@H](O)CNCc1ccccc1C(=O)OC(C)(C)C	ZINC000872224014	DE	On-Demand	Anodyne	ADRB2	20	42
N#CCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224023	EG	On-Demand	Mild	ADRB2	35	43
N#CCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224023	EG	On-Demand	Mild	ADRB1	67	44
N#CCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224023	EG	On-Demand	Mild	ADRB3	43	43
N#CCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224024	EG	On-Demand	Mild	ADRB2	35	43
N#CCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224024	EG	On-Demand	Mild	ADRB1	67	44
N#CCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224024	EG	On-Demand	Mild	ADRB3	43	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872224027	EE	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872224027	EE	On-Demand	Anodyne	ADRB1	52	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872224028	EE	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872224028	EE	On-Demand	Anodyne	ADRB1	52	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872224029	EE	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872224029	EE	On-Demand	Anodyne	ADRB1	52	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872224030	EE	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OC)c1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872224030	EE	On-Demand	Anodyne	ADRB1	52	43
COC[C@@H](O)CNCc1ccccc1C(=O)OC(C)(C)C	ZINC000872224040	CD	On-Demand	Anodyne	ADRB2	23	44
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	AVPR2	23	40
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	HRH3	23	44
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	ACOX1	18	40
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	HDAC8	18	43
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	ACR	52	32
O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224052	FG	On-Demand	Anodyne	L3MBTL3	62	38
O=C1CCc2cc(OC[C@H](O)CNCC[C@H]3CCCS3)ccc2N1	ZINC000872224057	FE	On-Demand	Anodyne	ADRB1	47	38
O=C1CCc2cc(OC[C@H](O)CNCC[C@H]3CCCS3)ccc2N1	ZINC000872224057	FE	On-Demand	Anodyne	ADRB3	28	41
O=C1CCc2cc(OC[C@@H](O)CNCC[C@H]3CCCS3)ccc2N1	ZINC000872224058	FE	On-Demand	Anodyne	ADRB1	47	38
O=C1CCc2cc(OC[C@@H](O)CNCC[C@H]3CCCS3)ccc2N1	ZINC000872224058	FE	On-Demand	Anodyne	ADRB3	28	41
O=C1CCc2cc(OC[C@@H](O)CNCC[C@@H]3CCCS3)ccc2N1	ZINC000872224059	FE	On-Demand	Anodyne	ADRB1	47	38
O=C1CCc2cc(OC[C@@H](O)CNCC[C@@H]3CCCS3)ccc2N1	ZINC000872224059	FE	On-Demand	Anodyne	ADRB3	28	41
O=C1CCc2cc(OC[C@H](O)CNCC[C@@H]3CCCS3)ccc2N1	ZINC000872224060	FE	On-Demand	Anodyne	ADRB1	47	38
O=C1CCc2cc(OC[C@H](O)CNCC[C@@H]3CCCS3)ccc2N1	ZINC000872224060	FE	On-Demand	Anodyne	ADRB3	28	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872224069	EE	On-Demand	Bother	ADRB2	33	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872224069	EE	On-Demand	Bother	ADRB1	52	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@H]1CCCS1	ZINC000872224069	EE	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872224070	EE	On-Demand	Bother	ADRB2	33	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872224070	EE	On-Demand	Bother	ADRB1	52	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCC[C@@H]1CCCS1	ZINC000872224070	EE	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872224071	EE	On-Demand	Bother	ADRB2	33	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872224071	EE	On-Demand	Bother	ADRB1	52	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@H]1CCCS1	ZINC000872224071	EE	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872224072	EE	On-Demand	Bother	ADRB2	33	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872224072	EE	On-Demand	Bother	ADRB1	52	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCC[C@@H]1CCCS1	ZINC000872224072	EE	On-Demand	Bother	ADRB3	23	40
O[C@H](CCc1ccccc1)CNCC[C@@H]1CCCS1	ZINC000872224101	CF	On-Demand	Anodyne	SLC18A2	42	36
O[C@@H](CCc1ccccc1)CNCC[C@@H]1CCCS1	ZINC000872224102	CF	On-Demand	Anodyne	SLC18A2	42	36
O[C@H](CCc1ccccc1)CNCC[C@H]1CCCS1	ZINC000872224103	CF	On-Demand	Anodyne	SLC18A2	42	36
O[C@@H](CCc1ccccc1)CNCC[C@H]1CCCS1	ZINC000872224104	CF	On-Demand	Anodyne	SLC18A2	42	36
O[C@@H](CNCC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224109	CG	On-Demand	Anodyne	ADRB1	50	48
O[C@@H](CNCC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224109	CG	On-Demand	Anodyne	ADRB3	65	48
O[C@@H](CNCC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224110	CG	On-Demand	Anodyne	ADRB1	50	48
O[C@@H](CNCC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224110	CG	On-Demand	Anodyne	ADRB3	65	48
O[C@H](CNCC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224111	CG	On-Demand	Anodyne	ADRB1	50	48
O[C@H](CNCC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224111	CG	On-Demand	Anodyne	ADRB3	65	48
O[C@H](CNCC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224112	CG	On-Demand	Anodyne	ADRB1	50	48
O[C@H](CNCC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000872224112	CG	On-Demand	Anodyne	ADRB3	65	48
N#Cc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224113	DF	On-Demand	Mild	ADRB2	29	40
N#Cc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224113	DF	On-Demand	Mild	ADRB1	59	42
N#Cc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224113	DF	On-Demand	Mild	ADRB3	30	40
N#Cc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224114	DF	On-Demand	Mild	ADRB2	29	40
N#Cc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224114	DF	On-Demand	Mild	ADRB1	59	42
N#Cc1ccc(OC[C@H](O)CNCC2CCC3(CC2)CC3)cc1	ZINC000872224114	DF	On-Demand	Mild	ADRB3	30	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@H]2CCCS2)CC1	ZINC000872224119	FF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@@H]2CCCS2)CC1	ZINC000872224120	FF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@H]2CCCS2)CC1	ZINC000872224121	FF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@@H]2CCCS2)CC1	ZINC000872224122	FF	On-Demand	Anodyne	GPR119	25	40
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224132	JI	On-Demand	Anodyne	AVPR2	45	38
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872224132	JI	On-Demand	Anodyne	L3MBTL3	79	36
COc1cccc(OC)c1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224133	EG	On-Demand	Anodyne	ADRB2	34	43
COc1cccc(OC)c1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224133	EG	On-Demand	Anodyne	ADRB1	50	41
COc1cccc(OC)c1OC[C@@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224133	EG	On-Demand	Anodyne	ADRB3	18	47
COc1cccc(OC)c1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224134	EG	On-Demand	Anodyne	ADRB2	34	43
COc1cccc(OC)c1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224134	EG	On-Demand	Anodyne	ADRB1	50	41
COc1cccc(OC)c1OC[C@H](O)CNCC1CCC2(CC1)CC2	ZINC000872224134	EG	On-Demand	Anodyne	ADRB3	18	47
O[C@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224147	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224147	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224147	CE	On-Demand	Anodyne	ADRB3	85	42
O[C@@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224148	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224148	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224148	CE	On-Demand	Anodyne	ADRB3	85	42
O[C@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224149	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224149	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224149	CE	On-Demand	Anodyne	ADRB3	85	42
O[C@@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224150	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224150	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000872224150	CE	On-Demand	Anodyne	ADRB3	85	42
CCCCCCn1nc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	ZINC000872224212	II	On-Demand	Anodyne	AVPR2	45	35
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224218	EF	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224218	EF	On-Demand	Anodyne	ADRB1	76	43
CCOc1ccc(OC[C@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224218	EF	On-Demand	Anodyne	ADRB3	50	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224219	EF	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224219	EF	On-Demand	Anodyne	ADRB1	76	43
CCOc1ccc(OC[C@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224219	EF	On-Demand	Anodyne	ADRB3	50	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224222	EF	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224222	EF	On-Demand	Anodyne	ADRB1	76	43
CCOc1ccc(OC[C@@H](O)CNCC[C@H]2CCCS2)cc1	ZINC000872224222	EF	On-Demand	Anodyne	ADRB3	50	43
COCc1cc(NC[C@@H](O)CSC)ccc1OC	ZINC000872224223	CD	On-Demand	Anodyne	QRFPR	40	33
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224224	EF	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224224	EF	On-Demand	Anodyne	ADRB1	76	43
CCOc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCS2)cc1	ZINC000872224224	EF	On-Demand	Anodyne	ADRB3	50	43
COCc1cc(NC[C@H](O)CSC)ccc1OC	ZINC000872224225	CD	On-Demand	Anodyne	QRFPR	40	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224235	FE	On-Demand	Anodyne	ADRB1	35	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224235	FE	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224235	FE	On-Demand	Anodyne	CYP3A4	53	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224235	FE	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224239	FE	On-Demand	Anodyne	ADRB1	35	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224239	FE	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224239	FE	On-Demand	Anodyne	CYP3A4	53	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](O)C1	ZINC000872224239	FE	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224240	FE	On-Demand	Anodyne	ADRB1	35	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224240	FE	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224240	FE	On-Demand	Anodyne	CYP3A4	53	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224240	FE	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224241	FE	On-Demand	Anodyne	ADRB1	35	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224241	FE	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224241	FE	On-Demand	Anodyne	CYP3A4	53	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H](O)C1	ZINC000872224241	FE	On-Demand	Anodyne	GPR119	37	42
COCc1cc(NC[C@@H](O)C[C@@](C)(O)C2CC2)ccc1OC	ZINC000872224259	DE	On-Demand	Anodyne	QRFPR	40	33
COCc1cc(NC[C@H](O)C[C@@](C)(O)C2CC2)ccc1OC	ZINC000872224260	DE	On-Demand	Anodyne	QRFPR	40	33
COCc1cc(NC[C@@H](O)C[C@](C)(O)C2CC2)ccc1OC	ZINC000872224261	DE	On-Demand	Anodyne	QRFPR	40	33
COCc1cc(NC[C@H](O)C[C@](C)(O)C2CC2)ccc1OC	ZINC000872224262	DE	On-Demand	Anodyne	QRFPR	40	33
CC[C@@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872224267	CF	On-Demand	Anodyne	MPO	77	47
CC[C@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872224268	CF	On-Demand	Anodyne	MPO	77	47
COCc1cc(NC[C@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224277	EF	On-Demand	Mild	ADRB2	23	55
COCc1cc(NC[C@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224277	EF	On-Demand	Mild	ADRB1	69	50
COCc1cc(NC[C@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224277	EF	On-Demand	Mild	CASR	47	48
COCc1cc(NC[C@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224277	EF	On-Demand	Mild	CYP2D6	27	52
COCc1cc(NC[C@@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224278	EF	On-Demand	Mild	ADRB2	23	55
COCc1cc(NC[C@@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224278	EF	On-Demand	Mild	ADRB1	69	50
COCc1cc(NC[C@@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224278	EF	On-Demand	Mild	CASR	47	48
COCc1cc(NC[C@@H](O)COc2ccccc2C#N)ccc1OC	ZINC000872224278	EF	On-Demand	Mild	CYP2D6	27	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C(C)(C)C)[C@@H](O)C1	ZINC000872224296	DD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C(C)(C)C)[C@@H](O)C1	ZINC000872224297	DD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C(C)(C)C)[C@H](O)C1	ZINC000872224298	DD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C(C)(C)C)[C@H](O)C1	ZINC000872224299	DD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCCC[C@H]2O)[C@H](O)C1	ZINC000872224300	DD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2CCCC[C@H]2O)[C@@H](O)C1	ZINC000872224301	DD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCCC[C@H]2O)[C@@H](O)C1	ZINC000872224302	DD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2CCCC[C@H]2O)[C@H](O)C1	ZINC000872224303	DD	On-Demand	Anodyne	GPR119	39	42
COCc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000872224308	CF	On-Demand	Anodyne	ADRB2	30	43
COCc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000872224308	CF	On-Demand	Anodyne	ADRB1	17	41
COCc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000872224308	CF	On-Demand	Anodyne	TSHR	41	32
COCc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000872224308	CF	On-Demand	Anodyne	ADRB3	39	41
COCc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000872224309	CF	On-Demand	Anodyne	ADRB2	30	43
COCc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000872224309	CF	On-Demand	Anodyne	ADRB1	17	41
COCc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000872224309	CF	On-Demand	Anodyne	TSHR	41	32
COCc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000872224309	CF	On-Demand	Anodyne	ADRB3	39	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)[C@@H](O)C1	ZINC000872224315	FD	On-Demand	Anodyne	CCR3	21	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)[C@@H](O)C1	ZINC000872224315	FD	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)[C@H](O)C1	ZINC000872224316	FD	On-Demand	Anodyne	CCR3	21	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)[C@H](O)C1	ZINC000872224316	FD	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)[C@@H](O)C1	ZINC000872224317	FD	On-Demand	Anodyne	CCR3	21	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)[C@@H](O)C1	ZINC000872224317	FD	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)[C@H](O)C1	ZINC000872224318	FD	On-Demand	Anodyne	CCR3	21	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)[C@H](O)C1	ZINC000872224318	FD	On-Demand	Anodyne	GPR119	47	45
COCc1cc(NC[C@H](O)COc2ccccc2C)ccc1OC	ZINC000872224319	EG	On-Demand	Anodyne	ADRB2	32	51
COCc1cc(NC[C@H](O)COc2ccccc2C)ccc1OC	ZINC000872224319	EG	On-Demand	Anodyne	CYP2D6	21	42
COCc1cc(NC[C@@H](O)COc2ccccc2C)ccc1OC	ZINC000872224320	EG	On-Demand	Anodyne	ADRB2	32	51
COCc1cc(NC[C@@H](O)COc2ccccc2C)ccc1OC	ZINC000872224320	EG	On-Demand	Anodyne	CYP2D6	21	42
CC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872224327	CC	On-Demand	Anodyne	GPR119	41	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224328	ED	On-Demand	Anodyne	ADRB2	43	48
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224328	ED	On-Demand	Anodyne	ADRB1	59	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224328	ED	On-Demand	Anodyne	ADRB3	40	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224329	ED	On-Demand	Anodyne	ADRB2	43	48
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224329	ED	On-Demand	Anodyne	ADRB1	59	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224329	ED	On-Demand	Anodyne	ADRB3	40	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCC[C@@H]2O)cc1	ZINC000872224332	CC	On-Demand	Anodyne	ADRB1	15	40
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224356	DE	On-Demand	Anodyne	ADRB2	24	73
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224356	DE	On-Demand	Anodyne	ADRB1	30	73
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224356	DE	On-Demand	Anodyne	HTR1A	17	73
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224356	DE	On-Demand	Anodyne	SLC6A4	20	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224356	DE	On-Demand	Anodyne	ADRB3	15	64
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224357	DE	On-Demand	Anodyne	ADRB2	24	73
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224357	DE	On-Demand	Anodyne	ADRB1	30	73
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224357	DE	On-Demand	Anodyne	HTR1A	17	73
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224357	DE	On-Demand	Anodyne	SLC6A4	20	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872224357	DE	On-Demand	Anodyne	ADRB3	15	64
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224389	DD	On-Demand	Anodyne	ADRB2	46	61
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224389	DD	On-Demand	Anodyne	ADRB1	78	61
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224389	DD	On-Demand	Anodyne	ADRB3	50	50
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224390	DD	On-Demand	Anodyne	ADRB2	46	61
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224390	DD	On-Demand	Anodyne	ADRB1	78	61
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872224390	DD	On-Demand	Anodyne	ADRB3	50	50
CSc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224449	DF	On-Demand	Anodyne	ADRB2	35	43
CSc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224449	DF	On-Demand	Anodyne	ADRB1	39	42
CSc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224449	DF	On-Demand	Anodyne	ADRB3	23	41
CSc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224450	DF	On-Demand	Anodyne	ADRB2	35	43
CSc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224450	DF	On-Demand	Anodyne	ADRB1	39	42
CSc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224450	DF	On-Demand	Anodyne	ADRB3	23	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224463	EE	On-Demand	Anodyne	ADRB2	46	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224463	EE	On-Demand	Anodyne	ADRB1	73	51
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224463	EE	On-Demand	Anodyne	ADRB3	51	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224463	EE	On-Demand	Anodyne	ABCB1	20	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224464	EE	On-Demand	Anodyne	ADRB2	46	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224464	EE	On-Demand	Anodyne	ADRB1	73	51
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224464	EE	On-Demand	Anodyne	ADRB3	51	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000872224464	EE	On-Demand	Anodyne	ABCB1	20	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000872224519	CE	On-Demand	Anodyne	ADRB2	38	59
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000872224519	CE	On-Demand	Anodyne	ADRB3	15	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000872224519	CE	On-Demand	Anodyne	ABCB1	26	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000872224531	CE	On-Demand	Anodyne	ADRB2	38	59
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000872224531	CE	On-Demand	Anodyne	ADRB3	15	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000872224531	CE	On-Demand	Anodyne	ABCB1	26	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872224570	EF	On-Demand	Anodyne	ADRB2	29	46
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872224570	EF	On-Demand	Anodyne	ADRB1	29	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872224572	EF	On-Demand	Anodyne	ADRB2	29	46
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872224572	EF	On-Demand	Anodyne	ADRB1	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CTSD	130	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	PGC	65	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CMA1	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CTRA_BOVIN	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	PAPA1_CARPA	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CCKAR	48	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CTSK	20	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	CACNA1B	42	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	PGA	45	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	BACE2	57	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	TACR3	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	REN	117	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	REN1	32	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	BACE1	93	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	FPR1	59	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	PLM1_PLAFA	34	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC[C@@H]1O	ZINC000872224573	FD	On-Demand	Anodyne	PLM2_PLAFA	58	35
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872224600	CD	On-Demand	Mild	ADRB2	28	62
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872224600	CD	On-Demand	Mild	ADRB1	76	46
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872224600	CD	On-Demand	Mild	CASR	44	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872224600	CD	On-Demand	Mild	CYP2D6	21	48
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872224601	CD	On-Demand	Mild	ADRB2	28	62
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872224601	CD	On-Demand	Mild	ADRB1	76	46
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872224601	CD	On-Demand	Mild	CASR	44	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872224601	CD	On-Demand	Mild	CYP2D6	21	48
CS[C@@H]1C[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872224619	DE	On-Demand	Anodyne	SIGMAR1	51	39
CS[C@@H]1C[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872224619	DE	On-Demand	Anodyne	NPFFR1	41	38
CS[C@@H]1C[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872224620	DE	On-Demand	Anodyne	SIGMAR1	51	39
CS[C@@H]1C[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872224620	DE	On-Demand	Anodyne	NPFFR1	41	38
CS[C@@H]1C[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000872224653	CE	On-Demand	Anodyne	ACE	21	43
CS[C@@H]1C[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000872224654	CE	On-Demand	Anodyne	ACE	21	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872224669	CE	On-Demand	Anodyne	ADRB2	40	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872224669	CE	On-Demand	Anodyne	ADRB1	47	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872224669	CE	On-Demand	Anodyne	ADRB3	28	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872224670	CE	On-Demand	Anodyne	ADRB2	40	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872224670	CE	On-Demand	Anodyne	ADRB1	47	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872224670	CE	On-Demand	Anodyne	ADRB3	28	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872224673	DF	On-Demand	Anodyne	ADRB2	16	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872224674	DF	On-Demand	Anodyne	ADRB2	16	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224689	DE	On-Demand	Anodyne	ADRB2	33	48
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224689	DE	On-Demand	Anodyne	ADRB1	38	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224689	DE	On-Demand	Anodyne	ADRB3	27	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224689	DE	On-Demand	Anodyne	ABCB1	16	46
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224689	DE	On-Demand	Anodyne	PDS	70	39
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224690	DE	On-Demand	Anodyne	ADRB2	33	48
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224690	DE	On-Demand	Anodyne	ADRB1	38	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224690	DE	On-Demand	Anodyne	ADRB3	27	41
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224690	DE	On-Demand	Anodyne	ABCB1	16	46
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872224690	DE	On-Demand	Anodyne	PDS	70	39
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872224697	DC	On-Demand	Anodyne	ADRB2	49	53
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872224697	DC	On-Demand	Anodyne	ADRB1	64	47
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872224697	DC	On-Demand	Anodyne	ADRB3	39	47
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872224698	DC	On-Demand	Anodyne	ADRB2	49	53
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872224698	DC	On-Demand	Anodyne	ADRB1	64	47
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872224698	DC	On-Demand	Anodyne	ADRB3	39	47
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872224699	DC	On-Demand	Anodyne	ADRB2	49	53
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872224699	DC	On-Demand	Anodyne	ADRB1	64	47
CSc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872224699	DC	On-Demand	Anodyne	ADRB3	39	47
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872224700	DC	On-Demand	Anodyne	ADRB2	49	53
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872224700	DC	On-Demand	Anodyne	ADRB1	64	47
CSc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872224700	DC	On-Demand	Anodyne	ADRB3	39	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872224735	CE	On-Demand	Anodyne	ADRB2	37	57
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872224735	CE	On-Demand	Anodyne	ADRB1	39	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872224735	CE	On-Demand	Anodyne	ADRB3	22	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872224736	CE	On-Demand	Anodyne	ADRB2	37	57
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872224736	CE	On-Demand	Anodyne	ADRB1	39	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872224736	CE	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@@H]1C[C@@H](Sc2ccccc2)C1)c1cccnc1	ZINC000872224757	DG	On-Demand	Anodyne	ADRB3	60	46
O[C@@H](CN[C@@H]1C[C@@H](Sc2ccccc2)C1)c1cccnc1	ZINC000872224758	DG	On-Demand	Anodyne	ADRB3	60	46
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224794	DD	On-Demand	Mild	ADRB2	35	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224794	DD	On-Demand	Mild	ADRB1	44	44
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224794	DD	On-Demand	Mild	ADRB3	30	40
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224795	DD	On-Demand	Mild	ADRB2	35	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224795	DD	On-Demand	Mild	ADRB1	44	44
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872224795	DD	On-Demand	Mild	ADRB3	30	40
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1C[C@@H](SC)C1	ZINC000872224803	ED	On-Demand	Anodyne	ADRB2	30	45
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1C[C@@H](SC)C1	ZINC000872224803	ED	On-Demand	Anodyne	ADRB1	30	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@@H](SC)C1	ZINC000872224804	ED	On-Demand	Anodyne	ADRB2	30	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@@H](SC)C1	ZINC000872224804	ED	On-Demand	Anodyne	ADRB1	30	45
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224809	EE	On-Demand	Anodyne	ADRB2	44	62
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224809	EE	On-Demand	Anodyne	ADRB1	65	62
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224809	EE	On-Demand	Anodyne	ADRB3	44	43
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224810	EE	On-Demand	Anodyne	ADRB2	44	62
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224810	EE	On-Demand	Anodyne	ADRB1	65	62
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872224810	EE	On-Demand	Anodyne	ADRB3	44	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224821	DE	On-Demand	Anodyne	ADRB2	37	46
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224821	DE	On-Demand	Anodyne	ADRB1	51	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224821	DE	On-Demand	Anodyne	ADRB3	32	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224822	DE	On-Demand	Anodyne	ADRB2	37	46
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224822	DE	On-Demand	Anodyne	ADRB1	51	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872224822	DE	On-Demand	Anodyne	ADRB3	32	42
CS[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872224823	CF	On-Demand	Anodyne	ADRB1	31	45
CS[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872224823	CF	On-Demand	Anodyne	ADRB3	50	47
CS[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872224823	CF	On-Demand	Anodyne	CYP3A4	40	35
CS[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872224824	CF	On-Demand	Anodyne	ADRB1	31	45
CS[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872224824	CF	On-Demand	Anodyne	ADRB3	50	47
CS[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872224824	CF	On-Demand	Anodyne	CYP3A4	40	35
CS[C@@H]1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872224836	EE	On-Demand	Anodyne	GPR119	27	42
CS[C@@H]1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872224837	EE	On-Demand	Anodyne	GPR119	27	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224845	DF	On-Demand	Anodyne	ADRB2	35	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224845	DF	On-Demand	Anodyne	ADRB1	42	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224845	DF	On-Demand	Anodyne	ADRB3	26	41
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224846	DF	On-Demand	Anodyne	ADRB2	35	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224846	DF	On-Demand	Anodyne	ADRB1	42	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872224846	DF	On-Demand	Anodyne	ADRB3	26	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872224847	EF	On-Demand	Anodyne	ADRB2	30	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872224847	EF	On-Demand	Anodyne	ADRB1	28	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872224847	EF	On-Demand	Anodyne	PDS	54	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872224848	EF	On-Demand	Anodyne	ADRB2	30	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872224848	EF	On-Demand	Anodyne	ADRB1	28	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872224848	EF	On-Demand	Anodyne	PDS	54	43
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](Sc3ccccc3)C2)c1	ZINC000872224851	EH	On-Demand	Bother	CACNA1C	43	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](Sc3ccccc3)C2)c1	ZINC000872224851	EH	On-Demand	Bother	CACNA1D	62	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](Sc3ccccc3)C2)c1	ZINC000872224852	EH	On-Demand	Bother	CACNA1C	43	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](Sc3ccccc3)C2)c1	ZINC000872224852	EH	On-Demand	Bother	CACNA1D	62	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	ZINC000872224856	JJ	On-Demand	Anodyne	AVPR2	58	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	ZINC000872224856	JJ	On-Demand	Anodyne	AVPR1A	30	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	ZINC000872224856	JJ	On-Demand	Anodyne	PRNP	48	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	ZINC000872224856	JJ	On-Demand	Anodyne	L3MBTL3	61	39
O[C@H]1CCC[C@@H]1NC[C@H](O)c1ccccc1Cl	ZINC000872224870	CD	On-Demand	Anodyne	OPRL1	35	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	ADRB2	22	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	ADRB1	22	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	CACNA1C	51	35
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	ADRB3	15	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	CACNA1D	81	34
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224901	DD	On-Demand	Bother	PDS	29	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	ADRB2	22	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	ADRB1	22	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	CACNA1C	51	35
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	ADRB3	15	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	CACNA1D	81	34
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872224902	DD	On-Demand	Bother	PDS	29	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872224918	CF	On-Demand	Anodyne	ADRB2	25	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872224918	CF	On-Demand	Anodyne	ADRB1	22	41
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872224919	CF	On-Demand	Anodyne	ADRB2	25	41
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872224919	CF	On-Demand	Anodyne	ADRB1	22	41
CS[C@@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872224975	CE	On-Demand	Bother	CACNA1C	53	40
CS[C@@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872224975	CE	On-Demand	Bother	CACNA1D	80	35
CS[C@@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872224976	CE	On-Demand	Bother	CACNA1C	53	40
CS[C@@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872224976	CE	On-Demand	Bother	CACNA1D	80	35
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872225023	CD	On-Demand	Mild	ADRB2	28	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872225023	CD	On-Demand	Mild	ADRB1	31	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872225024	CD	On-Demand	Mild	ADRB2	28	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872225024	CD	On-Demand	Mild	ADRB1	31	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872225033	DD	On-Demand	Bother	ADRB2	25	44
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872225034	DD	On-Demand	Bother	ADRB2	25	44
O[C@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872225035	CD	On-Demand	Anodyne	ADRB1	42	44
O[C@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872225035	CD	On-Demand	Anodyne	ADRB3	53	48
O[C@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872225035	CD	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CN[C@H]1CCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872225036	CD	On-Demand	Anodyne	ADRB1	42	44
O[C@H](CN[C@H]1CCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872225036	CD	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CN[C@H]1CCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872225036	CD	On-Demand	Anodyne	CYP3A4	43	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCC[C@@H]2O)CC1	ZINC000872225037	ED	On-Demand	Anodyne	GPR119	44	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCC[C@@H]2O)CC1	ZINC000872225038	ED	On-Demand	Anodyne	GPR119	44	44
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	ADRB2	57	56
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	ADRB1	62	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	PTGFR	16	40
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	ADRB3	44	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	ABCB1	16	40
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872225039	CD	On-Demand	Anodyne	PDS	45	37
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	ADRB2	57	56
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	ADRB1	62	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	PTGFR	16	40
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	ADRB3	44	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	ABCB1	16	40
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872225040	CD	On-Demand	Anodyne	PDS	45	37
O[C@H](CN[C@H]1CCC[C@@H]1O)c1cccnc1	ZINC000872225043	BC	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CN[C@H]1CCC[C@@H]1O)c1cccnc1	ZINC000872225043	BC	On-Demand	Anodyne	ADRB3	85	45
O[C@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000872225044	BC	On-Demand	Anodyne	ADRB1	26	42
O[C@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000872225044	BC	On-Demand	Anodyne	ADRB3	85	45
CS[C@@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000872225049	CF	On-Demand	Anodyne	ADRB3	16	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000872225055	CF	On-Demand	Anodyne	ADRB2	20	49
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000872225055	CF	On-Demand	Anodyne	ADRB1	15	40
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000872225056	CF	On-Demand	Anodyne	ADRB2	20	49
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000872225056	CF	On-Demand	Anodyne	ADRB1	15	40
O=C(/C=C\c1cnc2ccccc2n1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225068	FH	On-Demand	Anodyne	L3MBTL3	45	33
O=C(/C=C/c1cnc2ccccc2n1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225069	FH	On-Demand	Anodyne	L3MBTL3	45	33
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872225075	DF	On-Demand	Anodyne	ADRB2	33	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872225075	DF	On-Demand	Anodyne	ADRB1	29	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872225075	DF	On-Demand	Anodyne	ABCB1	18	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872225076	DF	On-Demand	Anodyne	ADRB2	33	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872225076	DF	On-Demand	Anodyne	ADRB1	29	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872225076	DF	On-Demand	Anodyne	ABCB1	18	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872225077	CF	On-Demand	Anodyne	ADRB2	23	58
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872225077	CF	On-Demand	Anodyne	ADRB1	19	44
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872225078	CF	On-Demand	Anodyne	ADRB2	23	58
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872225078	CF	On-Demand	Anodyne	ADRB1	19	44
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872225086	CE	On-Demand	Anodyne	ADRB2	32	47
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872225086	CE	On-Demand	Anodyne	ADRB1	41	35
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872225086	CE	On-Demand	Anodyne	ADRB3	15	44
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872225087	CE	On-Demand	Anodyne	ADRB2	32	47
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872225087	CE	On-Demand	Anodyne	ADRB1	41	35
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872225087	CE	On-Demand	Anodyne	ADRB3	15	44
CS[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872225092	BE	On-Demand	Anodyne	AOC3	15	45
CS[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872225093	BE	On-Demand	Anodyne	AOC3	15	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000872225098	CF	On-Demand	Anodyne	ADRB2	23	49
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000872225098	CF	On-Demand	Anodyne	ADRB1	15	40
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000872225099	CF	On-Demand	Anodyne	ADRB2	23	49
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000872225099	CF	On-Demand	Anodyne	ADRB1	15	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225100	DE	On-Demand	Anodyne	ADRB2	38	45
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225100	DE	On-Demand	Anodyne	ADRB1	41	45
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225100	DE	On-Demand	Anodyne	ADRB3	23	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225101	DE	On-Demand	Anodyne	ADRB2	38	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225101	DE	On-Demand	Anodyne	ADRB1	41	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](SC)C2)cc1	ZINC000872225101	DE	On-Demand	Anodyne	ADRB3	23	41
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225102	EF	On-Demand	Anodyne	ADRB2	25	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225102	EF	On-Demand	Anodyne	ADRB1	24	45
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225102	EF	On-Demand	Anodyne	PDS	65	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225103	EF	On-Demand	Anodyne	ADRB2	25	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225103	EF	On-Demand	Anodyne	ADRB1	24	45
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872225103	EF	On-Demand	Anodyne	PDS	65	45
O[C@H]1CCC[C@@H]1NC[C@H](O)c1ccc(F)cc1	ZINC000872225104	BD	On-Demand	Anodyne	SLC6A3	15	49
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872225119	CE	On-Demand	Anodyne	ADRB2	37	62
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872225119	CE	On-Demand	Anodyne	ADRB1	36	62
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872225119	CE	On-Demand	Anodyne	PDS	45	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872225120	CE	On-Demand	Anodyne	ADRB2	37	62
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872225120	CE	On-Demand	Anodyne	ADRB1	36	62
CS[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872225120	CE	On-Demand	Anodyne	PDS	45	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872225133	EF	On-Demand	Anodyne	ADRB2	33	43
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872225133	EF	On-Demand	Anodyne	ADRB1	37	42
CS[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872225133	EF	On-Demand	Anodyne	ADRB3	21	41
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872225134	EF	On-Demand	Anodyne	ADRB2	33	43
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872225134	EF	On-Demand	Anodyne	ADRB1	37	42
CS[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872225134	EF	On-Demand	Anodyne	ADRB3	21	41
CC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225176	CC	On-Demand	Anodyne	GPR119	41	44
CC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225177	CC	On-Demand	Anodyne	GPR119	41	44
CC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225178	CC	On-Demand	Anodyne	GPR119	41	44
CCOC(=O)C1CCC(O)(CNc2ccc(OC)c(COC)c2)CC1	ZINC000872225179	FF	On-Demand	Anodyne	TSHR	46	30
COCc1cc(NC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000872225184	DG	On-Demand	Anodyne	ADRB2	17	42
COCc1cc(NC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000872225185	DG	On-Demand	Anodyne	ADRB2	17	42
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	DRD4	28	44
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	SIGMAR1	22	45
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	SSTR5	47	36
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	CCR2	15	45
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	MCHR1	32	44
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225186	CD	On-Demand	Mild	CACNA1I	18	43
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	DRD4	28	44
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	SIGMAR1	22	45
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	SSTR5	47	36
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	CCR2	15	45
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	MCHR1	32	44
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872225187	CD	On-Demand	Mild	CACNA1I	18	43
COC[C@@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225191	CD	On-Demand	Anodyne	MPO	65	41
O[C@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225192	CD	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225192	CD	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225192	CD	On-Demand	Anodyne	CYP3A4	48	38
O[C@@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225193	CD	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225193	CD	On-Demand	Anodyne	ADRB3	47	48
O[C@@H](CN[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1	ZINC000872225193	CD	On-Demand	Anodyne	CYP3A4	48	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C2CC2)[C@@H](O)C1	ZINC000872225212	DC	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C2CC2)[C@H](O)C1	ZINC000872225213	DC	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C2CC2)[C@@H](O)C1	ZINC000872225214	DC	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C2CC2)[C@H](O)C1	ZINC000872225215	DC	On-Demand	Anodyne	GPR119	37	41
COCc1cc(NC[C@H](O)CCc2ccccc2)ccc1OC	ZINC000872225216	DG	On-Demand	Anodyne	TSHR	43	34
COCc1cc(NC[C@@H](O)CCc2ccccc2)ccc1OC	ZINC000872225217	DG	On-Demand	Anodyne	TSHR	43	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](O)C1	ZINC000872225223	FE	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](O)C1	ZINC000872225223	FE	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)[C@@H](O)C1	ZINC000872225224	FE	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)[C@@H](O)C1	ZINC000872225224	FE	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](O)C1	ZINC000872225225	FE	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](O)C1	ZINC000872225225	FE	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@@H](O)C1	ZINC000872225226	FE	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@@H](O)C1	ZINC000872225226	FE	On-Demand	Anodyne	GPR119	44	43
COCc1cc(NC[C@H](O)COc2ccccc2F)ccc1OC	ZINC000872225227	EF	On-Demand	Anodyne	ADRB2	26	40
COCc1cc(NC[C@H](O)COc2ccccc2F)ccc1OC	ZINC000872225227	EF	On-Demand	Anodyne	ADRB1	53	35
COCc1cc(NC[C@@H](O)COc2ccccc2F)ccc1OC	ZINC000872225228	EF	On-Demand	Anodyne	ADRB2	26	40
COCc1cc(NC[C@@H](O)COc2ccccc2F)ccc1OC	ZINC000872225228	EF	On-Demand	Anodyne	ADRB1	53	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	ADRB2	47	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	ADRB1	66	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	ABCB1	31	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225231	FD	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	ADRB2	47	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	ADRB1	66	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	ABCB1	31	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@H](O)C1	ZINC000872225232	FD	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	ADRB2	47	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	ADRB1	66	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	ABCB1	31	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225233	FD	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	ADRB2	47	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	ADRB1	66	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	ABCB1	31	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)[C@@H](O)C1	ZINC000872225234	FD	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CN(c3ccncn3)C2)CC1	ZINC000872225239	GD	On-Demand	Anodyne	GPR119	57	62
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CN(c3ccncn3)C2)CC1	ZINC000872225240	GD	On-Demand	Anodyne	GPR119	57	62
COCc1cc(NC[C@@H](O)CC2CCCC2)ccc1OC	ZINC000872225241	CG	On-Demand	Anodyne	QRFPR	47	38
COCc1cc(NC[C@H](O)CC2CCCC2)ccc1OC	ZINC000872225242	CG	On-Demand	Anodyne	QRFPR	47	38
O[C@@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225243	DD	On-Demand	Anodyne	ADRB1	30	44
O[C@@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225243	DD	On-Demand	Anodyne	ADRB3	47	47
O[C@@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225243	DD	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225244	DD	On-Demand	Anodyne	ADRB1	30	44
O[C@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225244	DD	On-Demand	Anodyne	ADRB3	47	47
O[C@H](CNC1CN(c2ccncn2)C1)c1cccc(Cl)c1	ZINC000872225244	DD	On-Demand	Anodyne	CYP3A4	45	34
COCc1cc(NC[C@H](O)COc2ccc(C#N)cc2)ccc1OC	ZINC000872225245	EF	On-Demand	Mild	ADRB1	43	40
COCc1cc(NC[C@H](O)COc2ccc(C#N)cc2)ccc1OC	ZINC000872225245	EF	On-Demand	Mild	ADRB3	23	40
COCc1cc(NC[C@@H](O)COc2ccc(C#N)cc2)ccc1OC	ZINC000872225246	EF	On-Demand	Mild	ADRB1	43	40
COCc1cc(NC[C@@H](O)COc2ccc(C#N)cc2)ccc1OC	ZINC000872225246	EF	On-Demand	Mild	ADRB3	23	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225251	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225251	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225251	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225251	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225252	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225252	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225252	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225252	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225253	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225253	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225253	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225253	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225254	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225254	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225254	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225254	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225255	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225255	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225255	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225255	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225256	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225256	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225256	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@H](O)C1	ZINC000872225256	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225257	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225257	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225257	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225257	ED	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225258	ED	On-Demand	Anodyne	P2RY12	58	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225258	ED	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225258	ED	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)[C@@H](O)C1	ZINC000872225258	ED	On-Demand	Anodyne	GPR119	45	45
COCc1cc(NC[C@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225259	EG	On-Demand	Anodyne	ADRB2	39	48
COCc1cc(NC[C@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225259	EG	On-Demand	Anodyne	ADRB1	51	41
COCc1cc(NC[C@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225259	EG	On-Demand	Anodyne	TSHR	48	35
COCc1cc(NC[C@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225259	EG	On-Demand	Anodyne	ADRB3	29	41
COCc1cc(NC[C@@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225260	EG	On-Demand	Anodyne	ADRB2	39	48
COCc1cc(NC[C@@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225260	EG	On-Demand	Anodyne	ADRB1	51	41
COCc1cc(NC[C@@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225260	EG	On-Demand	Anodyne	TSHR	48	35
COCc1cc(NC[C@@H](O)COc2ccc(C)cc2)ccc1OC	ZINC000872225260	EG	On-Demand	Anodyne	ADRB3	29	41
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225262	EG	On-Demand	Anodyne	DRD4	27	46
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225262	EG	On-Demand	Anodyne	SIGMAR1	23	45
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225262	EG	On-Demand	Anodyne	CCR3	41	43
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225262	EG	On-Demand	Anodyne	MLNR	59	43
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225262	EG	On-Demand	Anodyne	MCHR1	26	42
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225263	EG	On-Demand	Anodyne	DRD4	27	46
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225263	EG	On-Demand	Anodyne	SIGMAR1	23	45
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225263	EG	On-Demand	Anodyne	CCR3	41	43
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225263	EG	On-Demand	Anodyne	MLNR	59	43
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225263	EG	On-Demand	Anodyne	MCHR1	26	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225264	EG	On-Demand	Anodyne	DRD4	27	46
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225264	EG	On-Demand	Anodyne	SIGMAR1	23	45
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225264	EG	On-Demand	Anodyne	CCR3	41	43
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225264	EG	On-Demand	Anodyne	MLNR	59	43
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc1	ZINC000872225264	EG	On-Demand	Anodyne	MCHR1	26	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	DRD4	47	46
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	ACHE	18	41
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	SLC6A3	27	47
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	CHRM3	17	45
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	SIGMAR1	42	50
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	CCR3	25	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	CCR5	20	41
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000872225282	DF	On-Demand	Anodyne	MCHR1	23	43
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	DRD4	47	46
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	ACHE	18	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	SLC6A3	27	47
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	CHRM3	17	45
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	SIGMAR1	42	50
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	CCR3	25	40
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	CCR5	20	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225283	DF	On-Demand	Anodyne	MCHR1	23	43
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	DRD4	47	46
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	ACHE	18	41
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	SLC6A3	27	47
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	CHRM3	17	45
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	SIGMAR1	42	50
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	CCR3	25	40
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	CCR5	20	41
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872225284	DF	On-Demand	Anodyne	MCHR1	23	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)[C@@H](O)C1	ZINC000872225285	GE	On-Demand	Anodyne	CCR8	41	39
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)[C@@H](O)C1	ZINC000872225285	GE	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)[C@@H](O)C1	ZINC000872225286	GE	On-Demand	Anodyne	CCR8	41	39
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)[C@@H](O)C1	ZINC000872225286	GE	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)[C@H](O)C1	ZINC000872225287	GE	On-Demand	Anodyne	CCR8	41	39
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)[C@H](O)C1	ZINC000872225287	GE	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)[C@H](O)C1	ZINC000872225288	GE	On-Demand	Anodyne	CCR8	41	39
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)[C@H](O)C1	ZINC000872225288	GE	On-Demand	Anodyne	GPR119	43	47
COCc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000872225289	EF	On-Demand	Bother	CACNA1C	42	37
COCc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000872225289	EF	On-Demand	Bother	CACNA1D	67	35
COCc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000872225290	EF	On-Demand	Bother	CACNA1C	42	37
COCc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000872225290	EF	On-Demand	Bother	CACNA1D	67	35
COCc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225293	FF	On-Demand	Anodyne	ADRB2	42	55
COCc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225293	FF	On-Demand	Anodyne	ADRB1	71	55
COCc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225293	FF	On-Demand	Anodyne	TSHR	81	42
COCc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225293	FF	On-Demand	Anodyne	ADRB3	45	50
COCc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225294	FF	On-Demand	Anodyne	ADRB2	42	55
COCc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225294	FF	On-Demand	Anodyne	ADRB1	71	55
COCc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225294	FF	On-Demand	Anodyne	TSHR	81	42
COCc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)ccc1OC	ZINC000872225294	FF	On-Demand	Anodyne	ADRB3	45	50
COCc1cc(NC[C@H](O)Cn2c(-c3ccccc3)noc2=O)ccc1OC	ZINC000872225303	GE	On-Demand	Anodyne	TSHR	56	36
COCc1cc(NC[C@@H](O)Cn2c(-c3ccccc3)noc2=O)ccc1OC	ZINC000872225304	GE	On-Demand	Anodyne	TSHR	56	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225313	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225313	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225313	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225314	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225314	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225314	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225315	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225315	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225315	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225316	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225316	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225316	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225317	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225317	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225317	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225318	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225318	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225318	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225319	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225319	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)[C@H](O)C1	ZINC000872225319	GD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225320	GD	On-Demand	Anodyne	CTSK	16	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225320	GD	On-Demand	Anodyne	GHSR	39	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)[C@@H](O)C1	ZINC000872225320	GD	On-Demand	Anodyne	GPR119	39	42
CCOC[C@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225321	CE	On-Demand	Anodyne	MPO	59	42
CON(C)C(=O)CCNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225323	DE	On-Demand	Anodyne	MPO	59	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(C#N)cc3)C2)cc1	ZINC000872225341	EF	On-Demand	Mild	MLNR	29	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C#N)cc3)C2)cc1	ZINC000872225342	EF	On-Demand	Mild	MLNR	29	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(C#N)cc3)C2)cc1	ZINC000872225343	EF	On-Demand	Mild	MLNR	29	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)[C@H](O)C1	ZINC000872225352	GE	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)[C@H](O)C1	ZINC000872225353	GE	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)[C@@H](O)C1	ZINC000872225354	GE	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)[C@@H](O)C1	ZINC000872225355	GE	On-Demand	Anodyne	GPR119	36	40
COCc1cc(NC[C@H](O)CN(C)C2CC2)ccc1OC	ZINC000872225360	CD	On-Demand	Anodyne	QRFPR	41	34
COCc1cc(NC[C@@H](O)CN(C)C2CC2)ccc1OC	ZINC000872225361	CD	On-Demand	Anodyne	QRFPR	41	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)[C@@H](O)C1	ZINC000872225362	FD	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)[C@H](O)C1	ZINC000872225363	FD	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)[C@H](O)C1	ZINC000872225364	FD	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)[C@@H](O)C1	ZINC000872225365	FD	On-Demand	Anodyne	GPR119	50	52
COCc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225368	FF	On-Demand	Anodyne	TSHR	63	35
COCc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225368	FF	On-Demand	Anodyne	SIGMAR1	29	41
COCc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225368	FF	On-Demand	Anodyne	NPFFR1	40	39
COCc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225369	FF	On-Demand	Anodyne	TSHR	63	35
COCc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225369	FF	On-Demand	Anodyne	SIGMAR1	29	41
COCc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC	ZINC000872225369	FF	On-Demand	Anodyne	NPFFR1	40	39
COCc1cc(NCC2(O)CCC(C(=O)OC(C)(C)C)CC2)ccc1OC	ZINC000872225372	GH	On-Demand	Anodyne	TSHR	52	31
COCc1cc(NCC2(O)CCC(C(=O)OC(C)(C)C)CC2)ccc1OC	ZINC000872225372	GH	On-Demand	Anodyne	QRFPR	40	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C(F)(F)F)[C@H](O)C1	ZINC000872225389	EC	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)C(F)(F)F)[C@@H](O)C1	ZINC000872225391	EC	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C(F)(F)F)[C@H](O)C1	ZINC000872225392	EC	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)C(F)(F)F)[C@@H](O)C1	ZINC000872225393	EC	On-Demand	Anodyne	GPR119	38	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)C3CC3)C2)cc1	ZINC000872225398	CD	On-Demand	Anodyne	DRD4	24	42
Cc1ccc(CN2CC[C@H](NC[C@@H](O)C3CC3)C2)cc1	ZINC000872225398	CD	On-Demand	Anodyne	SIGMAR1	21	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)C3CC3)C2)cc1	ZINC000872225401	CD	On-Demand	Anodyne	DRD4	24	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)C3CC3)C2)cc1	ZINC000872225401	CD	On-Demand	Anodyne	SIGMAR1	21	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)C3CC3)C2)cc1	ZINC000872225405	CD	On-Demand	Anodyne	DRD4	24	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)C3CC3)C2)cc1	ZINC000872225405	CD	On-Demand	Anodyne	SIGMAR1	21	42
COCc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000872225411	EH	On-Demand	Anodyne	ADRB3	17	43
COCc1cc(NC[C@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000872225417	EH	On-Demand	Anodyne	ADRB3	17	43
CCOC(=O)c1cc(CNC[C@H](O)c2ccccc2)on1	ZINC000872225462	CD	On-Demand	Anodyne	ADRB3	47	36
CCOC(=O)c1cc(CNC[C@@H](O)c2ccccc2)on1	ZINC000872225463	CD	On-Demand	Anodyne	ADRB3	47	36
COCc1cc(NC[C@H](O)C2CCCCC2)ccc1OC	ZINC000872225478	CG	On-Demand	Anodyne	QRFPR	47	39
COCc1cc(NC[C@@H](O)C2CCCCC2)ccc1OC	ZINC000872225480	CG	On-Demand	Anodyne	QRFPR	47	39
COCc1cc(NC[C@H](O)CN2C(=O)c3ccccc3C2=O)ccc1OC	ZINC000872225486	FD	On-Demand	Anodyne	TSHR	64	35
COCc1cc(NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)ccc1OC	ZINC000872225488	FD	On-Demand	Anodyne	TSHR	64	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)[C@@H](O)C1	ZINC000872225492	GE	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)[C@H](O)C1	ZINC000872225496	GE	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)[C@@H](O)C1	ZINC000872225500	GE	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)[C@H](O)C1	ZINC000872225504	GE	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COCC[C@H]2O)CC1	ZINC000872225506	EC	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COCC[C@H]2O)CC1	ZINC000872225507	EC	On-Demand	Anodyne	GPR119	35	42
CN(C[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C1CC1	ZINC000872225514	EC	On-Demand	Anodyne	GPR119	36	40
CN(C[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C1CC1	ZINC000872225515	EC	On-Demand	Anodyne	GPR119	36	40
CN(C[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C1CC1	ZINC000872225516	EC	On-Demand	Anodyne	GPR119	36	40
CN(C[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C1CC1	ZINC000872225517	EC	On-Demand	Anodyne	GPR119	36	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225538	FE	On-Demand	Anodyne	ADRB2	38	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225538	FE	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225538	FE	On-Demand	Anodyne	GRIN1	23	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225538	FE	On-Demand	Anodyne	ADRB3	45	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225539	FE	On-Demand	Anodyne	ADRB2	38	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225539	FE	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225539	FE	On-Demand	Anodyne	GRIN1	23	41
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872225539	FE	On-Demand	Anodyne	ADRB3	45	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)[C@H](O)C1	ZINC000872225541	FD	On-Demand	Anodyne	GPR119	44	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)[C@H](O)C1	ZINC000872225542	FD	On-Demand	Anodyne	GPR119	44	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)[C@@H](O)C1	ZINC000872225543	FD	On-Demand	Anodyne	GPR119	44	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)[C@@H](O)C1	ZINC000872225544	FD	On-Demand	Anodyne	GPR119	44	52
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225618	GD	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225618	GD	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225618	GD	On-Demand	Anodyne	ABCB1	36	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225618	GD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225619	GD	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225619	GD	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225619	GD	On-Demand	Anodyne	ABCB1	36	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225619	GD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225620	GD	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225620	GD	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225620	GD	On-Demand	Anodyne	ABCB1	36	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@@H](O)C1	ZINC000872225620	GD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225621	GD	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225621	GD	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225621	GD	On-Demand	Anodyne	ABCB1	36	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)[C@H](O)C1	ZINC000872225621	GD	On-Demand	Anodyne	GPR119	46	50
COCc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1OC	ZINC000872225622	GG	On-Demand	Anodyne	GPR119	48	46
COCc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1OC	ZINC000872225623	GG	On-Demand	Anodyne	GPR119	48	46
CC(C)(O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225630	CC	On-Demand	Anodyne	GPR119	40	42
CC(C)(O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225631	CC	On-Demand	Anodyne	GPR119	40	42
CC(C)(O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225632	CC	On-Demand	Anodyne	GPR119	40	42
CC(C)(O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225633	CC	On-Demand	Anodyne	GPR119	40	42
CCOC(=O)CC[C@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225634	EE	On-Demand	Anodyne	MPO	48	39
CCOC(=O)CC[C@@H](O)CNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225635	EE	On-Demand	Anodyne	MPO	48	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)[C@H](O)C1	ZINC000872225636	FD	On-Demand	Anodyne	SSTR2	49	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)[C@H](O)C1	ZINC000872225636	FD	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)[C@H](O)C1	ZINC000872225637	FD	On-Demand	Anodyne	SSTR2	49	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)[C@H](O)C1	ZINC000872225637	FD	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)[C@@H](O)C1	ZINC000872225638	FD	On-Demand	Anodyne	SSTR2	49	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)[C@@H](O)C1	ZINC000872225638	FD	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)[C@@H](O)C1	ZINC000872225639	FD	On-Demand	Anodyne	SSTR2	49	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)[C@@H](O)C1	ZINC000872225639	FD	On-Demand	Anodyne	GPR119	47	51
COCc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000872225643	CE	On-Demand	Anodyne	ADRB1	25	44
COCc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000872225643	CE	On-Demand	Anodyne	ADRB3	85	44
COCc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000872225644	CE	On-Demand	Anodyne	ADRB1	25	44
COCc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000872225644	CE	On-Demand	Anodyne	ADRB3	85	44
COCc1cc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1OC	ZINC000872225651	GF	On-Demand	Anodyne	ADRB1	20	42
COCc1cc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1OC	ZINC000872225651	GF	On-Demand	Anodyne	TSHR	40	30
COCc1cc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1OC	ZINC000872225652	GF	On-Demand	Anodyne	ADRB1	20	42
COCc1cc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1OC	ZINC000872225652	GF	On-Demand	Anodyne	TSHR	40	30
C#CCNC(=O)CCNCCc1c[nH]c2cc(F)c(C)cc12	ZINC000872225664	DD	On-Demand	Mild	MPO	76	44
C=CCOc1ccc(/C=C/C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1OC	ZINC000872225665	HI	On-Demand	Mild	PDGFRB	23	40
C=CCOc1ccc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1OC	ZINC000872225666	HI	On-Demand	Mild	PDGFRB	23	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)CC(C)(C)O)C2)cc1	ZINC000872225681	DD	On-Demand	Anodyne	DRD4	20	42
Cc1ccc(CN2CC[C@H](NC[C@@H](O)CC(C)(C)O)C2)cc1	ZINC000872225682	DD	On-Demand	Anodyne	DRD4	20	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)CC(C)(C)O)C2)cc1	ZINC000872225683	DD	On-Demand	Anodyne	DRD4	20	42
O=C(/C=C\c1ccccc1F)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225684	EH	On-Demand	Anodyne	AVPR2	40	39
O=C(/C=C\c1ccccc1F)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225684	EH	On-Demand	Anodyne	EPHX2	21	45
O=C(/C=C\c1ccccc1F)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225684	EH	On-Demand	Anodyne	L3MBTL3	65	36
COCc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000872225687	EG	On-Demand	Anodyne	TSHR	42	32
COCc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000872225687	EG	On-Demand	Anodyne	ENPP1	63	33
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225693	EE	On-Demand	Anodyne	SSTR5	43	38
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225693	EE	On-Demand	Anodyne	CCR3	26	40
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225693	EE	On-Demand	Anodyne	MLNR	49	36
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225694	EE	On-Demand	Anodyne	SSTR5	43	38
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225694	EE	On-Demand	Anodyne	CCR3	26	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225694	EE	On-Demand	Anodyne	MLNR	49	36
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225695	EE	On-Demand	Anodyne	SSTR5	43	38
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225695	EE	On-Demand	Anodyne	CCR3	26	40
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc1	ZINC000872225695	EE	On-Demand	Anodyne	MLNR	49	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2F)[C@H](O)C1	ZINC000872225705	GD	On-Demand	Anodyne	GPR119	36	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2F)[C@@H](O)C1	ZINC000872225706	GD	On-Demand	Anodyne	GPR119	36	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2F)[C@H](O)C1	ZINC000872225707	GD	On-Demand	Anodyne	GPR119	36	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2F)[C@@H](O)C1	ZINC000872225708	GD	On-Demand	Anodyne	GPR119	36	53
COCc1cc(NCC2(O)CCC2)ccc1OC	ZINC000872225716	CE	On-Demand	Anodyne	QRFPR	45	37
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225732	GD	On-Demand	Anodyne	CCR8	45	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225732	GD	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225732	GD	On-Demand	Anodyne	SFRP1	126	45
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225732	GD	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225733	GD	On-Demand	Anodyne	CCR8	45	42
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225733	GD	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225733	GD	On-Demand	Anodyne	SFRP1	126	45
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@@H](O)C1	ZINC000872225733	GD	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225734	GD	On-Demand	Anodyne	CCR8	45	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225734	GD	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225734	GD	On-Demand	Anodyne	SFRP1	126	45
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225734	GD	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225735	GD	On-Demand	Anodyne	CCR8	45	42
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225735	GD	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225735	GD	On-Demand	Anodyne	SFRP1	126	45
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@H](O)C1	ZINC000872225735	GD	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC2CN(c3ccncn3)C2)CC1	ZINC000872225748	GD	On-Demand	Anodyne	GPR119	33	55
CC(C)(C)OC(=O)N1CCC[C@](O)(CNC2CN(c3ccncn3)C2)CC1	ZINC000872225749	GD	On-Demand	Anodyne	GPR119	33	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225750	GG	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225750	GG	On-Demand	Anodyne	ADRB1	80	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225750	GG	On-Demand	Anodyne	HTR1D	24	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225750	GG	On-Demand	Anodyne	GRIN1	20	49
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225750	GG	On-Demand	Anodyne	ADRB3	55	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225751	GG	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225751	GG	On-Demand	Anodyne	ADRB1	80	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225751	GG	On-Demand	Anodyne	HTR1D	24	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225751	GG	On-Demand	Anodyne	GRIN1	20	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2c[nH]c3cc(F)c(C)cc23)cc1	ZINC000872225751	GG	On-Demand	Anodyne	ADRB3	55	54
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225760	IE	On-Demand	Anodyne	AVPR2	37	40
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872225761	IE	On-Demand	Anodyne	AVPR2	37	40
COCc1cc(NCCC(N)=O)ccc1OC	ZINC000872225762	BD	On-Demand	Anodyne	ENPP1	56	32
COCc1cc(NCCC(N)=O)ccc1OC	ZINC000872225762	BD	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	TSHR	74	37
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	CPT1A	47	32
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	HDAC10	18	41
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	MTNR1B	22	44
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	HDAC2	19	41
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	HDAC3	17	41
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	HDAC6	15	41
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	ENPP1	62	33
COCc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000872225763	DG	On-Demand	Anodyne	DRTS_TRYCR	45	32
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225772	GD	On-Demand	Anodyne	ADRB2	28	45
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225772	GD	On-Demand	Anodyne	ACOX1	42	30
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225772	GD	On-Demand	Anodyne	GPR119	46	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225773	GD	On-Demand	Anodyne	ADRB2	28	45
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225773	GD	On-Demand	Anodyne	ACOX1	42	30
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)cc1	ZINC000872225773	GD	On-Demand	Anodyne	GPR119	46	47
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225774	GD	On-Demand	Anodyne	ADRB2	28	45
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225774	GD	On-Demand	Anodyne	ACOX1	42	30
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225774	GD	On-Demand	Anodyne	GPR119	46	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225775	GD	On-Demand	Anodyne	ADRB2	28	45
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225775	GD	On-Demand	Anodyne	ACOX1	42	30
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1	ZINC000872225775	GD	On-Demand	Anodyne	GPR119	46	47
COCc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1OC	ZINC000872225779	FG	On-Demand	Anodyne	TSHR	41	31
COCc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1OC	ZINC000872225779	FG	On-Demand	Anodyne	ENPP1	50	31
COCc1cc(NC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000872225784	DH	On-Demand	Anodyne	ADRB2	18	42
COCc1cc(NC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000872225784	DH	On-Demand	Anodyne	QRFPR	21	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2)[C@@H](O)C1	ZINC000872225785	FD	On-Demand	Anodyne	CCR8	40	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2)[C@@H](O)C1	ZINC000872225785	FD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2)[C@@H](O)C1	ZINC000872225786	FD	On-Demand	Anodyne	CCR8	40	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2)[C@@H](O)C1	ZINC000872225786	FD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2)[C@H](O)C1	ZINC000872225787	FD	On-Demand	Anodyne	CCR8	40	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2)[C@H](O)C1	ZINC000872225787	FD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2)[C@H](O)C1	ZINC000872225788	FD	On-Demand	Anodyne	CCR8	40	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2)[C@H](O)C1	ZINC000872225788	FD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)[C@H](O)C1	ZINC000872225789	FD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)[C@H](O)C1	ZINC000872225790	FD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)[C@@H](O)C1	ZINC000872225791	FD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)[C@@H](O)C1	ZINC000872225792	FD	On-Demand	Anodyne	GPR119	46	50
COCc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000872225798	DG	On-Demand	Anodyne	ADRB2	19	43
COCc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000872225799	DG	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc1	ZINC000872225802	EG	On-Demand	Anodyne	DRD4	34	43
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc1	ZINC000872225802	EG	On-Demand	Anodyne	SIGMAR1	32	50
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc1	ZINC000872225802	EG	On-Demand	Anodyne	CCR3	26	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc1	ZINC000872225802	EG	On-Demand	Anodyne	MLNR	44	36
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc1	ZINC000872225802	EG	On-Demand	Anodyne	MCHR1	22	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc1	ZINC000872225803	EG	On-Demand	Anodyne	DRD4	34	43
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc1	ZINC000872225803	EG	On-Demand	Anodyne	SIGMAR1	32	50
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc1	ZINC000872225803	EG	On-Demand	Anodyne	CCR3	26	40
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc1	ZINC000872225803	EG	On-Demand	Anodyne	MLNR	44	36
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc1	ZINC000872225803	EG	On-Demand	Anodyne	MCHR1	22	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225806	GE	On-Demand	Anodyne	ADRB3	23	41
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225806	GE	On-Demand	Anodyne	CCR3	17	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225806	GE	On-Demand	Anodyne	CCR5	23	44
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225808	GE	On-Demand	Anodyne	ADRB3	23	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225808	GE	On-Demand	Anodyne	CCR3	17	40
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225808	GE	On-Demand	Anodyne	CCR5	23	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225809	GE	On-Demand	Anodyne	ADRB3	23	41
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225809	GE	On-Demand	Anodyne	CCR3	17	40
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000872225809	GE	On-Demand	Anodyne	CCR5	23	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225815	CB	On-Demand	Anodyne	ADRB2	56	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225815	CB	On-Demand	Anodyne	ADRB1	84	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225815	CB	On-Demand	Anodyne	ADRB3	51	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225815	CB	On-Demand	Anodyne	ABCB1	23	61
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225816	CB	On-Demand	Anodyne	ADRB2	56	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225816	CB	On-Demand	Anodyne	ADRB1	84	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225816	CB	On-Demand	Anodyne	ADRB3	51	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225816	CB	On-Demand	Anodyne	ABCB1	23	61
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225817	CB	On-Demand	Anodyne	ADRB2	56	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225817	CB	On-Demand	Anodyne	ADRB1	84	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225817	CB	On-Demand	Anodyne	ADRB3	51	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225817	CB	On-Demand	Anodyne	ABCB1	23	61
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225818	CB	On-Demand	Anodyne	ADRB2	56	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225818	CB	On-Demand	Anodyne	ADRB1	84	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225818	CB	On-Demand	Anodyne	ADRB3	51	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225818	CB	On-Demand	Anodyne	ABCB1	23	61
COCc1cc(NCCC(=O)Nc2ccc(N3CCCC3=O)cc2)ccc1OC	ZINC000872225819	GG	On-Demand	Anodyne	TSHR	40	31
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225820	CC	On-Demand	Anodyne	ADRB2	58	57
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225820	CC	On-Demand	Anodyne	ADRB1	73	51
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)cc1	ZINC000872225820	CC	On-Demand	Anodyne	ADRB3	45	50
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225821	CC	On-Demand	Anodyne	ADRB2	58	57
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225821	CC	On-Demand	Anodyne	ADRB1	73	51
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)cc1	ZINC000872225821	CC	On-Demand	Anodyne	ADRB3	45	50
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225822	CC	On-Demand	Anodyne	ADRB2	58	57
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225822	CC	On-Demand	Anodyne	ADRB1	73	51
CCOc1ccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)cc1	ZINC000872225822	CC	On-Demand	Anodyne	ADRB3	45	50
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225823	CC	On-Demand	Anodyne	ADRB2	58	57
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225823	CC	On-Demand	Anodyne	ADRB1	73	51
CCOc1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)cc1	ZINC000872225823	CC	On-Demand	Anodyne	ADRB3	45	50
COCc1cc(NC[C@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000872225830	FF	On-Demand	Anodyne	NOD2	40	37
COCc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000872225831	FF	On-Demand	Anodyne	NOD2	40	37
COCc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000872225832	DF	On-Demand	Anodyne	ENPP1	61	39
O[C@H](CNC1CN(c2ccncn2)C1)c1cccnc1	ZINC000872225837	CC	On-Demand	Anodyne	ADRB3	64	45
O[C@@H](CNC1CN(c2ccncn2)C1)c1cccnc1	ZINC000872225838	CC	On-Demand	Anodyne	ADRB3	64	45
COCc1cc(NC[C@@H](O)C2CC2)ccc1OC	ZINC000872225855	CE	On-Demand	Anodyne	QRFPR	44	37
COCc1cc(NC[C@H](O)C2CC2)ccc1OC	ZINC000872225856	CE	On-Demand	Anodyne	QRFPR	44	37
COCc1cc(N[C@@H]2CCCC[C@H]2O)ccc1OC	ZINC000872225862	CF	On-Demand	Anodyne	QRFPR	50	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CN(c3ccncn3)C2)cc1	ZINC000872225863	EC	On-Demand	Anodyne	ADRB3	16	46
CS(=O)(=O)c1ccc([C@H](O)CNC2CN(c3ccncn3)C2)cc1	ZINC000872225864	EC	On-Demand	Anodyne	ADRB3	16	46
COCc1cc(NC[C@H](O)COc2ccccc2)ccc1OC	ZINC000872225887	DF	On-Demand	Anodyne	ADRB2	56	47
COCc1cc(NC[C@H](O)COc2ccccc2)ccc1OC	ZINC000872225887	DF	On-Demand	Anodyne	ADRB1	67	44
COCc1cc(NC[C@H](O)COc2ccccc2)ccc1OC	ZINC000872225887	DF	On-Demand	Anodyne	TSHR	58	35
COCc1cc(NC[C@H](O)COc2ccccc2)ccc1OC	ZINC000872225887	DF	On-Demand	Anodyne	ADRB3	45	44
COCc1cc(NC[C@H](O)COc2ccccc2)ccc1OC	ZINC000872225887	DF	On-Demand	Anodyne	CYP2D6	20	42
COCc1cc(NC[C@@H](O)COc2ccccc2)ccc1OC	ZINC000872225888	DF	On-Demand	Anodyne	ADRB2	56	47
COCc1cc(NC[C@@H](O)COc2ccccc2)ccc1OC	ZINC000872225888	DF	On-Demand	Anodyne	ADRB1	67	44
COCc1cc(NC[C@@H](O)COc2ccccc2)ccc1OC	ZINC000872225888	DF	On-Demand	Anodyne	TSHR	58	35
COCc1cc(NC[C@@H](O)COc2ccccc2)ccc1OC	ZINC000872225888	DF	On-Demand	Anodyne	ADRB3	45	44
COCc1cc(NC[C@@H](O)COc2ccccc2)ccc1OC	ZINC000872225888	DF	On-Demand	Anodyne	CYP2D6	20	42
COCc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225894	DH	On-Demand	Anodyne	ADRB2	31	49
COCc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225894	DH	On-Demand	Anodyne	ADRB1	36	50
COCc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225894	DH	On-Demand	Anodyne	ADRB3	54	50
COCc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225894	DH	On-Demand	Anodyne	CYP3A4	45	35
COCc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225895	DH	On-Demand	Anodyne	ADRB2	31	49
COCc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225895	DH	On-Demand	Anodyne	ADRB1	36	50
COCc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225895	DH	On-Demand	Anodyne	ADRB3	54	50
COCc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000872225895	DH	On-Demand	Anodyne	CYP3A4	45	35
COc1ccccc1COC[C@H](O)CNC[C@H](O)[C@@H](C)O	ZINC000872225898	CB	On-Demand	Anodyne	ADRB2	25	44
COc1ccccc1COC[C@H](O)CNC[C@@H](O)[C@H](C)O	ZINC000872225899	CB	On-Demand	Anodyne	ADRB2	25	44
COc1ccccc1COC[C@H](O)CNC[C@@H](O)[C@@H](C)O	ZINC000872225900	CB	On-Demand	Anodyne	ADRB2	25	44
COc1ccccc1COC[C@H](O)CNC[C@H](O)[C@H](C)O	ZINC000872225901	CB	On-Demand	Anodyne	ADRB2	25	44
COCc1cc(NCCC(=O)N(C)c2ccccc2)ccc1OC	ZINC000872225906	EG	On-Demand	Anodyne	TSHR	54	33
COCc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225918	FF	On-Demand	Mild	ADRB2	33	40
COCc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225918	FF	On-Demand	Mild	ADRB1	50	42
COCc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225918	FF	On-Demand	Mild	ADRB3	32	42
COCc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225919	FF	On-Demand	Mild	ADRB2	33	40
COCc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225919	FF	On-Demand	Mild	ADRB1	50	42
COCc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1OC	ZINC000872225919	FF	On-Demand	Mild	ADRB3	32	42
COCc1cc(NCC2(O)CCCC2)ccc1OC	ZINC000872225920	CF	On-Demand	Anodyne	QRFPR	42	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccn2)[C@@H](O)C1	ZINC000872225926	ED	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccn2)[C@@H](O)C1	ZINC000872225926	ED	On-Demand	Anodyne	SCD	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccn2)[C@H](O)C1	ZINC000872225927	ED	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccn2)[C@H](O)C1	ZINC000872225927	ED	On-Demand	Anodyne	SCD	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccn2)[C@H](O)C1	ZINC000872225928	ED	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccccn2)[C@H](O)C1	ZINC000872225928	ED	On-Demand	Anodyne	SCD	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccn2)[C@@H](O)C1	ZINC000872225929	ED	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccccn2)[C@@H](O)C1	ZINC000872225929	ED	On-Demand	Anodyne	SCD	17	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)[C@@H](O)C1	ZINC000872225935	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)[C@@H](O)C1	ZINC000872225936	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)[C@H](O)C1	ZINC000872225937	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)[C@H](O)C1	ZINC000872225938	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)[C@H](O)C1	ZINC000872225954	GE	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)[C@H](O)C1	ZINC000872225955	GE	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)[C@@H](O)C1	ZINC000872225956	GE	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)[C@@H](O)C1	ZINC000872225957	GE	On-Demand	Anodyne	GPR119	40	46
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	DRD4	23	46
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	SLC6A3	31	49
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	SIGMAR1	28	48
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	CCR3	40	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	MLNR	57	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225967	EG	On-Demand	Anodyne	MCHR1	19	50
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	DRD4	23	46
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	SLC6A3	31	49
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	SIGMAR1	28	48
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	CCR3	40	44
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	MLNR	57	44
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225968	EG	On-Demand	Anodyne	MCHR1	19	50
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	DRD4	23	46
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	SLC6A3	31	49
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	SIGMAR1	28	48
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	CCR3	40	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	MLNR	57	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000872225969	EG	On-Demand	Anodyne	MCHR1	19	50
COC[C@@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225972	DB	On-Demand	Anodyne	GPR119	35	41
COC[C@@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225973	DB	On-Demand	Anodyne	GPR119	35	41
COC[C@@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225974	DB	On-Demand	Anodyne	GPR119	35	41
COC[C@@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225975	DB	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(C)(=O)=O)[C@H](O)C1	ZINC000872225978	DB	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(C)(=O)=O)[C@@H](O)C1	ZINC000872225979	DB	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(C)(=O)=O)[C@@H](O)C1	ZINC000872225980	DB	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(C)(=O)=O)[C@H](O)C1	ZINC000872225981	DB	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225982	GD	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225982	GD	On-Demand	Anodyne	ADRB3	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225982	GD	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225983	GD	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225983	GD	On-Demand	Anodyne	ADRB3	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@H](O)C1	ZINC000872225983	GD	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225984	GD	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225984	GD	On-Demand	Anodyne	ADRB3	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225984	GD	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225985	GD	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225985	GD	On-Demand	Anodyne	ADRB3	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)[C@@H](O)C1	ZINC000872225985	GD	On-Demand	Anodyne	GPR119	48	44
CCOC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225990	DC	On-Demand	Anodyne	GPR119	30	41
CCOC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225991	DC	On-Demand	Anodyne	GPR119	30	41
CCOC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872225992	DC	On-Demand	Anodyne	GPR119	30	41
CCOC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872225993	DC	On-Demand	Anodyne	GPR119	30	41
COCc1cc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226001	FF	On-Demand	Anodyne	ADRB2	34	43
COCc1cc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226001	FF	On-Demand	Anodyne	ADRB1	56	43
COCc1cc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226001	FF	On-Demand	Anodyne	TSHR	57	35
COCc1cc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226001	FF	On-Demand	Anodyne	ADRB3	32	43
COCc1cc(NC[C@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226002	FF	On-Demand	Anodyne	ADRB2	34	43
COCc1cc(NC[C@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226002	FF	On-Demand	Anodyne	ADRB1	56	43
COCc1cc(NC[C@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226002	FF	On-Demand	Anodyne	TSHR	57	35
COCc1cc(NC[C@H](O)COc2ccc(C(C)=O)cc2)ccc1OC	ZINC000872226002	FF	On-Demand	Anodyne	ADRB3	32	43
COCc1cc(NC[C@@H](O)COCc2ccccc2)ccc1OC	ZINC000872226003	EF	On-Demand	Anodyne	TSHR	42	33
COCc1cc(NC[C@H](O)COCc2ccccc2)ccc1OC	ZINC000872226004	EF	On-Demand	Anodyne	TSHR	42	33
COCc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226013	FF	On-Demand	Anodyne	ADRB2	31	42
COCc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226013	FF	On-Demand	Anodyne	ADRB1	48	37
COCc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226013	FF	On-Demand	Anodyne	TSHR	54	32
COCc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226013	FF	On-Demand	Anodyne	ABCB1	15	41
COCc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226014	FF	On-Demand	Anodyne	ADRB2	31	42
COCc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226014	FF	On-Demand	Anodyne	ADRB1	48	37
COCc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226014	FF	On-Demand	Anodyne	TSHR	54	32
COCc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)ccc1OC	ZINC000872226014	FF	On-Demand	Anodyne	ABCB1	15	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)[C@@H](O)C1	ZINC000872226015	GE	On-Demand	Anodyne	CCR3	32	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)[C@@H](O)C1	ZINC000872226015	GE	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)[C@@H](O)C1	ZINC000872226016	GE	On-Demand	Anodyne	CCR3	32	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)[C@@H](O)C1	ZINC000872226016	GE	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)[C@H](O)C1	ZINC000872226017	GE	On-Demand	Anodyne	CCR3	32	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)[C@H](O)C1	ZINC000872226017	GE	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)[C@H](O)C1	ZINC000872226018	GE	On-Demand	Anodyne	CCR3	32	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)[C@H](O)C1	ZINC000872226018	GE	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	ACE	42	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	PGC	41	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	CTSK	16	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	MMP3	21	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	REN	48	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226023	FD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	ACE	42	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	PGC	41	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	CTSK	16	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	MMP3	21	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	REN	48	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226024	FD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	ACE	42	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	PGC	41	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	CTSK	16	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	MMP3	21	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	REN	48	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)[C@H](O)C1	ZINC000872226025	FD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	ACE	42	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	PGC	41	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	CTSK	16	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	MMP3	21	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	REN	48	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)[C@@H](O)C1	ZINC000872226026	FD	On-Demand	Anodyne	GPR119	40	45
COCc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226027	FG	On-Demand	Anodyne	ADRB2	21	58
COCc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226027	FG	On-Demand	Anodyne	ADRB1	30	58
COCc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226027	FG	On-Demand	Anodyne	CYP2D6	19	43
COCc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226028	FG	On-Demand	Anodyne	ADRB2	21	58
COCc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226028	FG	On-Demand	Anodyne	ADRB1	30	58
COCc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1OC	ZINC000872226028	FG	On-Demand	Anodyne	CYP2D6	19	43
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872226031	GE	On-Demand	Anodyne	GPR119	45	45
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000872226032	GE	On-Demand	Anodyne	GPR119	45	45
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872226033	GE	On-Demand	Anodyne	GPR119	45	45
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000872226034	GE	On-Demand	Anodyne	GPR119	45	45
COCc1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226035	EF	On-Demand	Anodyne	ADRB2	40	39
COCc1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226035	EF	On-Demand	Anodyne	ADRB1	57	43
COCc1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226035	EF	On-Demand	Anodyne	TSHR	53	31
COCc1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226035	EF	On-Demand	Anodyne	ADRB3	34	43
COCc1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226036	EF	On-Demand	Anodyne	ADRB2	40	39
COCc1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226036	EF	On-Demand	Anodyne	ADRB1	57	43
COCc1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226036	EF	On-Demand	Anodyne	TSHR	53	31
COCc1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1OC	ZINC000872226036	EF	On-Demand	Anodyne	ADRB3	34	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)[C@H](O)C1	ZINC000872226046	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)[C@H](O)C1	ZINC000872226047	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)[C@@H](O)C1	ZINC000872226048	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)[C@@H](O)C1	ZINC000872226049	FD	On-Demand	Anodyne	GPR119	48	46
COCc1cc(NCCC(=O)Nc2ccccc2F)ccc1OC	ZINC000872226051	EG	On-Demand	Anodyne	TSHR	55	34
COCc1cc(NC[C@H](O)COc2cccc(C)c2)ccc1OC	ZINC000872226061	EG	On-Demand	Anodyne	ADRB2	33	53
COCc1cc(NC[C@H](O)COc2cccc(C)c2)ccc1OC	ZINC000872226061	EG	On-Demand	Anodyne	ADRB1	38	53
COCc1cc(NC[C@@H](O)COc2cccc(C)c2)ccc1OC	ZINC000872226062	EG	On-Demand	Anodyne	ADRB2	33	53
COCc1cc(NC[C@@H](O)COc2cccc(C)c2)ccc1OC	ZINC000872226062	EG	On-Demand	Anodyne	ADRB1	38	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CC2CCCC2)[C@H](O)C1	ZINC000872226065	ED	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CC2CCCC2)[C@@H](O)C1	ZINC000872226066	ED	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CC2CCCC2)[C@H](O)C1	ZINC000872226067	ED	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CC2CCCC2)[C@@H](O)C1	ZINC000872226068	ED	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)[C@H](O)C1	ZINC000872226075	FD	On-Demand	Anodyne	SLC6A3	23	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)[C@H](O)C1	ZINC000872226075	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)[C@H](O)C1	ZINC000872226076	FD	On-Demand	Anodyne	SLC6A3	23	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)[C@H](O)C1	ZINC000872226076	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)[C@@H](O)C1	ZINC000872226077	FD	On-Demand	Anodyne	SLC6A3	23	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)[C@@H](O)C1	ZINC000872226077	FD	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)[C@@H](O)C1	ZINC000872226078	FD	On-Demand	Anodyne	SLC6A3	23	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)[C@@H](O)C1	ZINC000872226078	FD	On-Demand	Anodyne	GPR119	48	46
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	DRD4	30	44
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	SIGMAR1	24	40
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	SSTR5	51	38
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	UTS2R	20	42
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	MLNR	47	34
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226095	DD	On-Demand	Anodyne	MCHR1	41	42
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	DRD4	30	44
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	SIGMAR1	24	40
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	SSTR5	51	38
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	UTS2R	20	42
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	MLNR	47	34
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000872226096	DD	On-Demand	Anodyne	MCHR1	41	42
C/C=C\c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c(OC)c1	ZINC000872226097	EC	On-Demand	Anodyne	ADRB2	25	73
C/C=C\c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c(OC)c1	ZINC000872226098	EC	On-Demand	Anodyne	ADRB2	25	73
C/C=C/c1ccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c(OC)c1	ZINC000872226099	EC	On-Demand	Anodyne	ADRB2	25	73
C/C=C/c1ccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c(OC)c1	ZINC000872226100	EC	On-Demand	Anodyne	ADRB2	25	73
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccn3)C2)cc1	ZINC000872226108	DE	On-Demand	Anodyne	DRD4	31	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccn3)C2)cc1	ZINC000872226108	DE	On-Demand	Anodyne	SIGMAR1	21	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccn3)C2)cc1	ZINC000872226108	DE	On-Demand	Anodyne	SSTR5	54	35
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccn3)C2)cc1	ZINC000872226108	DE	On-Demand	Anodyne	MCHR1	17	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccn3)C2)cc1	ZINC000872226109	DE	On-Demand	Anodyne	DRD4	31	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccn3)C2)cc1	ZINC000872226109	DE	On-Demand	Anodyne	SIGMAR1	21	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccn3)C2)cc1	ZINC000872226109	DE	On-Demand	Anodyne	SSTR5	54	35
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccn3)C2)cc1	ZINC000872226109	DE	On-Demand	Anodyne	MCHR1	17	40
COCc1cc(NCCS(=O)(=O)c2ccccc2)ccc1OC	ZINC000872226118	EF	On-Demand	Anodyne	TSHR	62	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	GHRHR	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	CACNA1B	44	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	REN	73	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	GHSR	16	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226128	FD	On-Demand	Anodyne	SFRP1	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	GHRHR	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	CACNA1B	44	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	REN	73	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	GHSR	16	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226129	FD	On-Demand	Anodyne	SFRP1	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	GHRHR	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	CACNA1B	44	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	REN	73	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	GHSR	16	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@@H](O)C1	ZINC000872226130	FD	On-Demand	Anodyne	SFRP1	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	GHRHR	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	CACNA1B	44	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	REN	73	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	GHSR	16	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)[C@H](O)C1	ZINC000872226131	FD	On-Demand	Anodyne	SFRP1	22	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc1	ZINC000872226132	DE	On-Demand	Anodyne	ADRB1	25	42
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc1	ZINC000872226132	DE	On-Demand	Anodyne	ADRB3	91	49
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc1	ZINC000872226135	DE	On-Demand	Anodyne	ADRB1	25	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc1	ZINC000872226135	DE	On-Demand	Anodyne	ADRB3	91	49
Cc1cc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c(C(C)C)cc1Cl	ZINC000872226138	ED	On-Demand	Anodyne	ADRB2	20	46
Cc1cc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c(C(C)C)cc1Cl	ZINC000872226139	ED	On-Demand	Anodyne	ADRB2	20	46
Cc1cc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c(C(C)C)cc1Cl	ZINC000872226140	ED	On-Demand	Anodyne	ADRB2	20	46
Cc1cc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c(C(C)C)cc1Cl	ZINC000872226141	ED	On-Demand	Anodyne	ADRB2	20	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c1	ZINC000872226143	CB	On-Demand	Anodyne	ADRB2	52	52
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c1	ZINC000872226143	CB	On-Demand	Anodyne	ADRB1	77	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c1	ZINC000872226143	CB	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c1	ZINC000872226143	CB	On-Demand	Anodyne	ABCB1	31	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@@H](C)O)c1	ZINC000872226143	CB	On-Demand	Anodyne	PDS	59	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c1	ZINC000872226145	CB	On-Demand	Anodyne	ADRB2	52	52
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c1	ZINC000872226145	CB	On-Demand	Anodyne	ADRB1	77	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c1	ZINC000872226145	CB	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c1	ZINC000872226145	CB	On-Demand	Anodyne	ABCB1	31	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)[C@H](C)O)c1	ZINC000872226145	CB	On-Demand	Anodyne	PDS	59	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c1	ZINC000872226147	CB	On-Demand	Anodyne	ADRB2	52	52
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c1	ZINC000872226147	CB	On-Demand	Anodyne	ADRB1	77	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c1	ZINC000872226147	CB	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c1	ZINC000872226147	CB	On-Demand	Anodyne	ABCB1	31	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@H](C)O)c1	ZINC000872226147	CB	On-Demand	Anodyne	PDS	59	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c1	ZINC000872226149	CB	On-Demand	Anodyne	ADRB2	52	52
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c1	ZINC000872226149	CB	On-Demand	Anodyne	ADRB1	77	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c1	ZINC000872226149	CB	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c1	ZINC000872226149	CB	On-Demand	Anodyne	ABCB1	31	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)[C@@H](C)O)c1	ZINC000872226149	CB	On-Demand	Anodyne	PDS	59	38
COCc1cc(NC[C@@H](O)Cc2ccccc2)ccc1OC	ZINC000872226170	DF	On-Demand	Anodyne	TSHR	55	34
COCc1cc(NC[C@H](O)Cc2ccccc2)ccc1OC	ZINC000872226171	DF	On-Demand	Anodyne	TSHR	55	34
Cc1ccc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226176	CD	On-Demand	Anodyne	DRD4	31	49
Cc1ccc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226176	CD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226176	CD	On-Demand	Anodyne	CCR3	20	43
Cc1ccc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226176	CD	On-Demand	Anodyne	MCHR1	22	42
Cc1ccc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226177	CD	On-Demand	Anodyne	DRD4	31	49
Cc1ccc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226177	CD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226177	CD	On-Demand	Anodyne	CCR3	20	43
Cc1ccc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc1	ZINC000872226177	CD	On-Demand	Anodyne	MCHR1	22	42
O=C(/C=C/c1cc(Br)ccc1F)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872226188	HI	On-Demand	Anodyne	L3MBTL3	47	33
O=C(/C=C\c1cc(Br)ccc1F)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872226189	HI	On-Demand	Anodyne	L3MBTL3	47	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)[C@H](O)C1	ZINC000872226190	GE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@H](O)C1	ZINC000872226191	GE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@@H](O)C1	ZINC000872226192	GE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)[C@@H](O)C1	ZINC000872226193	GE	On-Demand	Anodyne	GPR119	45	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226293	FF	On-Demand	Anodyne	ADRB1	47	38
CC(=O)c1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226294	FF	On-Demand	Anodyne	ADRB1	47	38
CCC(CC)(CNC[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000872226299	CH	On-Demand	Anodyne	AOC3	15	45
CCC(CC)(CNC[C@H](O)c1ccccc1)C(F)(F)F	ZINC000872226300	CH	On-Demand	Anodyne	AOC3	15	45
CCC(CC)(CNC[C@@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226309	DG	On-Demand	Anodyne	ADRB2	62	58
CCC(CC)(CNC[C@@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226309	DG	On-Demand	Anodyne	ADRB1	77	46
CCC(CC)(CNC[C@@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226309	DG	On-Demand	Anodyne	ADRB3	46	46
CCC(CC)(CNC[C@@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226309	DG	On-Demand	Anodyne	PDS	48	35
CCC(CC)(CNC[C@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226310	DG	On-Demand	Anodyne	ADRB2	62	58
CCC(CC)(CNC[C@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226310	DG	On-Demand	Anodyne	ADRB1	77	46
CCC(CC)(CNC[C@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226310	DG	On-Demand	Anodyne	ADRB3	46	46
CCC(CC)(CNC[C@H](O)COc1ccccc1)C(F)(F)F	ZINC000872226310	DG	On-Demand	Anodyne	PDS	48	35
CC[C@@H](NC[C@H](O)COC(C)C)c1cccc(OC)c1OC	ZINC000872226313	DF	On-Demand	Anodyne	ADRB2	23	42
CC[C@@H](NC[C@@H](O)COC(C)C)c1cccc(OC)c1OC	ZINC000872226315	DF	On-Demand	Anodyne	ADRB2	23	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226341	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226341	GG	On-Demand	Anodyne	ADRB1	64	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226341	GG	On-Demand	Anodyne	GRIN1	21	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226341	GG	On-Demand	Anodyne	ADRB3	44	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226342	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226342	GG	On-Demand	Anodyne	ADRB1	64	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226342	GG	On-Demand	Anodyne	GRIN1	21	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226342	GG	On-Demand	Anodyne	ADRB3	44	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc3ccc(F)cc23)CC1	ZINC000872226375	GG	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc3ccc(F)cc23)CC1	ZINC000872226376	GG	On-Demand	Anodyne	GPR119	53	51
CCC(CC)(CNC[C@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226422	EG	On-Demand	Mild	ADRB2	26	62
CCC(CC)(CNC[C@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226422	EG	On-Demand	Mild	ADRB1	78	52
CCC(CC)(CNC[C@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226422	EG	On-Demand	Mild	CASR	47	49
CCC(CC)(CNC[C@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226422	EG	On-Demand	Mild	CYP2D6	22	50
CCC(CC)(CNC[C@@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226423	EG	On-Demand	Mild	ADRB2	26	62
CCC(CC)(CNC[C@@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226423	EG	On-Demand	Mild	ADRB1	78	52
CCC(CC)(CNC[C@@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226423	EG	On-Demand	Mild	CASR	47	49
CCC(CC)(CNC[C@@H](O)COc1ccccc1C#N)C(F)(F)F	ZINC000872226423	EG	On-Demand	Mild	CYP2D6	22	50
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226429	FG	On-Demand	Mild	ADRB2	26	60
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226429	FG	On-Demand	Mild	ADRB1	69	46
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226429	FG	On-Demand	Mild	CASR	43	44
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226429	FG	On-Demand	Mild	CYP2D6	22	49
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226430	FG	On-Demand	Mild	ADRB2	26	60
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226430	FG	On-Demand	Mild	ADRB1	69	46
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226430	FG	On-Demand	Mild	CASR	43	44
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cccc(OC)c1OC	ZINC000872226430	FG	On-Demand	Mild	CYP2D6	22	49
CC(C)(C)OC(=O)CN1CCCC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000872226460	FD	On-Demand	Anodyne	ADRB3	52	43
CC(C)(C)OC(=O)CN1CCCC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000872226461	FD	On-Demand	Anodyne	ADRB3	52	43
CC(C)(C)OC(=O)CN1CCCC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000872226462	FD	On-Demand	Anodyne	ADRB3	52	43
CC(C)(C)OC(=O)CN1CCCC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000872226463	FD	On-Demand	Anodyne	ADRB3	52	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000872226494	IH	On-Demand	Anodyne	AVPR2	60	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000872226494	IH	On-Demand	Anodyne	AVPR1A	33	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000872226494	IH	On-Demand	Anodyne	LPL	41	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000872226494	IH	On-Demand	Anodyne	L3MBTL3	46	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000872226494	IH	On-Demand	Anodyne	NAMPT	35	42
CCC(CC)(CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)C(F)(F)F	ZINC000872226521	GG	On-Demand	Anodyne	ADRB1	20	40
CCC(CC)(CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)C(F)(F)F	ZINC000872226522	GG	On-Demand	Anodyne	ADRB1	20	40
N#CCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226529	FF	On-Demand	Mild	ADRB1	40	39
N#CCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226530	FF	On-Demand	Mild	ADRB1	40	39
CC[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1cccc(OC)c1OC	ZINC000872226536	FG	On-Demand	Mild	ADRB2	29	42
CC[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1cccc(OC)c1OC	ZINC000872226536	FG	On-Demand	Mild	ADRB1	45	36
CC[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1cccc(OC)c1OC	ZINC000872226537	FG	On-Demand	Mild	ADRB2	29	42
CC[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1cccc(OC)c1OC	ZINC000872226537	FG	On-Demand	Mild	ADRB1	45	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	ZINC000872226554	JF	On-Demand	Anodyne	L3MBTL3	69	35
COCCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226602	FF	On-Demand	Anodyne	ADRB2	36	50
COCCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226602	FF	On-Demand	Anodyne	ADRB1	59	50
COCCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226602	FF	On-Demand	Anodyne	GRIN1	15	43
COCCc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226602	FF	On-Demand	Anodyne	ADRB3	40	44
COCCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226603	FF	On-Demand	Anodyne	ADRB2	36	50
COCCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226603	FF	On-Demand	Anodyne	ADRB1	59	50
COCCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226603	FF	On-Demand	Anodyne	GRIN1	15	43
COCCc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226603	FF	On-Demand	Anodyne	ADRB3	40	44
CCC(CC)(CNC[C@@H](O)COc1ccccc1F)C(F)(F)F	ZINC000872226612	EH	On-Demand	Anodyne	ADRB2	34	48
CCC(CC)(CNC[C@@H](O)COc1ccccc1F)C(F)(F)F	ZINC000872226612	EH	On-Demand	Anodyne	ADRB1	59	39
CCC(CC)(CNC[C@H](O)COc1ccccc1F)C(F)(F)F	ZINC000872226613	EH	On-Demand	Anodyne	ADRB2	34	48
CCC(CC)(CNC[C@H](O)COc1ccccc1F)C(F)(F)F	ZINC000872226613	EH	On-Demand	Anodyne	ADRB1	59	39
CC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1OC	ZINC000872226621	FG	On-Demand	Bother	CACNA1D	42	32
CC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1OC	ZINC000872226623	FG	On-Demand	Bother	CACNA1D	42	32
CCC(CC)(CNC[C@H](O)COc1ccc(C#N)cc1)C(F)(F)F	ZINC000872226633	EG	On-Demand	Mild	ADRB2	36	42
CCC(CC)(CNC[C@H](O)COc1ccc(C#N)cc1)C(F)(F)F	ZINC000872226633	EG	On-Demand	Mild	ADRB1	48	42
CCC(CC)(CNC[C@@H](O)COc1ccc(C#N)cc1)C(F)(F)F	ZINC000872226634	EG	On-Demand	Mild	ADRB2	36	42
CCC(CC)(CNC[C@@H](O)COc1ccc(C#N)cc1)C(F)(F)F	ZINC000872226634	EG	On-Demand	Mild	ADRB1	48	42
Cc1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226703	EF	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226704	EF	On-Demand	Anodyne	ADRB2	32	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	ZINC000872226799	JG	On-Demand	Anodyne	CPT1A	41	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	ZINC000872226799	JG	On-Demand	Anodyne	L3MBTL3	52	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	ZINC000872226800	JG	On-Demand	Anodyne	CPT1A	41	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	ZINC000872226800	JG	On-Demand	Anodyne	L3MBTL3	52	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)c1	ZINC000872226810	FF	On-Demand	Anodyne	ADRB1	49	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)c1	ZINC000872226810	FF	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)c1	ZINC000872226811	FF	On-Demand	Anodyne	ADRB1	49	36
CC(=O)c1cccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)c1	ZINC000872226811	FF	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872226828	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872226828	FE	On-Demand	Anodyne	ADRB1	41	38
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872226829	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872226829	FE	On-Demand	Anodyne	ADRB1	41	38
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	ADRB2	42	41
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	ADRB1	56	40
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	GRIN1	29	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	ADRB3	45	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	ACOX1	52	33
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	CCR3	20	48
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226839	EE	On-Demand	Anodyne	PDS	23	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	ADRB2	42	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	ADRB1	56	40
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	GRIN1	29	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	ADRB3	45	44
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	ACOX1	52	33
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	CCR3	20	48
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872226841	EE	On-Demand	Anodyne	PDS	23	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872226858	GD	On-Demand	Anodyne	ADRB2	41	53
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872226858	GD	On-Demand	Anodyne	ADRB1	40	53
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872226858	GD	On-Demand	Anodyne	ADRB3	30	47
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000872226858	GD	On-Demand	Anodyne	ABCB1	55	43
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872226860	GD	On-Demand	Anodyne	ADRB2	41	53
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872226860	GD	On-Demand	Anodyne	ADRB1	40	53
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872226860	GD	On-Demand	Anodyne	ADRB3	30	47
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872226860	GD	On-Demand	Anodyne	ABCB1	55	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000872226862	FE	On-Demand	Anodyne	CCR3	44	37
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000872226865	FE	On-Demand	Anodyne	CCR3	44	37
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	CHRM2	15	42
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	P2RY12	45	41
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	NPY2R	27	44
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	EPHX2	50	51
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	ACR	40	33
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	TGM2	28	42
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	F13A1	47	42
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	CCR8	29	41
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	PTR1	52	40
CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872226867	FF	On-Demand	Anodyne	L3MBTL3	103	44
CC(C)(C)OC(=O)CN1CCC(NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000872226869	GF	On-Demand	Anodyne	DRD4	17	49
CC(C)(C)OC(=O)CN1CCC(NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000872226869	GF	On-Demand	Anodyne	CCR3	51	39
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226876	FE	On-Demand	Anodyne	ADRB2	32	40
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226876	FE	On-Demand	Anodyne	ADRB1	53	40
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226876	FE	On-Demand	Anodyne	ADRB3	32	40
COC(=O)C1CC(NCCC(=O)Nc2cccc(F)c2)C1	ZINC000872226877	CD	On-Demand	Anodyne	FUCA1	16	46
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226879	FE	On-Demand	Anodyne	ADRB2	32	40
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226879	FE	On-Demand	Anodyne	ADRB1	53	40
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3ccc(F)cc23)cc1	ZINC000872226879	FE	On-Demand	Anodyne	ADRB3	32	40
COc1ccc(OC)c([C@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)c1	ZINC000872226902	GE	On-Demand	Anodyne	ADRB3	18	40
COC(=O)C1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226922	DD	On-Demand	Mild	ADRB2	49	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226922	DD	On-Demand	Mild	ADRB1	72	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226922	DD	On-Demand	Mild	ADRB3	49	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226923	DD	On-Demand	Mild	ADRB2	49	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226923	DD	On-Demand	Mild	ADRB1	72	44
COC(=O)C1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872226923	DD	On-Demand	Mild	ADRB3	49	42
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000872226925	FE	On-Demand	Anodyne	ADRB1	15	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000872226925	FE	On-Demand	Anodyne	ACE	41	37
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000872226925	FE	On-Demand	Anodyne	SIGMAR1	27	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000872226925	FE	On-Demand	Anodyne	ABCB1	36	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000872226927	FE	On-Demand	Anodyne	ADRB1	15	40
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000872226927	FE	On-Demand	Anodyne	ACE	41	37
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000872226927	FE	On-Demand	Anodyne	SIGMAR1	27	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000872226927	FE	On-Demand	Anodyne	ABCB1	36	41
COc1ccc(OC)c([C@H](O)CNCCC(C)(C)OC)c1	ZINC000872226959	CE	On-Demand	Anodyne	ADRB2	18	49
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000872226971	GF	On-Demand	Anodyne	ADRB3	26	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000872226974	GF	On-Demand	Anodyne	ADRB3	26	40
COC(=O)C1CC(NC[C@H](O)c2cccc(Br)c2)C1	ZINC000872226976	EE	On-Demand	Anodyne	ADRB1	21	40
COC(=O)C1CC(NC[C@H](O)c2cccc(Br)c2)C1	ZINC000872226976	EE	On-Demand	Anodyne	ADRB3	36	42
COC(=O)C1CC(NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000872226978	EE	On-Demand	Anodyne	ADRB1	21	40
COC(=O)C1CC(NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000872226978	EE	On-Demand	Anodyne	ADRB3	36	42
CCC(CC)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000872227003	FG	On-Demand	Anodyne	CTSF	43	34
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227027	JK	On-Demand	Anodyne	NPY2R	23	44
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227027	JK	On-Demand	Anodyne	EPHX2	37	49
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227027	JK	On-Demand	Anodyne	MLYCD	20	45
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227027	JK	On-Demand	Anodyne	L3MBTL3	56	35
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227027	JK	On-Demand	Anodyne	HPGD	21	40
CCC(CC)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000872227028	FG	On-Demand	Anodyne	CTSF	43	34
CC[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1cccc(OC)c1OC	ZINC000872227041	GF	On-Demand	Anodyne	ADRB2	17	41
CC[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1cccc(OC)c1OC	ZINC000872227041	GF	On-Demand	Anodyne	ADRB3	31	44
CC[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1cccc(OC)c1OC	ZINC000872227042	GF	On-Demand	Anodyne	ADRB2	17	41
CC[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1cccc(OC)c1OC	ZINC000872227042	GF	On-Demand	Anodyne	ADRB3	31	44
CCOC(=O)c1cc(CNC[C@H](O)c2cccc(Cl)c2)on1	ZINC000872227046	DE	On-Demand	Anodyne	ADRB1	37	44
CCOC(=O)c1cc(CNC[C@H](O)c2cccc(Cl)c2)on1	ZINC000872227046	DE	On-Demand	Anodyne	ADRB3	58	43
CCOC(=O)c1cc(CNC[C@@H](O)c2cccc(Cl)c2)on1	ZINC000872227047	DE	On-Demand	Anodyne	ADRB1	37	44
CCOC(=O)c1cc(CNC[C@@H](O)c2cccc(Cl)c2)on1	ZINC000872227047	DE	On-Demand	Anodyne	ADRB3	58	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227071	IH	On-Demand	Anodyne	P2RX7	17	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227071	IH	On-Demand	Anodyne	NPY2R	27	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227071	IH	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227071	IH	On-Demand	Anodyne	L3MBTL3	57	34
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227072	IH	On-Demand	Anodyne	P2RX7	17	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227072	IH	On-Demand	Anodyne	NPY2R	27	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227072	IH	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872227072	IH	On-Demand	Anodyne	L3MBTL3	57	34
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227105	JK	On-Demand	Anodyne	NPY2R	23	44
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227105	JK	On-Demand	Anodyne	EPHX2	37	49
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227105	JK	On-Demand	Anodyne	MLYCD	20	45
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227105	JK	On-Demand	Anodyne	L3MBTL3	56	35
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872227105	JK	On-Demand	Anodyne	HPGD	21	40
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227106	DC	On-Demand	Anodyne	ADRB2	41	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227106	DC	On-Demand	Anodyne	ADRB1	65	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227106	DC	On-Demand	Anodyne	ADRB3	46	43
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227106	DC	On-Demand	Anodyne	ABCB1	19	41
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227108	DC	On-Demand	Anodyne	ADRB2	41	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227108	DC	On-Demand	Anodyne	ADRB1	65	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227108	DC	On-Demand	Anodyne	ADRB3	46	43
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227108	DC	On-Demand	Anodyne	ABCB1	19	41
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227109	DC	On-Demand	Anodyne	ADRB2	41	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227109	DC	On-Demand	Anodyne	ADRB1	65	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227109	DC	On-Demand	Anodyne	ADRB3	46	43
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3)COCCN12	ZINC000872227109	DC	On-Demand	Anodyne	ABCB1	19	41
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227110	DC	On-Demand	Anodyne	ADRB2	41	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227110	DC	On-Demand	Anodyne	ADRB1	65	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227110	DC	On-Demand	Anodyne	ADRB3	46	43
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3)COCCN12	ZINC000872227110	DC	On-Demand	Anodyne	ABCB1	19	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872227111	CD	On-Demand	Anodyne	ADRB2	54	53
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872227111	CD	On-Demand	Anodyne	ADRB1	67	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000872227111	CD	On-Demand	Anodyne	ADRB3	47	46
COC(=O)C1CC(NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872227116	CD	On-Demand	Anodyne	ADRB2	54	53
COC(=O)C1CC(NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872227116	CD	On-Demand	Anodyne	ADRB1	67	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000872227116	CD	On-Demand	Anodyne	ADRB3	47	46
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)c(C)c1	ZINC000872227118	EF	On-Demand	Anodyne	ADRB2	18	44
Cc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)c(C)c1	ZINC000872227119	EF	On-Demand	Anodyne	ADRB2	18	44
COC(=O)C1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872227151	EE	On-Demand	Anodyne	ADRB2	31	41
COC(=O)C1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872227151	EE	On-Demand	Anodyne	ADRB1	30	41
COC(=O)C1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872227153	EE	On-Demand	Anodyne	ADRB2	31	41
COC(=O)C1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872227153	EE	On-Demand	Anodyne	ADRB1	30	41
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCCC2)C1	ZINC000872227164	DD	On-Demand	Anodyne	CTSS	15	41
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	ADRB2	34	59
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	ADRB1	76	51
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	ADRB3	18	50
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	CASR	47	47
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	CYP2D6	21	50
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872227174	DC	On-Demand	Mild	ABCB1	38	46
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	ADRB2	34	59
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	ADRB1	76	51
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	ADRB3	18	50
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	CASR	47	47
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	CYP2D6	21	50
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872227179	DC	On-Demand	Mild	ABCB1	38	46
COC(=O)C1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227183	DD	On-Demand	Anodyne	ADRB2	43	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227183	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227183	DD	On-Demand	Anodyne	ADRB3	41	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227183	DD	On-Demand	Anodyne	ABCB1	17	51
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227184	DD	On-Demand	Anodyne	ADRB2	43	44
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227184	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227184	DD	On-Demand	Anodyne	ADRB3	41	44
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872227184	DD	On-Demand	Anodyne	ABCB1	17	51
COC(=O)C1CC(NCCC(=O)Nc2cccnc2)C1	ZINC000872227194	CC	On-Demand	Anodyne	NAMPT	42	40
COC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872227202	CD	On-Demand	Anodyne	SLC6A3	21	48
COC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872227202	CD	On-Demand	Anodyne	MME	76	38
COC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872227202	CD	On-Demand	Anodyne	ABCB1	15	43
COC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872227204	CD	On-Demand	Anodyne	SLC6A3	21	48
COC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872227204	CD	On-Demand	Anodyne	MME	76	38
COC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872227204	CD	On-Demand	Anodyne	ABCB1	15	43
O=C(CCNCc1ccc(CN2C(=O)CNC2=O)cc1)Nc1ccccc1	ZINC000872227226	FD	On-Demand	Anodyne	LTA4H	15	41
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227238	GE	On-Demand	Anodyne	ADRB2	26	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227238	GE	On-Demand	Anodyne	ADRB3	19	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227238	GE	On-Demand	Anodyne	ABCB1	15	43
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872227241	GE	On-Demand	Anodyne	ADRB2	26	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872227241	GE	On-Demand	Anodyne	ADRB3	19	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000872227241	GE	On-Demand	Anodyne	ABCB1	15	43
COC(=O)C1CC(NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000872227245	DD	On-Demand	Anodyne	ADRB2	30	46
COC(=O)C1CC(NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000872227245	DD	On-Demand	Anodyne	ABCB1	24	41
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000872227246	DD	On-Demand	Anodyne	ADRB2	30	46
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000872227246	DD	On-Demand	Anodyne	ABCB1	24	41
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C)C1	ZINC000872227257	CD	On-Demand	Anodyne	ADRB2	43	57
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C)C1	ZINC000872227257	CD	On-Demand	Anodyne	ADRB1	61	36
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C)C1	ZINC000872227257	CD	On-Demand	Anodyne	ADRB3	25	42
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C)C1	ZINC000872227257	CD	On-Demand	Anodyne	ABCB1	70	49
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C)C1	ZINC000872227259	CD	On-Demand	Anodyne	ADRB2	43	57
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C)C1	ZINC000872227259	CD	On-Demand	Anodyne	ADRB1	61	36
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C)C1	ZINC000872227259	CD	On-Demand	Anodyne	ADRB3	25	42
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C)C1	ZINC000872227259	CD	On-Demand	Anodyne	ABCB1	70	49
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872227287	FD	On-Demand	Anodyne	ADRB2	54	49
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872227287	FD	On-Demand	Anodyne	ADRB1	73	49
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872227287	FD	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872227287	FD	On-Demand	Anodyne	ACOX1	53	38
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000872227287	FD	On-Demand	Anodyne	ABCB1	49	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872227288	FD	On-Demand	Anodyne	ADRB2	54	49
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872227288	FD	On-Demand	Anodyne	ADRB1	73	49
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872227288	FD	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872227288	FD	On-Demand	Anodyne	ACOX1	53	38
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000872227288	FD	On-Demand	Anodyne	ABCB1	49	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000872227295	FE	On-Demand	Anodyne	SLC6A3	32	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000872227295	FE	On-Demand	Anodyne	ADRB3	26	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000872227296	FE	On-Demand	Anodyne	SLC6A3	32	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000872227296	FE	On-Demand	Anodyne	ADRB3	26	40
N#CC1(C[C@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CC1	ZINC000872227344	ED	On-Demand	Mild	CTSS	25	45
N#CC1(C[C@@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CC1	ZINC000872227345	ED	On-Demand	Mild	CTSS	25	45
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227351	CD	On-Demand	Anodyne	ADRB2	39	47
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227351	CD	On-Demand	Anodyne	ADRB1	58	39
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227351	CD	On-Demand	Anodyne	ADRB3	24	44
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000872227351	CD	On-Demand	Anodyne	ABCB1	50	48
COC(=O)C1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000872227353	CD	On-Demand	Anodyne	ADRB2	39	47
COC(=O)C1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000872227353	CD	On-Demand	Anodyne	ADRB1	58	39
COC(=O)C1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000872227353	CD	On-Demand	Anodyne	ADRB3	24	44
COC(=O)C1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000872227353	CD	On-Demand	Anodyne	ABCB1	50	48
COC(=O)C1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227363	EC	On-Demand	Anodyne	ADRB2	37	46
COC(=O)C1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227363	EC	On-Demand	Anodyne	ADRB1	36	46
COC(=O)C1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227363	EC	On-Demand	Anodyne	ADRB3	23	42
COC(=O)C1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227363	EC	On-Demand	Anodyne	ABCB1	25	44
COC(=O)C1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227364	EC	On-Demand	Anodyne	ADRB2	37	46
COC(=O)C1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227364	EC	On-Demand	Anodyne	ADRB1	36	46
COC(=O)C1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227364	EC	On-Demand	Anodyne	ADRB3	23	42
COC(=O)C1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872227364	EC	On-Demand	Anodyne	ABCB1	25	44
COC(=O)C1CC(NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000872227372	DD	On-Demand	Anodyne	ADRB1	26	41
COC(=O)C1CC(NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000872227372	DD	On-Demand	Anodyne	ADRB3	18	44
COC(=O)C1CC(NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000872227373	DD	On-Demand	Anodyne	ADRB1	26	41
COC(=O)C1CC(NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000872227373	DD	On-Demand	Anodyne	ADRB3	18	44
COC(=O)C1CC(NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000872227376	CD	On-Demand	Mild	CTRB_BOVIN	43	30
COC(=O)C1CC(NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000872227377	CD	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000872227378	ED	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000872227378	ED	On-Demand	Anodyne	SIGMAR1	27	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000872227378	ED	On-Demand	Anodyne	REN	46	37
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000872227378	ED	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000872227378	ED	On-Demand	Anodyne	SFRP1	41	37
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000872227379	ED	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000872227379	ED	On-Demand	Anodyne	SIGMAR1	27	43
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000872227379	ED	On-Demand	Anodyne	REN	46	37
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000872227379	ED	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000872227379	ED	On-Demand	Anodyne	SFRP1	41	37
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227388	ED	On-Demand	Anodyne	ADRB2	34	42
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227388	ED	On-Demand	Anodyne	ADRB1	40	42
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227388	ED	On-Demand	Anodyne	PTGFR	43	40
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227388	ED	On-Demand	Anodyne	PDS	80	48
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227389	ED	On-Demand	Anodyne	ADRB2	34	42
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227389	ED	On-Demand	Anodyne	ADRB1	40	42
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227389	ED	On-Demand	Anodyne	PTGFR	43	40
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872227389	ED	On-Demand	Anodyne	PDS	80	48
COC(=O)C1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872227400	ED	On-Demand	Anodyne	ADRB2	40	41
COC(=O)C1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872227400	ED	On-Demand	Anodyne	ADRB1	57	41
COC(=O)C1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872227400	ED	On-Demand	Anodyne	ADRB3	40	44
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227401	EC	On-Demand	Anodyne	ADRB2	25	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227401	EC	On-Demand	Anodyne	ADRB1	49	45
COC(=O)C1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872227402	ED	On-Demand	Anodyne	ADRB2	40	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872227402	ED	On-Demand	Anodyne	ADRB1	57	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872227402	ED	On-Demand	Anodyne	ADRB3	40	44
COC(=O)C1CC(NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000872227405	EE	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)C1CC(NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000872227406	EE	On-Demand	Anodyne	SLC6A3	18	42
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227409	EC	On-Demand	Anodyne	ADRB2	25	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227409	EC	On-Demand	Anodyne	ADRB1	49	45
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	ADRB2	30	73
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	ADRB1	41	61
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	HTR1A	17	73
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	ADRB3	20	61
COC(=O)C1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227410	DD	On-Demand	Anodyne	ABCB1	20	44
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227411	EC	On-Demand	Anodyne	ADRB2	25	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227411	EC	On-Demand	Anodyne	ADRB1	49	45
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	ADRB2	30	73
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	ADRB1	41	61
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	HTR1A	17	73
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	ADRB3	20	61
COC(=O)C1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872227412	DD	On-Demand	Anodyne	ABCB1	20	44
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227413	EC	On-Demand	Anodyne	ADRB2	25	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(F)cc3)COCCN12	ZINC000872227413	EC	On-Demand	Anodyne	ADRB1	49	45
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc4[nH]ccc34)COCCN12	ZINC000872227423	FC	On-Demand	Anodyne	ADRB1	26	52
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc4[nH]ccc34)COCCN12	ZINC000872227424	FC	On-Demand	Anodyne	ADRB1	26	52
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc4[nH]ccc34)COCCN12	ZINC000872227425	FC	On-Demand	Anodyne	ADRB1	26	52
O=C1OC[C@]2(CNC[C@H](O)COc3cccc4[nH]ccc34)COCCN12	ZINC000872227428	FC	On-Demand	Anodyne	ADRB1	26	52
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA2	77	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	AVPR2	64	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	AVPR1A	36	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA1	63	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA7	41	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CPT1A	44	36
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA4	66	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA5A	41	34
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	EPHX2	17	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA12	43	37
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CA9	46	47
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	UREA_CANEN	25	41
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	CYNT	17	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	MTCA1	45	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	P96878_MYCTU	56	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872227438	GD	On-Demand	Anodyne	L3MBTL3	82	39
CSc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227448	FG	On-Demand	Anodyne	ADRB2	28	41
CSc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227448	FG	On-Demand	Anodyne	ADRB1	36	44
CSc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227448	FG	On-Demand	Anodyne	ADRB3	23	44
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227449	FG	On-Demand	Anodyne	ADRB2	28	41
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227449	FG	On-Demand	Anodyne	ADRB1	36	44
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872227449	FG	On-Demand	Anodyne	ADRB3	23	44
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Br)cc2)on1	ZINC000872227452	GE	On-Demand	Anodyne	ADRB2	40	47
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Br)cc2)on1	ZINC000872227452	GE	On-Demand	Anodyne	ADRB1	53	39
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Br)cc2)on1	ZINC000872227453	GE	On-Demand	Anodyne	ADRB2	40	47
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Br)cc2)on1	ZINC000872227453	GE	On-Demand	Anodyne	ADRB1	53	39
COC(=O)C1CC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000872227488	DE	On-Demand	Anodyne	ADRB3	15	49
COC(=O)C1CC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000872227489	DE	On-Demand	Anodyne	ADRB3	15	49
COC(=O)C1CC(NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000872227499	EE	On-Demand	Anodyne	ADRB2	20	40
COC(=O)C1CC(NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000872227500	EE	On-Demand	Anodyne	ADRB2	20	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000872227511	FD	On-Demand	Mild	ADRB3	21	50
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000872227512	FD	On-Demand	Mild	ADRB3	21	50
COC(=O)C1CC(NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000872227518	CD	On-Demand	Anodyne	SLC6A3	26	41
COC(=O)C1CC(NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000872227518	CD	On-Demand	Anodyne	ADRB3	19	47
COC(=O)C1CC(NC[C@H](O)c2ccc(C)cc2)C1	ZINC000872227519	CD	On-Demand	Anodyne	SLC6A3	26	41
COC(=O)C1CC(NC[C@H](O)c2ccc(C)cc2)C1	ZINC000872227519	CD	On-Demand	Anodyne	ADRB3	19	47
COC(=O)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000872227520	BD	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000872227520	BD	On-Demand	Anodyne	ADRB3	46	38
COC(=O)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000872227520	BD	On-Demand	Anodyne	AOC3	15	43
COC(=O)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000872227520	BD	On-Demand	Anodyne	ACHP_LYMST	21	43
COC(=O)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000872227520	BD	On-Demand	Anodyne	Q8WSF8_APLCA	44	43
COC(=O)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000872227521	BD	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000872227521	BD	On-Demand	Anodyne	ADRB3	46	38
COC(=O)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000872227521	BD	On-Demand	Anodyne	AOC3	15	43
COC(=O)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000872227521	BD	On-Demand	Anodyne	ACHP_LYMST	21	43
COC(=O)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000872227521	BD	On-Demand	Anodyne	Q8WSF8_APLCA	44	43
COC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872227542	CD	On-Demand	Anodyne	ADRB2	24	45
COC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872227542	CD	On-Demand	Anodyne	ADRB1	50	50
COC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872227542	CD	On-Demand	Anodyne	SLC6A3	21	44
COC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872227542	CD	On-Demand	Anodyne	ADRB3	70	52
COC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872227542	CD	On-Demand	Anodyne	CYP3A4	48	37
COC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872227543	CD	On-Demand	Anodyne	ADRB2	24	45
COC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872227543	CD	On-Demand	Anodyne	ADRB1	50	50
COC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872227543	CD	On-Demand	Anodyne	SLC6A3	21	44
COC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872227543	CD	On-Demand	Anodyne	ADRB3	70	52
COC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872227543	CD	On-Demand	Anodyne	CYP3A4	48	37
CC(C)(C)OC(=O)CN1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000872227547	FE	On-Demand	Anodyne	DRD4	26	41
CC(C)(C)OC(=O)CN1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000872227547	FE	On-Demand	Anodyne	LTA4H	29	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000872227556	GF	On-Demand	Anodyne	ADRB3	18	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000872227558	GF	On-Demand	Anodyne	ADRB3	18	41
COC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227582	DD	On-Demand	Anodyne	DRD2	15	40
COC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227582	DD	On-Demand	Anodyne	DRD4	35	40
COC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227582	DD	On-Demand	Anodyne	SIGMAR1	76	44
COC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227582	DD	On-Demand	Anodyne	MCHR2	44	32
COC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227582	DD	On-Demand	Anodyne	NPFFR1	50	41
COC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227583	DD	On-Demand	Anodyne	DRD2	15	40
COC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227583	DD	On-Demand	Anodyne	DRD4	35	40
COC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227583	DD	On-Demand	Anodyne	SIGMAR1	76	44
COC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227583	DD	On-Demand	Anodyne	MCHR2	44	32
COC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872227583	DD	On-Demand	Anodyne	NPFFR1	50	41
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872227587	CD	On-Demand	Anodyne	ADRB2	48	58
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872227587	CD	On-Demand	Anodyne	ADRB1	55	58
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872227587	CD	On-Demand	Anodyne	ADRB3	40	39
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872227587	CD	On-Demand	Anodyne	ACOX1	45	33
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000872227587	CD	On-Demand	Anodyne	PDS	72	44
COC(=O)C1CC(NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872227588	CD	On-Demand	Anodyne	ADRB2	48	58
COC(=O)C1CC(NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872227588	CD	On-Demand	Anodyne	ADRB1	55	58
COC(=O)C1CC(NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872227588	CD	On-Demand	Anodyne	ADRB3	40	39
COC(=O)C1CC(NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872227588	CD	On-Demand	Anodyne	ACOX1	45	33
COC(=O)C1CC(NC[C@H](O)COc2cccc(C)c2)C1	ZINC000872227588	CD	On-Demand	Anodyne	PDS	72	44
COC(=O)C1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872227605	EC	On-Demand	Anodyne	ADRB3	25	43
COC(=O)C1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872227606	EC	On-Demand	Anodyne	ADRB3	25	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000872227609	DD	On-Demand	Anodyne	ADRB2	27	46
COC(=O)C1CC(NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000872227609	DD	On-Demand	Anodyne	ABCB1	24	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000872227610	DD	On-Demand	Anodyne	ADRB2	27	46
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000872227610	DD	On-Demand	Anodyne	ABCB1	24	41
COC(=O)C1CC(NC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000872227615	DC	On-Demand	Anodyne	NOD2	43	38
COC(=O)C1CC(NC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000872227616	DC	On-Demand	Anodyne	NOD2	43	38
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872227628	EE	On-Demand	Anodyne	SLC6A3	18	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872227628	EE	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872227628	EE	On-Demand	Anodyne	SIGMAR1	16	44
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872227628	EE	On-Demand	Anodyne	CCR5	16	42
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000872227628	EE	On-Demand	Anodyne	SFRP1	43	38
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872227630	EE	On-Demand	Anodyne	SLC6A3	18	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872227630	EE	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872227630	EE	On-Demand	Anodyne	SIGMAR1	16	44
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872227630	EE	On-Demand	Anodyne	CCR5	16	42
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000872227630	EE	On-Demand	Anodyne	SFRP1	43	38
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872227662	GE	On-Demand	Anodyne	ADRB2	43	53
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872227662	GE	On-Demand	Anodyne	ADRB1	39	53
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872227662	GE	On-Demand	Anodyne	ADRB3	32	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872227662	GE	On-Demand	Anodyne	ABCB1	55	43
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872227674	GE	On-Demand	Anodyne	ADRB2	43	53
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872227674	GE	On-Demand	Anodyne	ADRB1	39	53
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872227674	GE	On-Demand	Anodyne	ADRB3	32	43
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872227674	GE	On-Demand	Anodyne	ABCB1	55	43
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	ADRB2	69	52
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	ADRB1	88	46
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	PTGFR	30	42
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	ADRB3	65	46
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	ABCB1	47	47
COC(=O)C1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000872227676	CC	On-Demand	Anodyne	PDS	72	40
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	ADRB2	69	52
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	ADRB1	88	46
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	PTGFR	30	42
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	ADRB3	65	46
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	ABCB1	47	47
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000872227684	CC	On-Demand	Anodyne	PDS	72	40
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872227687	GD	On-Demand	Anodyne	ADRB2	40	45
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872227687	GD	On-Demand	Anodyne	ADRB1	50	45
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872227687	GD	On-Demand	Anodyne	ADRB3	36	46
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872227687	GD	On-Demand	Anodyne	ACOX1	51	40
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872227687	GD	On-Demand	Anodyne	CCR3	21	44
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872227690	GD	On-Demand	Anodyne	ADRB2	40	45
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872227690	GD	On-Demand	Anodyne	ADRB1	50	45
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872227690	GD	On-Demand	Anodyne	ADRB3	36	46
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872227690	GD	On-Demand	Anodyne	ACOX1	51	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872227690	GD	On-Demand	Anodyne	CCR3	21	44
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872227701	FF	On-Demand	Anodyne	ADRB3	27	48
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872227701	FF	On-Demand	Anodyne	CACNA1I	43	35
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872227717	EE	On-Demand	Anodyne	ADRB2	21	40
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000872227718	EE	On-Demand	Anodyne	ADRB2	21	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	AVPR2	82	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	AVPR1A	43	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	CCKAR	15	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	TACR3	17	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	ATR	16	48
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	NR2E3	60	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	SMO	28	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872227733	JK	On-Demand	Anodyne	MT-CO2	43	41
COC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872227771	CD	On-Demand	Anodyne	HDAC10	18	42
COC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872227771	CD	On-Demand	Anodyne	HDAC2	16	42
COC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872227771	CD	On-Demand	Anodyne	HDAC11	17	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227804	EC	On-Demand	Anodyne	ADRB2	52	60
COC(=O)C1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227804	EC	On-Demand	Anodyne	ADRB1	83	60
COC(=O)C1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227804	EC	On-Demand	Anodyne	TSHR	40	30
COC(=O)C1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227804	EC	On-Demand	Anodyne	ADRB3	57	52
COC(=O)C1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227806	EC	On-Demand	Anodyne	ADRB2	52	60
COC(=O)C1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227806	EC	On-Demand	Anodyne	ADRB1	83	60
COC(=O)C1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227806	EC	On-Demand	Anodyne	TSHR	40	30
COC(=O)C1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872227806	EC	On-Demand	Anodyne	ADRB3	57	52
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227809	DD	On-Demand	Anodyne	ADRB2	40	46
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227809	DD	On-Demand	Anodyne	ADRB1	48	44
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227809	DD	On-Demand	Anodyne	ADRB3	36	41
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227809	DD	On-Demand	Anodyne	ABCB1	23	47
COC(=O)C1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227809	DD	On-Demand	Anodyne	PDS	59	35
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227811	DD	On-Demand	Anodyne	ADRB2	40	46
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227811	DD	On-Demand	Anodyne	ADRB1	48	44
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227811	DD	On-Demand	Anodyne	ADRB3	36	41
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227811	DD	On-Demand	Anodyne	ABCB1	23	47
COC(=O)C1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872227811	DD	On-Demand	Anodyne	PDS	59	35
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000872227829	FE	On-Demand	Anodyne	ADRB3	25	40
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000872227831	FE	On-Demand	Anodyne	ADRB3	25	40
COC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872227833	EE	On-Demand	Anodyne	ADRB2	48	58
COC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872227833	EE	On-Demand	Anodyne	ADRB1	62	39
COC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872227833	EE	On-Demand	Anodyne	ADRB3	30	57
COC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872227833	EE	On-Demand	Anodyne	CYP2D6	20	44
COC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872227833	EE	On-Demand	Anodyne	ABCB1	56	48
COC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872227835	EE	On-Demand	Anodyne	ADRB2	48	58
COC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872227835	EE	On-Demand	Anodyne	ADRB1	62	39
COC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872227835	EE	On-Demand	Anodyne	ADRB3	30	57
COC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872227835	EE	On-Demand	Anodyne	CYP2D6	20	44
COC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872227835	EE	On-Demand	Anodyne	ABCB1	56	48
COC(=O)C1CC(NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000872227841	CD	On-Demand	Anodyne	SLC6A3	31	42
COC(=O)C1CC(NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000872227841	CD	On-Demand	Anodyne	ADRB3	25	48
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227842	GD	On-Demand	Mild	ADRB2	29	42
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227842	GD	On-Demand	Mild	ADRB1	42	42
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227842	GD	On-Demand	Mild	ADRB3	28	45
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227842	GD	On-Demand	Mild	ACOX1	49	32
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227843	GD	On-Demand	Mild	ADRB2	29	42
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227843	GD	On-Demand	Mild	ADRB1	42	42
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227843	GD	On-Demand	Mild	ADRB3	28	45
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872227843	GD	On-Demand	Mild	ACOX1	49	32
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227846	DD	On-Demand	Anodyne	ADRB2	50	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227846	DD	On-Demand	Anodyne	ADRB1	75	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227846	DD	On-Demand	Anodyne	GRIN1	19	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227846	DD	On-Demand	Anodyne	ADRB3	55	45
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227847	DD	On-Demand	Anodyne	ADRB2	50	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227847	DD	On-Demand	Anodyne	ADRB1	75	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227847	DD	On-Demand	Anodyne	GRIN1	19	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872227847	DD	On-Demand	Anodyne	ADRB3	55	45
COC(=O)C1CC(NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872227856	ED	On-Demand	Anodyne	ADRB2	23	44
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872227857	ED	On-Demand	Anodyne	ADRB2	23	44
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227861	ED	On-Demand	Anodyne	ADRB2	36	46
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227861	ED	On-Demand	Anodyne	ADRB1	55	37
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227861	ED	On-Demand	Anodyne	ADRB3	21	40
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227861	ED	On-Demand	Anodyne	ABCB1	43	49
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227862	ED	On-Demand	Anodyne	ADRB2	36	46
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227862	ED	On-Demand	Anodyne	ADRB1	55	37
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227862	ED	On-Demand	Anodyne	ADRB3	21	40
COC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872227862	ED	On-Demand	Anodyne	ABCB1	43	49
Cc1ccc(OC[C@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227866	GE	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227866	GE	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227866	GE	On-Demand	Anodyne	ADRB3	36	47
Cc1ccc(OC[C@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227866	GE	On-Demand	Anodyne	ACOX1	64	36
Cc1ccc(OC[C@@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227867	GE	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227867	GE	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227867	GE	On-Demand	Anodyne	ADRB3	36	47
Cc1ccc(OC[C@@H](O)CNC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000872227867	GE	On-Demand	Anodyne	ACOX1	64	36
COC(=O)C1CC(NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227869	DD	On-Demand	Anodyne	ADRB2	33	55
COC(=O)C1CC(NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227869	DD	On-Demand	Anodyne	ADRB1	30	41
COC(=O)C1CC(NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227869	DD	On-Demand	Anodyne	ADRB3	20	40
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227870	DD	On-Demand	Anodyne	ADRB2	33	55
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227870	DD	On-Demand	Anodyne	ADRB1	30	41
COC(=O)C1CC(NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872227870	DD	On-Demand	Anodyne	ADRB3	20	40
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	ADRB2	56	57
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	ADRB1	64	42
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	ADRB3	48	43
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	CASR	40	35
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	ACOX1	51	38
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	ABCB1	36	41
COC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227871	EE	On-Demand	Anodyne	PDS	44	34
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	ADRB2	56	57
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	ADRB1	64	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	ADRB3	48	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	CASR	40	35
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	ACOX1	51	38
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	ABCB1	36	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872227872	EE	On-Demand	Anodyne	PDS	44	34
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872227873	DD	On-Demand	Anodyne	ADRB2	42	53
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872227873	DD	On-Demand	Anodyne	ADRB1	61	36
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872227873	DD	On-Demand	Anodyne	ADRB3	28	42
COC(=O)C1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872227873	DD	On-Demand	Anodyne	ABCB1	57	49
COC(=O)C1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872227874	DD	On-Demand	Anodyne	ADRB2	42	53
COC(=O)C1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872227874	DD	On-Demand	Anodyne	ADRB1	61	36
COC(=O)C1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872227874	DD	On-Demand	Anodyne	ADRB3	28	42
COC(=O)C1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000872227874	DD	On-Demand	Anodyne	ABCB1	57	49
CC(C)(C)OC(=O)CN1CCC(NCCC(=O)Nc2ccccc2F)CC1	ZINC000872227875	GF	On-Demand	Anodyne	DRD4	16	47
COC(=O)C1CC(NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000872227902	DE	On-Demand	Anodyne	ADRB3	26	40
COC(=O)C1CC(NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000872227903	DE	On-Demand	Anodyne	ADRB3	26	40
C/C=C/c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)c(OC)c1	ZINC000872227904	EE	On-Demand	Anodyne	TUBB1	40	33
C/C=C\c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)c(OC)c1	ZINC000872227906	EE	On-Demand	Anodyne	TUBB1	40	33
C/C=C\c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)c(OC)c1	ZINC000872227908	EE	On-Demand	Anodyne	TUBB1	40	33
C/C=C/c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)c(OC)c1	ZINC000872227909	EE	On-Demand	Anodyne	TUBB1	40	33
COC(=O)C1CC(NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872227921	EF	On-Demand	Anodyne	EPHX2	16	46
COC(=O)C1CC(NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872227921	EF	On-Demand	Anodyne	PDS	41	35
COC(=O)C1CC(NC[C@H](O)COCc2ccccc2OC)C1	ZINC000872227933	DD	On-Demand	Anodyne	ADRB2	17	40
COC(=O)C1CC(NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000872227935	DD	On-Demand	Anodyne	ADRB2	17	40
COC(=O)C1CC(NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872227983	FD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872227983	FD	On-Demand	Anodyne	ADRB1	64	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000872227983	FD	On-Demand	Anodyne	ADRB3	44	45
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872227984	FD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872227984	FD	On-Demand	Anodyne	ADRB1	64	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000872227984	FD	On-Demand	Anodyne	ADRB3	44	45
COC(=O)C1CC(NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227985	DE	On-Demand	Anodyne	ADRB2	22	40
COC(=O)C1CC(NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227985	DE	On-Demand	Anodyne	CASR	41	42
COC(=O)C1CC(NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227985	DE	On-Demand	Anodyne	TRY2_BOVIN	56	33
COC(=O)C1CC(NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227986	DE	On-Demand	Anodyne	ADRB2	22	40
COC(=O)C1CC(NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227986	DE	On-Demand	Anodyne	CASR	41	42
COC(=O)C1CC(NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872227986	DE	On-Demand	Anodyne	TRY2_BOVIN	56	33
COC(=O)C1CC(NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872227987	CD	On-Demand	Anodyne	ADRB3	38	40
COC(=O)C1CC(NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872227988	CD	On-Demand	Anodyne	ADRB3	38	40
COC(=O)C1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000872227997	CD	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)C1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000872227998	CD	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)C1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228005	DE	On-Demand	Anodyne	ADRB1	18	40
COC(=O)C1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228005	DE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)C1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228005	DE	On-Demand	Anodyne	CCR2	53	36
COC(=O)C1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228005	DE	On-Demand	Anodyne	PDS	43	34
COC(=O)C1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228006	DE	On-Demand	Anodyne	ADRB1	18	40
COC(=O)C1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228006	DE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)C1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228006	DE	On-Demand	Anodyne	CCR2	53	36
COC(=O)C1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872228006	DE	On-Demand	Anodyne	PDS	43	34
COC(=O)C1CC(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228013	GC	On-Demand	Clean	DRD4	44	36
COC(=O)C1CC(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228013	GC	On-Demand	Clean	ACOX1	43	30
COC(=O)C1CC(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228013	GC	On-Demand	Clean	ABCB1	46	40
COC(=O)C1CC(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228014	GC	On-Demand	Clean	DRD4	44	36
COC(=O)C1CC(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228014	GC	On-Demand	Clean	ACOX1	43	30
COC(=O)C1CC(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000872228014	GC	On-Demand	Clean	ABCB1	46	40
COC(=O)C1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000872228029	CD	On-Demand	Anodyne	MMP2	20	48
COC(=O)C1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000872228029	CD	On-Demand	Anodyne	MMP3	17	41
COC(=O)C1CC(NC[C@H](O)c2cccc(F)c2)C1	ZINC000872228030	CD	On-Demand	Anodyne	SLC6A3	19	42
COC(=O)C1CC(NC[C@@H](O)c2cccc(F)c2)C1	ZINC000872228031	CD	On-Demand	Anodyne	SLC6A3	19	42
CC(C)(C)OC(=O)CN1CCC(NCCS(=O)(=O)c2ccccc2)CC1	ZINC000872228040	GD	On-Demand	Anodyne	SFRP1	122	43
CC(C)(C)OC(=O)CN1CCC(NCCS(=O)(=O)c2ccccc2)CC1	ZINC000872228040	GD	On-Demand	Anodyne	WNT3	82	38
COC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228045	EC	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228045	EC	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228045	EC	On-Demand	Anodyne	ADRB3	53	45
COC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228045	EC	On-Demand	Anodyne	ABCB1	15	41
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228046	EC	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228046	EC	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228046	EC	On-Demand	Anodyne	ADRB3	53	45
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228046	EC	On-Demand	Anodyne	ABCB1	15	41
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228050	DC	On-Demand	Mild	ADRB2	41	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228050	DC	On-Demand	Mild	ADRB1	58	43
COC(=O)C1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228050	DC	On-Demand	Mild	ADRB3	36	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228051	DC	On-Demand	Mild	ADRB2	41	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228051	DC	On-Demand	Mild	ADRB1	58	43
COC(=O)C1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872228051	DC	On-Demand	Mild	ADRB3	36	44
COC(=O)C1CC(NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228052	CD	On-Demand	Anodyne	ADRB2	58	47
COC(=O)C1CC(NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228052	CD	On-Demand	Anodyne	ADRB1	74	42
COC(=O)C1CC(NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228052	CD	On-Demand	Anodyne	ADRB3	50	45
COC(=O)C1CC(NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228052	CD	On-Demand	Anodyne	ABCB1	18	40
COC(=O)C1CC(NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228053	CD	On-Demand	Anodyne	ADRB2	58	47
COC(=O)C1CC(NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228053	CD	On-Demand	Anodyne	ADRB1	74	42
COC(=O)C1CC(NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228053	CD	On-Demand	Anodyne	ADRB3	50	45
COC(=O)C1CC(NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228053	CD	On-Demand	Anodyne	ABCB1	18	40
COC(=O)C1CC(NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872228054	DD	On-Demand	Anodyne	ADRB2	31	41
COC(=O)C1CC(NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872228054	DD	On-Demand	Anodyne	ADRB1	27	41
COC(=O)C1CC(NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872228054	DD	On-Demand	Anodyne	ABCB1	29	40
COC(=O)C1CC(NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872228055	DD	On-Demand	Anodyne	ADRB2	31	41
COC(=O)C1CC(NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872228055	DD	On-Demand	Anodyne	ADRB1	27	41
COC(=O)C1CC(NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872228055	DD	On-Demand	Anodyne	ABCB1	29	40
COC(=O)C1CC(NC[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000872228064	DD	On-Demand	Anodyne	MTNR1A	34	45
COC(=O)C1CC(NC[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000872228065	DD	On-Demand	Anodyne	MTNR1A	34	45
COC(=O)C1CC(NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872228080	FD	On-Demand	Anodyne	ADRB2	41	44
COC(=O)C1CC(NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872228080	FD	On-Demand	Anodyne	ADRB1	48	44
COC(=O)C1CC(NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000872228080	FD	On-Demand	Anodyne	PDS	76	45
COC(=O)C1CC(NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872228081	FD	On-Demand	Anodyne	ADRB2	41	44
COC(=O)C1CC(NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872228081	FD	On-Demand	Anodyne	ADRB1	48	44
COC(=O)C1CC(NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000872228081	FD	On-Demand	Anodyne	PDS	76	45
COC(=O)C1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000872228087	CD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)C1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000872228087	CD	On-Demand	Anodyne	ABCB1	18	43
COC(=O)C1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000872228088	CD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)C1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000872228088	CD	On-Demand	Anodyne	ABCB1	18	43
COC(=O)C1CC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872228089	FD	On-Demand	Anodyne	GPR119	26	42
COC(=O)C1CC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872228090	FD	On-Demand	Anodyne	GPR119	26	42
COC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872228100	CD	On-Demand	Anodyne	ACE	43	38
COC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872228100	CD	On-Demand	Anodyne	PTGFR	39	41
COC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872228100	CD	On-Demand	Anodyne	SLC6A3	20	40
COC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872228100	CD	On-Demand	Anodyne	ABCB1	32	47
COC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872228101	CD	On-Demand	Anodyne	ACE	43	38
COC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872228101	CD	On-Demand	Anodyne	PTGFR	39	41
COC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872228101	CD	On-Demand	Anodyne	SLC6A3	20	40
COC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872228101	CD	On-Demand	Anodyne	ABCB1	32	47
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000872228118	FE	On-Demand	Anodyne	CCR5	41	36
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000872228119	FE	On-Demand	Anodyne	CCR5	41	36
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	ADRB2	37	51
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	ADRB1	70	43
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	ADRB3	24	44
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	CASR	44	44
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	CYP2D6	20	44
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872228130	GD	On-Demand	Mild	ABCB1	43	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	ADRB2	37	51
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	ADRB1	70	43
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	ADRB3	24	44
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	CASR	44	44
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	CYP2D6	20	44
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872228131	GD	On-Demand	Mild	ABCB1	43	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228133	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228133	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228133	FE	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228134	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228134	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872228134	FE	On-Demand	Anodyne	ABCB1	15	46
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872228138	FF	On-Demand	Anodyne	ADRB1	42	49
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872228138	FF	On-Demand	Anodyne	ADRB3	64	51
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872228138	FF	On-Demand	Anodyne	IGF1R	31	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872228138	FF	On-Demand	Anodyne	CYP3A4	52	41
CC(C)(C)OC(=O)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872228138	FF	On-Demand	Anodyne	CACNA1I	50	39
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872228139	FF	On-Demand	Anodyne	ADRB1	42	49
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872228139	FF	On-Demand	Anodyne	ADRB3	64	51
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872228139	FF	On-Demand	Anodyne	IGF1R	31	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872228139	FF	On-Demand	Anodyne	CYP3A4	52	41
CC(C)(C)OC(=O)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872228139	FF	On-Demand	Anodyne	CACNA1I	50	39
CCOc1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228166	DD	On-Demand	Anodyne	ADRB2	54	46
CCOc1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228166	DD	On-Demand	Anodyne	ADRB1	68	43
CCOc1ccc(OC[C@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228166	DD	On-Demand	Anodyne	ADRB3	47	46
CCOc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228167	DD	On-Demand	Anodyne	ADRB2	54	46
CCOc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228167	DD	On-Demand	Anodyne	ADRB1	68	43
CCOc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC)C2)cc1	ZINC000872228167	DD	On-Demand	Anodyne	ADRB3	47	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228185	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228185	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228185	GE	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228186	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228186	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872228186	GE	On-Demand	Anodyne	ADRB3	47	48
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228218	FE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228218	FE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228218	FE	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228219	FE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228219	FE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228219	FE	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228220	FE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228220	FE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228220	FE	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228221	FE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228221	FE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228221	FE	On-Demand	Anodyne	ADRB3	43	44
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228240	EE	On-Demand	Anodyne	ADRB2	30	41
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228240	EE	On-Demand	Anodyne	ADRB1	46	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228240	EE	On-Demand	Anodyne	ADRB3	31	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228242	EE	On-Demand	Anodyne	ADRB2	30	41
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228242	EE	On-Demand	Anodyne	ADRB1	46	43
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228242	EE	On-Demand	Anodyne	ADRB3	31	45
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228246	DE	On-Demand	Anodyne	ADRB2	39	49
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228246	DE	On-Demand	Anodyne	ADRB1	63	42
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228246	DE	On-Demand	Anodyne	ADRB3	43	42
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228248	DE	On-Demand	Anodyne	ADRB2	39	49
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228248	DE	On-Demand	Anodyne	ADRB1	63	42
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228248	DE	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228249	DE	On-Demand	Anodyne	ADRB2	39	49
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228249	DE	On-Demand	Anodyne	ADRB1	63	42
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228249	DE	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228250	DE	On-Demand	Anodyne	ADRB2	39	49
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228250	DE	On-Demand	Anodyne	ADRB1	63	42
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1	ZINC000872228250	DE	On-Demand	Anodyne	ADRB3	43	42
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228266	FF	On-Demand	Anodyne	ADRB2	33	43
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228266	FF	On-Demand	Anodyne	ADRB1	42	46
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228266	FF	On-Demand	Anodyne	ADRB3	26	46
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228268	FF	On-Demand	Anodyne	ADRB2	33	43
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228268	FF	On-Demand	Anodyne	ADRB1	42	46
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228268	FF	On-Demand	Anodyne	ADRB3	26	46
O=C(CCNC[C@@]12COCCN1C(=O)OC2)Nc1cccc(Br)c1	ZINC000872228272	GD	On-Demand	Anodyne	EGFR	15	42
O=C(CCNC[C@]12COCCN1C(=O)OC2)Nc1cccc(Br)c1	ZINC000872228273	GD	On-Demand	Anodyne	EGFR	15	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228311	EE	On-Demand	Mild	ADRB1	64	45
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228311	EE	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228311	EE	On-Demand	Mild	CYP2D6	17	42
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228313	EE	On-Demand	Mild	ADRB1	64	45
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228313	EE	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228313	EE	On-Demand	Mild	CYP2D6	17	42
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228315	EE	On-Demand	Mild	ADRB1	64	45
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228315	EE	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CCC12CCOCC2	ZINC000872228315	EE	On-Demand	Mild	CYP2D6	17	42
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228317	EE	On-Demand	Mild	ADRB1	64	45
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228317	EE	On-Demand	Mild	CASR	39	41
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CCC12CCOCC2	ZINC000872228317	EE	On-Demand	Mild	CYP2D6	17	42
O=C1OC[C@]2(CNC[C@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228325	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1OC[C@]2(CNC[C@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228325	GD	On-Demand	Anodyne	PDS	42	37
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228327	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228327	GD	On-Demand	Anodyne	PDS	42	37
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228329	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228329	GD	On-Demand	Anodyne	PDS	42	37
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228331	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc(C(F)(F)F)c3)COCCN12	ZINC000872228331	GD	On-Demand	Anodyne	PDS	42	37
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228356	ED	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228356	ED	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228356	ED	On-Demand	Mild	CYP2D6	16	43
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228357	ED	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228357	ED	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC2(CCOCC2)CO1	ZINC000872228357	ED	On-Demand	Mild	CYP2D6	16	43
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228358	ED	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228358	ED	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228358	ED	On-Demand	Mild	CYP2D6	16	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228359	ED	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228359	ED	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC2(CCOCC2)CO1	ZINC000872228359	ED	On-Demand	Mild	CYP2D6	16	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228366	GC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228366	GC	On-Demand	Anodyne	ADRB1	68	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228366	GC	On-Demand	Anodyne	ADRB3	46	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228366	GC	On-Demand	Anodyne	ABCB1	23	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228367	GC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228367	GC	On-Demand	Anodyne	ADRB1	68	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228367	GC	On-Demand	Anodyne	ADRB3	46	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228367	GC	On-Demand	Anodyne	ABCB1	23	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228368	GC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228368	GC	On-Demand	Anodyne	ADRB1	68	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228368	GC	On-Demand	Anodyne	ADRB3	46	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228368	GC	On-Demand	Anodyne	ABCB1	23	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228369	GC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228369	GC	On-Demand	Anodyne	ADRB1	68	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228369	GC	On-Demand	Anodyne	ADRB3	46	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228369	GC	On-Demand	Anodyne	ABCB1	23	41
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872228371	FE	On-Demand	Anodyne	ADRB2	54	46
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872228371	FE	On-Demand	Anodyne	ADRB1	71	46
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000872228371	FE	On-Demand	Anodyne	ADRB3	58	46
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872228372	FE	On-Demand	Anodyne	ADRB2	54	46
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872228372	FE	On-Demand	Anodyne	ADRB1	71	46
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000872228372	FE	On-Demand	Anodyne	ADRB3	58	46
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)on1	ZINC000872228388	FF	On-Demand	Anodyne	ADRB2	31	61
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)on1	ZINC000872228388	FF	On-Demand	Anodyne	ADRB1	61	32
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)on1	ZINC000872228388	FF	On-Demand	Anodyne	ADRB3	17	47
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)on1	ZINC000872228388	FF	On-Demand	Anodyne	CYP2D6	16	42
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)on1	ZINC000872228389	FF	On-Demand	Anodyne	ADRB2	31	61
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)on1	ZINC000872228389	FF	On-Demand	Anodyne	ADRB1	61	32
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)on1	ZINC000872228389	FF	On-Demand	Anodyne	ADRB3	17	47
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)on1	ZINC000872228389	FF	On-Demand	Anodyne	CYP2D6	16	42
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1Cl	ZINC000872228468	EF	On-Demand	Anodyne	ADRB2	18	45
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1Cl	ZINC000872228469	EF	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1Cl	ZINC000872228470	EF	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1Cl	ZINC000872228471	EF	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228478	DE	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228478	DE	On-Demand	Anodyne	ADRB1	42	41
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228478	DE	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228479	DE	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228479	DE	On-Demand	Anodyne	ADRB1	42	41
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228479	DE	On-Demand	Anodyne	ADRB3	23	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228480	DE	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228480	DE	On-Demand	Anodyne	ADRB1	42	41
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228480	DE	On-Demand	Anodyne	ADRB3	23	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228481	DE	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228481	DE	On-Demand	Anodyne	ADRB1	42	41
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(F)cc1	ZINC000872228481	DE	On-Demand	Anodyne	ADRB3	23	40
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(C)cc2)on1	ZINC000872228493	ED	On-Demand	Anodyne	ADRB2	45	49
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(C)cc2)on1	ZINC000872228493	ED	On-Demand	Anodyne	ADRB1	61	40
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(C)cc2)on1	ZINC000872228494	ED	On-Demand	Anodyne	ADRB2	45	49
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(C)cc2)on1	ZINC000872228494	ED	On-Demand	Anodyne	ADRB1	61	40
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228518	GE	On-Demand	Anodyne	ADRB2	48	45
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228518	GE	On-Demand	Anodyne	ADRB1	67	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872228518	GE	On-Demand	Anodyne	ADRB3	52	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228519	GE	On-Demand	Anodyne	ADRB2	48	45
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228519	GE	On-Demand	Anodyne	ADRB1	67	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872228519	GE	On-Demand	Anodyne	ADRB3	52	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000872228520	JH	On-Demand	Anodyne	NPY2R	19	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000872228520	JH	On-Demand	Anodyne	EPHX2	38	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000872228520	JH	On-Demand	Anodyne	F13A1	47	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000872228520	JH	On-Demand	Anodyne	L3MBTL3	80	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000872228521	JH	On-Demand	Anodyne	NPY2R	19	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000872228521	JH	On-Demand	Anodyne	EPHX2	38	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000872228521	JH	On-Demand	Anodyne	F13A1	47	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000872228521	JH	On-Demand	Anodyne	L3MBTL3	80	39
CC(C)(C#N)C[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872228529	ED	On-Demand	Mild	CTSS	18	42
CC(C)(C#N)C[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872228530	ED	On-Demand	Mild	CTSS	18	42
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)C(F)(F)F)C1	ZINC000872228548	DD	On-Demand	Anodyne	SFRP1	42	32
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)C(F)(F)F)C1	ZINC000872228549	DD	On-Demand	Anodyne	SFRP1	42	32
N#CC1(C[C@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CCOCC1	ZINC000872228550	GD	On-Demand	Mild	CTSS	24	48
N#CC1(C[C@@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CCOCC1	ZINC000872228551	GD	On-Demand	Mild	CTSS	24	48
Cc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228558	EC	On-Demand	Anodyne	ADRB2	31	45
Cc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228558	EC	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228559	EC	On-Demand	Anodyne	ADRB2	31	45
Cc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228559	EC	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228560	EC	On-Demand	Anodyne	ADRB2	31	45
Cc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872228560	EC	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228561	EC	On-Demand	Anodyne	ADRB2	31	45
Cc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872228561	EC	On-Demand	Anodyne	ADRB1	50	45
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	AVPR2	50	41
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	CPT1A	80	42
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	CPT2	47	38
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	CPT1B	57	38
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	TAAR1	31	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Cl	ZINC000872228562	IG	On-Demand	Anodyne	L3MBTL3	61	39
CCOC(=O)c1cc(CNC[C@H](O)COc2cc(C)cc(C)c2)on1	ZINC000872228579	ED	On-Demand	Anodyne	ADRB2	18	45
CCOC(=O)c1cc(CNC[C@@H](O)COc2cc(C)cc(C)c2)on1	ZINC000872228580	ED	On-Demand	Anodyne	ADRB2	18	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228587	FC	On-Demand	Anodyne	ADRB2	21	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228587	FC	On-Demand	Anodyne	ADRB1	45	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228588	FC	On-Demand	Anodyne	ADRB2	21	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228588	FC	On-Demand	Anodyne	ADRB1	45	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228589	FC	On-Demand	Anodyne	ADRB2	21	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228589	FC	On-Demand	Anodyne	ADRB1	45	45
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228632	GF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228632	GF	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228633	GF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228633	GF	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228634	GF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228634	GF	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228635	GF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Br)cc1	ZINC000872228635	GF	On-Demand	Anodyne	ADRB1	37	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228647	FE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228647	FE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228647	FE	On-Demand	Anodyne	ADRB3	37	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228648	FE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228648	FE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228648	FE	On-Demand	Anodyne	ADRB3	37	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228649	FE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228649	FE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872228649	FE	On-Demand	Anodyne	ADRB3	37	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228650	FE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228650	FE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872228650	FE	On-Demand	Anodyne	ADRB3	37	42
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228773	FC	On-Demand	Anodyne	ADRB2	21	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(Cl)cc3)COCCN12	ZINC000872228773	FC	On-Demand	Anodyne	ADRB1	45	45
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228774	GD	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228774	GD	On-Demand	Anodyne	ADRB1	64	41
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228774	GD	On-Demand	Anodyne	ADRB3	42	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228775	GD	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228775	GD	On-Demand	Anodyne	ADRB1	64	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3C(=O)CNC3=O)cc2)cc1	ZINC000872228775	GD	On-Demand	Anodyne	ADRB3	42	41
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)CN2CCCC2)C1	ZINC000872228786	ED	On-Demand	Anodyne	CTSS	19	40
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)CN2CCCC2)C1	ZINC000872228787	ED	On-Demand	Anodyne	CTSS	19	40
C[C@@](O)(CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1)C(F)(F)F	ZINC000872228793	ED	On-Demand	Anodyne	SFRP1	46	33
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228829	GD	On-Demand	Mild	ADRB2	37	41
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228829	GD	On-Demand	Mild	ADRB1	51	39
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228829	GD	On-Demand	Mild	ADRB3	40	42
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228830	GD	On-Demand	Mild	ADRB2	37	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228830	GD	On-Demand	Mild	ADRB1	51	39
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)cc1	ZINC000872228830	GD	On-Demand	Mild	ADRB3	40	42
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228833	FE	On-Demand	Anodyne	ADRB2	30	47
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228833	FE	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228833	FE	On-Demand	Anodyne	ADRB3	19	43
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228835	FE	On-Demand	Anodyne	ADRB2	30	47
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228835	FE	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(N(C)C)CC1	ZINC000872228835	FE	On-Demand	Anodyne	ADRB3	19	43
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228848	FE	On-Demand	Anodyne	ADRB2	42	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228848	FE	On-Demand	Anodyne	ADRB1	77	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228848	FE	On-Demand	Anodyne	ADRB3	53	48
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228849	FE	On-Demand	Anodyne	ADRB2	42	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228849	FE	On-Demand	Anodyne	ADRB1	77	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872228849	FE	On-Demand	Anodyne	ADRB3	53	48
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872228861	JF	On-Demand	Anodyne	AVPR2	55	41
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872228861	JF	On-Demand	Anodyne	CPT1A	52	38
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872228861	JF	On-Demand	Anodyne	CPT2	40	32
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872228861	JF	On-Demand	Anodyne	L3MBTL3	60	37
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(c3cccc(Cl)c3)CCC2)cc1	ZINC000872228879	GG	On-Demand	Anodyne	ADRB3	41	39
CS(=O)(=O)c1ccc([C@H](O)CNCC2(c3cccc(Cl)c3)CCC2)cc1	ZINC000872228881	GG	On-Demand	Anodyne	ADRB3	41	39
CCOC(=O)c1cc(CNC[C@H](O)c2cccc(F)c2)on1	ZINC000872228897	DD	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)c1cc(CNC[C@H](O)c2cccc(F)c2)on1	ZINC000872228897	DD	On-Demand	Anodyne	ADRB3	29	41
CCOC(=O)c1cc(CNC[C@@H](O)c2cccc(F)c2)on1	ZINC000872228901	DD	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)c1cc(CNC[C@@H](O)c2cccc(F)c2)on1	ZINC000872228901	DD	On-Demand	Anodyne	ADRB3	29	41
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228941	GD	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228941	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228941	GD	On-Demand	Anodyne	ADRB3	36	41
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228942	GD	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228942	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228942	GD	On-Demand	Anodyne	ADRB3	36	41
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228944	GD	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228944	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228944	GD	On-Demand	Anodyne	ADRB3	36	41
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228946	GD	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228946	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872228946	GD	On-Demand	Anodyne	ADRB3	36	41
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCC2)C1	ZINC000872229055	CD	On-Demand	Anodyne	CTSS	15	41
O=C1OC[C@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229075	FD	On-Demand	Anodyne	ADRB2	29	48
O=C1OC[C@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229075	FD	On-Demand	Anodyne	ADRB1	48	33
O=C1OC[C@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229075	FD	On-Demand	Anodyne	ADRB3	17	44
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229079	FD	On-Demand	Anodyne	ADRB2	29	48
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229079	FD	On-Demand	Anodyne	ADRB1	48	33
O=C1OC[C@@]2(CNC[C@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229079	FD	On-Demand	Anodyne	ADRB3	17	44
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229082	FD	On-Demand	Anodyne	ADRB2	29	48
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229082	FD	On-Demand	Anodyne	ADRB1	48	33
O=C1OC[C@@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229082	FD	On-Demand	Anodyne	ADRB3	17	44
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229086	FD	On-Demand	Anodyne	ADRB2	29	48
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229086	FD	On-Demand	Anodyne	ADRB1	48	33
O=C1OC[C@]2(CNC[C@@H](O)COc3cccc4ccccc34)COCCN12	ZINC000872229086	FD	On-Demand	Anodyne	ADRB3	17	44
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)CC2(O)CCOCC2)C1	ZINC000872229137	FC	On-Demand	Anodyne	CTSS	19	42
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)CC2(O)CCOCC2)C1	ZINC000872229140	FC	On-Demand	Anodyne	CTSS	19	42
O=S(=O)(c1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCOCC2)C1	ZINC000872229165	ED	On-Demand	Anodyne	CTSS	21	44
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229173	DF	On-Demand	Anodyne	ADRB2	34	50
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229173	DF	On-Demand	Anodyne	ADRB1	41	46
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229173	DF	On-Demand	Anodyne	ADRB3	25	46
Cc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229174	DF	On-Demand	Anodyne	ADRB2	34	50
Cc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229174	DF	On-Demand	Anodyne	ADRB1	41	46
Cc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229174	DF	On-Demand	Anodyne	ADRB3	25	46
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229177	GD	On-Demand	Anodyne	ADRB2	15	42
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229177	GD	On-Demand	Anodyne	ADRB1	28	42
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229177	GD	On-Demand	Anodyne	GRIN1	25	46
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229178	GD	On-Demand	Anodyne	ADRB2	15	42
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229178	GD	On-Demand	Anodyne	ADRB1	28	42
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229178	GD	On-Demand	Anodyne	GRIN1	25	46
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229179	GD	On-Demand	Anodyne	ADRB2	15	42
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229179	GD	On-Demand	Anodyne	ADRB1	28	42
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229179	GD	On-Demand	Anodyne	GRIN1	25	46
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229180	GD	On-Demand	Anodyne	ADRB2	15	42
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229180	GD	On-Demand	Anodyne	ADRB1	28	42
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(Cl)c(Cl)c3)COCCN12	ZINC000872229180	GD	On-Demand	Anodyne	GRIN1	25	46
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229181	GC	On-Demand	Anodyne	ADRB2	36	48
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229181	GC	On-Demand	Anodyne	ADRB1	69	48
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229181	GC	On-Demand	Anodyne	ADRB3	46	42
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229182	GC	On-Demand	Anodyne	ADRB2	36	48
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229182	GC	On-Demand	Anodyne	ADRB1	69	48
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229182	GC	On-Demand	Anodyne	ADRB3	46	42
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229183	GC	On-Demand	Anodyne	ADRB2	36	48
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229183	GC	On-Demand	Anodyne	ADRB1	69	48
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229183	GC	On-Demand	Anodyne	ADRB3	46	42
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229184	GC	On-Demand	Anodyne	ADRB2	36	48
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229184	GC	On-Demand	Anodyne	ADRB1	69	48
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229184	GC	On-Demand	Anodyne	ADRB3	46	42
CCOC(=O)c1cc(CNC[C@H](O)COc2cc(C)ccc2C)on1	ZINC000872229191	ED	On-Demand	Anodyne	ADRB2	19	46
CCOC(=O)c1cc(CNC[C@@H](O)COc2cc(C)ccc2C)on1	ZINC000872229192	ED	On-Demand	Anodyne	ADRB2	19	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	AVPR2	74	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	AVPR1A	39	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	NPY2R	24	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	CPT1A	52	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	CPT2	41	33
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	GRM4	26	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	EPHX2	22	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	TGM2	64	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	F13A1	81	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	NR2E3	59	32
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	L3MBTL3	87	50
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000872229207	JH	On-Demand	Anodyne	NAMPT	28	42
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229237	EE	On-Demand	Mild	ADRB1	47	38
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229238	EE	On-Demand	Mild	ADRB1	47	38
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229239	EE	On-Demand	Mild	ADRB1	47	38
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229240	EE	On-Demand	Mild	ADRB1	47	38
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229258	EF	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229258	EF	On-Demand	Anodyne	ADRB1	44	40
CCOc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229259	EF	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229259	EF	On-Demand	Anodyne	ADRB1	44	40
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229260	EF	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229260	EF	On-Demand	Anodyne	ADRB1	44	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229261	EF	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229261	EF	On-Demand	Anodyne	ADRB1	44	40
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229338	GD	On-Demand	Mild	ADRB2	22	52
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229338	GD	On-Demand	Mild	ADRB1	62	43
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229338	GD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229338	GD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229339	GD	On-Demand	Mild	ADRB2	22	52
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229339	GD	On-Demand	Mild	ADRB1	62	43
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229339	GD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229339	GD	On-Demand	Mild	CYP2D6	17	43
O=C(CCN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1)Nc1cccnc1	ZINC000872229374	FE	On-Demand	Anodyne	TBXAS1	43	30
O=C(CCN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1)Nc1cccnc1	ZINC000872229374	FE	On-Demand	Anodyne	NAMPT	67	47
CCOc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229379	FC	On-Demand	Anodyne	ADRB2	29	45
CCOc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229379	FC	On-Demand	Anodyne	ADRB1	51	45
CCOc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229380	FC	On-Demand	Anodyne	ADRB2	29	45
CCOc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229380	FC	On-Demand	Anodyne	ADRB1	51	45
CCOc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229381	FC	On-Demand	Anodyne	ADRB2	29	45
CCOc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229381	FC	On-Demand	Anodyne	ADRB1	51	45
CCOc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229382	FC	On-Demand	Anodyne	ADRB2	29	45
CCOc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229382	FC	On-Demand	Anodyne	ADRB1	51	45
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc(Br)c2)on1	ZINC000872229389	GE	On-Demand	Anodyne	ADRB2	30	48
CCOC(=O)c1cc(CNC[C@@H](O)COc2cccc(Br)c2)on1	ZINC000872229389	GE	On-Demand	Anodyne	PDS	52	41
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc(Br)c2)on1	ZINC000872229390	GE	On-Demand	Anodyne	ADRB2	30	48
CCOC(=O)c1cc(CNC[C@H](O)COc2cccc(Br)c2)on1	ZINC000872229390	GE	On-Demand	Anodyne	PDS	52	41
O=C1OC[C@@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229395	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1OC[C@@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229395	ED	On-Demand	Anodyne	ADRB3	44	43
O=C1OC[C@@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229395	ED	On-Demand	Anodyne	IGF1R	30	42
O=C1OC[C@@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229395	ED	On-Demand	Anodyne	CYP3A4	51	40
O=C1OC[C@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229396	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1OC[C@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229396	ED	On-Demand	Anodyne	ADRB3	44	43
O=C1OC[C@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229396	ED	On-Demand	Anodyne	IGF1R	30	42
O=C1OC[C@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229396	ED	On-Demand	Anodyne	CYP3A4	51	40
O=C1OC[C@@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229397	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1OC[C@@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229397	ED	On-Demand	Anodyne	ADRB3	44	43
O=C1OC[C@@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229397	ED	On-Demand	Anodyne	IGF1R	30	42
O=C1OC[C@@]2(CNC[C@@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229397	ED	On-Demand	Anodyne	CYP3A4	51	40
O=C1OC[C@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229398	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1OC[C@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229398	ED	On-Demand	Anodyne	ADRB3	44	43
O=C1OC[C@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229398	ED	On-Demand	Anodyne	IGF1R	30	42
O=C1OC[C@]2(CNC[C@H](O)c3cccc(Cl)c3)COCCN12	ZINC000872229398	ED	On-Demand	Anodyne	CYP3A4	51	40
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229399	FE	On-Demand	Anodyne	ADRB2	38	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229399	FE	On-Demand	Anodyne	ADRB1	59	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229399	FE	On-Demand	Anodyne	ADRB3	42	48
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229400	FE	On-Demand	Anodyne	ADRB2	38	43
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229400	FE	On-Demand	Anodyne	ADRB1	59	43
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872229400	FE	On-Demand	Anodyne	ADRB3	42	48
CCOC(=O)c1cc(CNCCC(=O)Nc2cccc(Br)c2)on1	ZINC000872229401	GF	On-Demand	Anodyne	EGFR	16	40
O=C(CCNC[C@@]12COCCN1C(=O)OC2)Nc1cccc(C(F)(F)F)c1	ZINC000872229426	GD	On-Demand	Anodyne	EPHX2	21	44
O=C(CCNC[C@]12COCCN1C(=O)OC2)Nc1cccc(C(F)(F)F)c1	ZINC000872229430	GD	On-Demand	Anodyne	EPHX2	21	44
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229452	GF	On-Demand	Anodyne	ADRB2	33	46
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229452	GF	On-Demand	Anodyne	ADRB1	40	38
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229452	GF	On-Demand	Anodyne	GRIN1	27	46
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229452	GF	On-Demand	Anodyne	PDS	17	40
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229453	GF	On-Demand	Anodyne	ADRB2	33	46
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229453	GF	On-Demand	Anodyne	ADRB1	40	38
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229453	GF	On-Demand	Anodyne	GRIN1	27	46
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)on1	ZINC000872229453	GF	On-Demand	Anodyne	PDS	17	40
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229459	GD	On-Demand	Anodyne	ADRB2	38	44
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229459	GD	On-Demand	Anodyne	ADRB1	62	44
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229459	GD	On-Demand	Anodyne	ADRB3	46	41
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229616	GD	On-Demand	Anodyne	ADRB2	38	44
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229616	GD	On-Demand	Anodyne	ADRB1	62	44
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229616	GD	On-Demand	Anodyne	ADRB3	46	41
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229617	GD	On-Demand	Anodyne	ADRB2	38	44
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229617	GD	On-Demand	Anodyne	ADRB1	62	44
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229617	GD	On-Demand	Anodyne	ADRB3	46	41
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229618	GD	On-Demand	Anodyne	ADRB2	38	44
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229618	GD	On-Demand	Anodyne	ADRB1	62	44
O=C1OC[C@]2(CNC[C@H](O)COc3ccc(-c4ccccc4)cc3)COCCN12	ZINC000872229618	GD	On-Demand	Anodyne	ADRB3	46	41
O=C(CCNC[C@@]12COCCN1C(=O)OC2)Nc1cccc(Cl)c1	ZINC000872229637	FD	On-Demand	Anodyne	EPHX2	15	40
O=C(CCNC[C@]12COCCN1C(=O)OC2)Nc1cccc(Cl)c1	ZINC000872229638	FD	On-Demand	Anodyne	EPHX2	15	40
CSc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229640	FC	On-Demand	Anodyne	ADRB2	20	43
CSc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229640	FC	On-Demand	Anodyne	ADRB1	41	43
CSc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229641	FC	On-Demand	Anodyne	ADRB2	20	43
CSc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229641	FC	On-Demand	Anodyne	ADRB1	41	43
CSc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229642	FC	On-Demand	Anodyne	ADRB2	20	43
CSc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229642	FC	On-Demand	Anodyne	ADRB1	41	43
CSc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229643	FC	On-Demand	Anodyne	ADRB2	20	43
CSc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229643	FC	On-Demand	Anodyne	ADRB1	41	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229650	FC	On-Demand	Anodyne	ADRB2	21	46
CC(=O)c1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229650	FC	On-Demand	Anodyne	ADRB1	47	46
CC(=O)c1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229650	FC	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229651	FC	On-Demand	Anodyne	ADRB2	21	46
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229651	FC	On-Demand	Anodyne	ADRB1	47	46
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872229651	FC	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229652	FC	On-Demand	Anodyne	ADRB2	21	46
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229652	FC	On-Demand	Anodyne	ADRB1	47	46
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229652	FC	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229653	FC	On-Demand	Anodyne	ADRB2	21	46
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229653	FC	On-Demand	Anodyne	ADRB1	47	46
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872229653	FC	On-Demand	Anodyne	ABCB1	15	51
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229709	GF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229709	GF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229709	GF	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229710	GF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229710	GF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229710	GF	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229712	GF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229712	GF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229712	GF	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229713	GF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229713	GF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229713	GF	On-Demand	Anodyne	ADRB3	48	43
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1cccc(C(F)(F)F)c1	ZINC000872229720	FG	On-Demand	Anodyne	PDS	43	38
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc(C(F)(F)F)c1	ZINC000872229721	FG	On-Demand	Anodyne	PDS	43	38
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1cccc(C(F)(F)F)c1	ZINC000872229722	FG	On-Demand	Anodyne	PDS	43	38
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc(C(F)(F)F)c1	ZINC000872229724	FG	On-Demand	Anodyne	PDS	43	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229725	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229725	EE	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229725	EE	On-Demand	Anodyne	ADRB3	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229727	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229727	EE	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229727	EE	On-Demand	Anodyne	ADRB3	28	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229728	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229728	EE	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229728	EE	On-Demand	Anodyne	ADRB3	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229730	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229730	EE	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229730	EE	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1F	ZINC000872229737	DE	On-Demand	Anodyne	ADRB1	40	36
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1F	ZINC000872229738	DE	On-Demand	Anodyne	ADRB1	40	36
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccccc1F	ZINC000872229739	DE	On-Demand	Anodyne	ADRB1	40	36
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccccc1F	ZINC000872229741	DE	On-Demand	Anodyne	ADRB1	40	36
O[C@]1(CNC[C@H]2CCC23CCOCC3)CCN(Cc2ccccc2)C1	ZINC000872229746	EE	On-Demand	Anodyne	SIGMAR1	46	37
O[C@]1(CNC[C@@H]2CCC23CCOCC3)CCN(Cc2ccccc2)C1	ZINC000872229747	EE	On-Demand	Anodyne	SIGMAR1	46	37
O[C@@]1(CNC[C@@H]2CCC23CCOCC3)CCN(Cc2ccccc2)C1	ZINC000872229748	EE	On-Demand	Anodyne	SIGMAR1	46	37
N#CCCN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872229749	CD	On-Demand	Mild	CTSS	15	42
O[C@@]1(CNC[C@H]2CCC23CCOCC3)CCN(Cc2ccccc2)C1	ZINC000872229750	EE	On-Demand	Anodyne	SIGMAR1	46	37
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3C(F)(F)F)COCCN12	ZINC000872229752	GD	On-Demand	Anodyne	ADRB1	45	33
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229754	FE	On-Demand	Anodyne	ADRB2	33	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229754	FE	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229754	FE	On-Demand	Anodyne	ADRB3	47	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229755	FE	On-Demand	Anodyne	ADRB2	33	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229755	FE	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229755	FE	On-Demand	Anodyne	ADRB3	47	50
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3C(F)(F)F)COCCN12	ZINC000872229756	GD	On-Demand	Anodyne	ADRB1	45	33
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229757	FE	On-Demand	Anodyne	ADRB2	33	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229757	FE	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872229757	FE	On-Demand	Anodyne	ADRB3	47	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229758	FE	On-Demand	Anodyne	ADRB2	33	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229758	FE	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872229758	FE	On-Demand	Anodyne	ADRB3	47	50
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3C(F)(F)F)COCCN12	ZINC000872229759	GD	On-Demand	Anodyne	ADRB1	45	33
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3C(F)(F)F)COCCN12	ZINC000872229763	GD	On-Demand	Anodyne	ADRB1	45	33
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229776	EF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229776	EF	On-Demand	Anodyne	ADRB1	41	41
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229777	EF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229777	EF	On-Demand	Anodyne	ADRB1	41	41
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229778	EF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229778	EF	On-Demand	Anodyne	ADRB1	41	41
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229780	EF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1ccc(Cl)cc1	ZINC000872229780	EF	On-Demand	Anodyne	ADRB1	41	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2C)on1	ZINC000872229811	ED	On-Demand	Anodyne	ADRB2	27	59
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2C)on1	ZINC000872229811	ED	On-Demand	Anodyne	ADRB1	58	33
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2C)on1	ZINC000872229811	ED	On-Demand	Anodyne	ABCB1	32	40
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2C)on1	ZINC000872229812	ED	On-Demand	Anodyne	ADRB2	27	59
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2C)on1	ZINC000872229812	ED	On-Demand	Anodyne	ADRB1	58	33
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2C)on1	ZINC000872229812	ED	On-Demand	Anodyne	ABCB1	32	40
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229825	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229825	FE	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229825	FE	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229826	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229826	FE	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872229826	FE	On-Demand	Anodyne	ADRB3	45	49
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc(Cl)c1	ZINC000872229871	EI	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc(Cl)c1	ZINC000872229871	EI	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc(Cl)c1	ZINC000872229872	EI	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc(Cl)c1	ZINC000872229872	EI	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2ccccc12	ZINC000872229873	FF	On-Demand	Anodyne	ADRB2	18	50
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2ccccc12	ZINC000872229874	FF	On-Demand	Anodyne	ADRB2	18	50
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2ccccc12	ZINC000872229875	FF	On-Demand	Anodyne	ADRB2	18	50
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2ccccc12	ZINC000872229876	FF	On-Demand	Anodyne	ADRB2	18	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872229903	EF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872229903	EF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872229904	EF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872229904	EF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872229905	EF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872229905	EF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872229906	EF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872229906	EF	On-Demand	Anodyne	ADRB1	51	39
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229932	EF	On-Demand	Anodyne	ADRB2	15	58
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229932	EF	On-Demand	Anodyne	ADRB1	20	58
O[C@@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229932	EF	On-Demand	Anodyne	SLC6A4	15	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229933	EF	On-Demand	Anodyne	ADRB2	15	58
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229933	EF	On-Demand	Anodyne	ADRB1	20	58
O[C@@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229933	EF	On-Demand	Anodyne	SLC6A4	15	40
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229934	EF	On-Demand	Anodyne	ADRB2	15	58
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229934	EF	On-Demand	Anodyne	ADRB1	20	58
O[C@H](CNC[C@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229934	EF	On-Demand	Anodyne	SLC6A4	15	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229935	EF	On-Demand	Anodyne	ADRB2	15	58
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229935	EF	On-Demand	Anodyne	ADRB1	20	58
O[C@H](CNC[C@@H]1CCC12CCOCC2)COc1cccc2[nH]ccc12	ZINC000872229935	EF	On-Demand	Anodyne	SLC6A4	15	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)OC3)c1	ZINC000872229952	FC	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)OC3)c1	ZINC000872229955	FC	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)OC3)c1	ZINC000872229956	FC	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)OC3)c1	ZINC000872229959	FC	On-Demand	Anodyne	ABCB1	21	47
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA2	73	49
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	AVPR2	58	38
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA1	62	49
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA7	41	36
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA4	61	49
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA5A	40	34
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA12	42	37
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CA9	45	46
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	CYNT	23	43
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	MTCA1	47	42
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	P96878_MYCTU	59	42
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872229964	JF	On-Demand	Anodyne	L3MBTL3	88	40
CCOC(=O)c1cc(CNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)on1	ZINC000872230013	GF	On-Demand	Anodyne	CYNT	30	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2Cl)on1	ZINC000872230020	FE	On-Demand	Anodyne	ADRB2	26	58
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2Cl)on1	ZINC000872230020	FE	On-Demand	Anodyne	ADRB1	54	33
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2Cl)on1	ZINC000872230022	FE	On-Demand	Anodyne	ADRB2	26	58
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2Cl)on1	ZINC000872230022	FE	On-Demand	Anodyne	ADRB1	54	33
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230039	ED	On-Demand	Anodyne	ADRB2	36	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230039	ED	On-Demand	Anodyne	ADRB1	46	38
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230039	ED	On-Demand	Anodyne	ADRB3	31	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230041	ED	On-Demand	Anodyne	ADRB2	36	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230041	ED	On-Demand	Anodyne	ADRB1	46	38
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230041	ED	On-Demand	Anodyne	ADRB3	31	43
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3F)COCCN12	ZINC000872230050	EC	On-Demand	Anodyne	ADRB1	45	39
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3F)COCCN12	ZINC000872230052	EC	On-Demand	Anodyne	ADRB1	45	39
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3F)COCCN12	ZINC000872230054	EC	On-Demand	Anodyne	ADRB1	45	39
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3F)COCCN12	ZINC000872230056	EC	On-Demand	Anodyne	ADRB1	45	39
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	AVPR2	74	44
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	AVPR1A	38	44
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	F10	18	46
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	CPT1A	58	42
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	CPT2	44	33
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	EPHX2	17	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	F13A1	42	39
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872230082	HF	On-Demand	Anodyne	L3MBTL3	80	41
CCOC(=O)c1cc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)on1	ZINC000872230087	GF	On-Demand	Anodyne	KIT	15	40
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230090	FE	On-Demand	Anodyne	ADRB2	41	56
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230090	FE	On-Demand	Anodyne	ADRB1	67	56
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230090	FE	On-Demand	Anodyne	ADRB3	46	44
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230091	FE	On-Demand	Anodyne	ADRB2	41	56
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230091	FE	On-Demand	Anodyne	ADRB1	67	56
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230091	FE	On-Demand	Anodyne	ADRB3	46	44
CCOC(=O)c1cc(CNC[C@H](O)COc2c(Cl)cccc2Cl)on1	ZINC000872230097	GF	On-Demand	Anodyne	ADRB2	17	45
CCOC(=O)c1cc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)on1	ZINC000872230098	GF	On-Demand	Anodyne	ADRB2	17	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230099	FD	On-Demand	Anodyne	ADRB2	27	45
O=C1OC[C@@]2(CNC[C@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230099	FD	On-Demand	Anodyne	ADRB1	39	41
O=C1OC[C@]2(CNC[C@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230100	FD	On-Demand	Anodyne	ADRB2	27	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230100	FD	On-Demand	Anodyne	ADRB1	39	41
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230101	FD	On-Demand	Anodyne	ADRB2	27	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230101	FD	On-Demand	Anodyne	ADRB1	39	41
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230102	FD	On-Demand	Anodyne	ADRB2	27	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccc4ccccc4c3)COCCN12	ZINC000872230102	FD	On-Demand	Anodyne	ADRB1	39	41
CN(CCC#N)C[C@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872230113	FC	On-Demand	Mild	CTSS	15	41
CN(CCC#N)C[C@@H](O)CN[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872230114	FC	On-Demand	Mild	CTSS	15	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872230196	DF	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872230196	DF	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872230197	DF	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872230197	DF	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872230198	DF	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)cc1	ZINC000872230198	DF	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872230199	DF	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)cc1	ZINC000872230199	DF	On-Demand	Anodyne	ADRB1	44	41
O[C@H](CNC[C@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230240	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNC[C@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230240	DG	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNC[C@@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230241	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNC[C@@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230241	DG	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNC[C@@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230242	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNC[C@@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230242	DG	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNC[C@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230243	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNC[C@H]1CCC12CCOCC2)c1cccc(Cl)c1	ZINC000872230243	DG	On-Demand	Anodyne	ADRB3	40	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230319	FE	On-Demand	Anodyne	ADRB2	41	47
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230319	FE	On-Demand	Anodyne	ADRB1	60	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230319	FE	On-Demand	Anodyne	GRIN1	18	43
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230320	FE	On-Demand	Anodyne	ADRB2	41	47
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230320	FE	On-Demand	Anodyne	ADRB1	60	41
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)cc2)on1	ZINC000872230320	FE	On-Demand	Anodyne	GRIN1	18	43
O=C1OC[C@@]2(CNC[C@H](O)COc3ccccc3Cl)COCCN12	ZINC000872230327	FC	On-Demand	Anodyne	ADRB2	20	45
O=C1OC[C@]2(CNC[C@H](O)COc3ccccc3Cl)COCCN12	ZINC000872230328	FC	On-Demand	Anodyne	ADRB2	20	45
O=C1OC[C@@]2(CNC[C@@H](O)COc3ccccc3Cl)COCCN12	ZINC000872230329	FC	On-Demand	Anodyne	ADRB2	20	45
O=C1OC[C@]2(CNC[C@@H](O)COc3ccccc3Cl)COCCN12	ZINC000872230330	FC	On-Demand	Anodyne	ADRB2	20	45
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230335	FF	On-Demand	Anodyne	ADRB2	42	48
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230335	FF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230335	FF	On-Demand	Anodyne	ADRB3	33	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230336	FF	On-Demand	Anodyne	ADRB2	42	48
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230336	FF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc3ccccc3c2)on1	ZINC000872230336	FF	On-Demand	Anodyne	ADRB3	33	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230337	GF	On-Demand	Anodyne	ADRB2	43	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230337	GF	On-Demand	Anodyne	ADRB1	73	49
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230337	GF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230337	GF	On-Demand	Anodyne	ABCB1	26	47
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230338	GF	On-Demand	Anodyne	ADRB2	43	41
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230338	GF	On-Demand	Anodyne	ADRB1	73	49
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230338	GF	On-Demand	Anodyne	ADRB3	53	43
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)cc1	ZINC000872230338	GF	On-Demand	Anodyne	ABCB1	26	47
CCOC(=O)c1cc(CNC[C@H](O)COc2ccc(C)cc2C)on1	ZINC000872230362	ED	On-Demand	Anodyne	ADRB2	17	45
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccc(C)cc2C)on1	ZINC000872230363	ED	On-Demand	Anodyne	ADRB2	17	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230376	EE	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230376	EE	On-Demand	Anodyne	ADRB1	38	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230376	EE	On-Demand	Anodyne	ADRB3	29	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230376	EE	On-Demand	Anodyne	ABCB1	17	43
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230377	EE	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230377	EE	On-Demand	Anodyne	ADRB1	38	40
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230377	EE	On-Demand	Anodyne	ADRB3	29	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(N(C)C)CC2)c1	ZINC000872230377	EE	On-Demand	Anodyne	ABCB1	17	43
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2F)on1	ZINC000872230388	ED	On-Demand	Anodyne	ADRB2	24	49
CCOC(=O)c1cc(CNC[C@@H](O)COc2ccccc2F)on1	ZINC000872230388	ED	On-Demand	Anodyne	ADRB1	57	37
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2F)on1	ZINC000872230389	ED	On-Demand	Anodyne	ADRB2	24	49
CCOC(=O)c1cc(CNC[C@H](O)COc2ccccc2F)on1	ZINC000872230389	ED	On-Demand	Anodyne	ADRB1	57	37
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)c1	ZINC000872230456	EE	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCC23CCOCC3)c1	ZINC000872230456	EE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)c1	ZINC000872230457	EE	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCC23CCOCC3)c1	ZINC000872230457	EE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)c1	ZINC000872230458	EE	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCC23CCOCC3)c1	ZINC000872230458	EE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)c1	ZINC000872230459	EE	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCC23CCOCC3)c1	ZINC000872230459	EE	On-Demand	Anodyne	ABCB1	15	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230466	FD	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230466	FD	On-Demand	Anodyne	ADRB1	50	39
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230466	FD	On-Demand	Anodyne	ADRB3	35	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230467	FD	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230467	FD	On-Demand	Anodyne	ADRB1	50	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000872230467	FD	On-Demand	Anodyne	ADRB3	35	43
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230556	ED	On-Demand	Anodyne	ADRB2	31	48
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230556	ED	On-Demand	Anodyne	ADRB1	30	45
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230556	ED	On-Demand	Anodyne	ADRB3	119	57
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230557	ED	On-Demand	Anodyne	ADRB2	31	48
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230557	ED	On-Demand	Anodyne	ADRB1	30	45
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230557	ED	On-Demand	Anodyne	ADRB3	119	57
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230558	ED	On-Demand	Anodyne	ADRB2	31	48
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230558	ED	On-Demand	Anodyne	ADRB1	30	45
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230558	ED	On-Demand	Anodyne	ADRB3	119	57
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230559	ED	On-Demand	Anodyne	ADRB2	31	48
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230559	ED	On-Demand	Anodyne	ADRB1	30	45
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872230559	ED	On-Demand	Anodyne	ADRB3	119	57
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872230563	EE	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872230563	EE	On-Demand	Anodyne	ADRB1	64	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872230563	EE	On-Demand	Anodyne	ADRB3	41	45
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872230564	EE	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872230564	EE	On-Demand	Anodyne	ADRB1	64	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872230564	EE	On-Demand	Anodyne	ADRB3	41	45
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872230565	EE	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872230565	EE	On-Demand	Anodyne	ADRB1	64	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872230565	EE	On-Demand	Anodyne	ADRB3	41	45
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872230566	EE	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872230566	EE	On-Demand	Anodyne	ADRB1	64	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872230566	EE	On-Demand	Anodyne	ADRB3	41	45
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872230567	FH	On-Demand	Anodyne	ADRB1	22	54
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872230568	FH	On-Demand	Anodyne	ADRB1	22	54
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccc(F)cc1	ZINC000872230581	EG	On-Demand	Anodyne	ADRB1	47	41
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccc(F)cc1	ZINC000872230582	EG	On-Demand	Anodyne	ADRB1	47	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230638	GD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230638	GD	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230638	GD	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230639	GD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230639	GD	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230639	GD	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230640	GD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230640	GD	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230640	GD	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230641	GD	On-Demand	Anodyne	ADRB2	24	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230641	GD	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230641	GD	On-Demand	Anodyne	ADRB3	29	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230643	GD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230643	GD	On-Demand	Anodyne	ADRB1	66	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230643	GD	On-Demand	Anodyne	ADRB3	42	47
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230644	GD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230644	GD	On-Demand	Anodyne	ADRB1	66	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230644	GD	On-Demand	Anodyne	ADRB3	42	47
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230645	GD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230645	GD	On-Demand	Anodyne	ADRB1	66	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230645	GD	On-Demand	Anodyne	ADRB3	42	47
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230646	GD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230646	GD	On-Demand	Anodyne	ADRB1	66	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872230646	GD	On-Demand	Anodyne	ADRB3	42	47
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872230674	FG	On-Demand	Bother	ADRB1	43	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872230675	FG	On-Demand	Bother	ADRB1	43	33
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230711	FE	On-Demand	Anodyne	ADRB1	18	54
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230711	FE	On-Demand	Anodyne	HTR1A	15	54
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230711	FE	On-Demand	Anodyne	SLC6A4	15	40
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230712	FE	On-Demand	Anodyne	ADRB1	18	54
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230712	FE	On-Demand	Anodyne	HTR1A	15	54
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230712	FE	On-Demand	Anodyne	SLC6A4	15	40
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230713	FE	On-Demand	Anodyne	ADRB1	18	54
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230713	FE	On-Demand	Anodyne	HTR1A	15	54
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230713	FE	On-Demand	Anodyne	SLC6A4	15	40
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230714	FE	On-Demand	Anodyne	ADRB1	18	54
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230714	FE	On-Demand	Anodyne	HTR1A	15	54
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc2[nH]ccc12	ZINC000872230714	FE	On-Demand	Anodyne	SLC6A4	15	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000872230738	EE	On-Demand	Bother	ADRB1	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000872230739	EE	On-Demand	Bother	ADRB1	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000872230740	EE	On-Demand	Bother	ADRB1	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000872230741	EE	On-Demand	Bother	ADRB1	15	44
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230785	ED	On-Demand	Mild	ADRB1	63	44
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230785	ED	On-Demand	Mild	CASR	40	41
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230785	ED	On-Demand	Mild	CYP2D6	17	41
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230786	ED	On-Demand	Mild	ADRB1	63	44
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230786	ED	On-Demand	Mild	CASR	40	41
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]1C1CCOCC1	ZINC000872230786	ED	On-Demand	Mild	CYP2D6	17	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	AVPR2	47	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	AVPR1A	27	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	PRNP	46	34
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	MLYCD	18	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(C2SCCCS2)cc1	ZINC000872230846	HK	On-Demand	Anodyne	L3MBTL3	86	43
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc(C(F)(F)F)c1	ZINC000872230848	GF	On-Demand	Anodyne	PDS	41	35
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1cccc(C(F)(F)F)c1	ZINC000872230849	GF	On-Demand	Anodyne	PDS	41	35
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc(C(F)(F)F)c1	ZINC000872230850	GF	On-Demand	Anodyne	PDS	41	35
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1cccc(C(F)(F)F)c1	ZINC000872230851	GF	On-Demand	Anodyne	PDS	41	35
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1F	ZINC000872230857	EG	On-Demand	Anodyne	ADRB1	51	37
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1F	ZINC000872230858	EG	On-Demand	Anodyne	ADRB1	51	37
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc2ccccc2c1	ZINC000872230866	FF	On-Demand	Anodyne	ADRB2	17	47
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc2ccccc2c1	ZINC000872230867	FF	On-Demand	Anodyne	ADRB2	17	47
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc2ccccc2c1	ZINC000872230868	FF	On-Demand	Anodyne	ADRB2	17	47
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc2ccccc2c1	ZINC000872230869	FF	On-Demand	Anodyne	ADRB2	17	47
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872230887	FG	On-Demand	Anodyne	ADRB1	52	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872230888	FG	On-Demand	Anodyne	ADRB1	52	38
C[C@H](CNCCS(C)(=O)=O)c1ccc(S(C)(=O)=O)cc1	ZINC000872230907	DC	On-Demand	Anodyne	GRIA4	20	45
C[C@@H](CNCCS(C)(=O)=O)c1ccc(S(C)(=O)=O)cc1	ZINC000872230908	DC	On-Demand	Anodyne	GRIA4	20	45
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)c1cccc(Cl)c1	ZINC000872230918	EF	On-Demand	Anodyne	CYP3A4	47	38
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)c1cccc(Cl)c1	ZINC000872230919	EF	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)c1cccc(Cl)c1	ZINC000872230920	EF	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)c1cccc(Cl)c1	ZINC000872230921	EF	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230928	GG	On-Demand	Anodyne	ADRB2	29	40
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230928	GG	On-Demand	Anodyne	ADRB1	44	37
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230929	GG	On-Demand	Anodyne	ADRB2	29	40
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230929	GG	On-Demand	Anodyne	ADRB1	44	37
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230930	GG	On-Demand	Anodyne	ADRB2	29	40
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230930	GG	On-Demand	Anodyne	ADRB1	44	37
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230931	GG	On-Demand	Anodyne	ADRB2	29	40
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(-c2ccccc2)cc1	ZINC000872230931	GG	On-Demand	Anodyne	ADRB1	44	37
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Cl)cc1	ZINC000872230933	EF	On-Demand	Anodyne	ADRB1	36	41
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Cl)cc1	ZINC000872230934	EF	On-Demand	Anodyne	ADRB1	36	41
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC8	20	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC10	41	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC1	15	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC2	28	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC3	26	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC6	30	47
O=C(CCNCCCCC1CC1)Nc1ccccc1	ZINC000872230967	CG	On-Demand	Anodyne	HDAC11	32	47
COc1ccccc1COC[C@@H](O)CNCc1ccc(C)c([N+](=O)[O-])c1	ZINC000872230986	FF	On-Demand	Bother	ADRB1	18	42
COc1ccccc1COC[C@H](O)CNCc1ccc(C)c([N+](=O)[O-])c1	ZINC000872230987	FF	On-Demand	Bother	ADRB1	18	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCC2CC2)cc1	ZINC000872231027	DE	On-Demand	Anodyne	ADRB2	38	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCC2CC2)cc1	ZINC000872231027	DE	On-Demand	Anodyne	ADRB3	54	39
CS(=O)(=O)c1ccc([C@H](O)CNCCCCC2CC2)cc1	ZINC000872231028	DE	On-Demand	Anodyne	ADRB2	38	48
CS(=O)(=O)c1ccc([C@H](O)CNCCCCC2CC2)cc1	ZINC000872231028	DE	On-Demand	Anodyne	ADRB3	54	39
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872231168	EE	On-Demand	Anodyne	ADRB2	38	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872231168	EE	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872231168	EE	On-Demand	Anodyne	ADRB3	47	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872231169	EE	On-Demand	Anodyne	ADRB2	38	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872231169	EE	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872231169	EE	On-Demand	Anodyne	ADRB3	47	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872231170	EE	On-Demand	Anodyne	ADRB2	38	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872231170	EE	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872231170	EE	On-Demand	Anodyne	ADRB3	47	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872231171	EE	On-Demand	Anodyne	ADRB2	38	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872231171	EE	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872231171	EE	On-Demand	Anodyne	ADRB3	47	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231188	GG	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231188	GG	On-Demand	Anodyne	ADRB1	76	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231188	GG	On-Demand	Anodyne	ADRB3	46	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231189	GG	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231189	GG	On-Demand	Anodyne	ADRB1	76	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231189	GG	On-Demand	Anodyne	ADRB3	46	51
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Br)cc1	ZINC000872231217	GF	On-Demand	Anodyne	ADRB1	33	41
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Br)cc1	ZINC000872231219	GF	On-Demand	Anodyne	ADRB1	33	41
COc1ccc(OC)c([C@H](O)CNCCCCC2CC2)c1	ZINC000872231233	CF	On-Demand	Anodyne	ADRB2	27	46
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231276	GF	On-Demand	Anodyne	ADRB3	29	45
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231276	GF	On-Demand	Anodyne	TRPV1	82	35
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231277	GF	On-Demand	Anodyne	ADRB3	29	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231277	GF	On-Demand	Anodyne	TRPV1	82	35
COC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231282	EE	On-Demand	Anodyne	ADRB2	52	48
COC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231282	EE	On-Demand	Anodyne	ADRB1	76	48
COC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231282	EE	On-Demand	Anodyne	ADRB3	47	48
COC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231283	EE	On-Demand	Anodyne	ADRB2	52	48
COC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231283	EE	On-Demand	Anodyne	ADRB1	76	48
COC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231283	EE	On-Demand	Anodyne	ADRB3	47	48
CCOc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231304	EG	On-Demand	Anodyne	ADRB2	48	46
CCOc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231304	EG	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231304	EG	On-Demand	Anodyne	ADRB3	32	43
CCOc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231305	EG	On-Demand	Anodyne	ADRB2	48	46
CCOc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231305	EG	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231305	EG	On-Demand	Anodyne	ADRB3	32	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231367	DE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231367	DE	On-Demand	Anodyne	ADRB1	38	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231368	DE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231368	DE	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231381	EE	On-Demand	Anodyne	ADRB2	20	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231381	EE	On-Demand	Anodyne	ADRB1	45	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231381	EE	On-Demand	Anodyne	ADRB3	25	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231382	EE	On-Demand	Anodyne	ADRB2	20	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231382	EE	On-Demand	Anodyne	ADRB1	45	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872231382	EE	On-Demand	Anodyne	ADRB3	25	40
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231394	DE	On-Demand	Mild	ADRB2	15	53
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231394	DE	On-Demand	Mild	ADRB1	66	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231394	DE	On-Demand	Mild	CASR	40	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231394	DE	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231395	DE	On-Demand	Mild	ADRB2	15	53
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231395	DE	On-Demand	Mild	ADRB1	66	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231395	DE	On-Demand	Mild	CASR	40	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231395	DE	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231396	DE	On-Demand	Mild	ADRB2	15	53
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231396	DE	On-Demand	Mild	ADRB1	66	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231396	DE	On-Demand	Mild	CASR	40	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231396	DE	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231397	DE	On-Demand	Mild	ADRB2	15	53
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231397	DE	On-Demand	Mild	ADRB1	66	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231397	DE	On-Demand	Mild	CASR	40	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231397	DE	On-Demand	Mild	CYP2D6	17	43
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231418	DD	On-Demand	Anodyne	ADRB2	30	45
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231418	DD	On-Demand	Anodyne	ADRB1	45	39
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231419	DD	On-Demand	Anodyne	ADRB2	30	45
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231419	DD	On-Demand	Anodyne	ADRB1	45	39
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231420	DD	On-Demand	Anodyne	ADRB2	30	45
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231420	DD	On-Demand	Anodyne	ADRB1	45	39
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231422	DD	On-Demand	Anodyne	ADRB2	30	45
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccccc1	ZINC000872231422	DD	On-Demand	Anodyne	ADRB1	45	39
O=C1CCc2cc(OC[C@@H](O)CNCCCCC3CC3)ccc2N1	ZINC000872231437	EE	On-Demand	Anodyne	ADRB1	52	39
O=C1CCc2cc(OC[C@@H](O)CNCCCCC3CC3)ccc2N1	ZINC000872231437	EE	On-Demand	Anodyne	ADRB3	32	40
O=C1CCc2cc(OC[C@H](O)CNCCCCC3CC3)ccc2N1	ZINC000872231439	EE	On-Demand	Anodyne	ADRB1	52	39
O=C1CCc2cc(OC[C@H](O)CNCCCCC3CC3)ccc2N1	ZINC000872231439	EE	On-Demand	Anodyne	ADRB3	32	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCC2CC2)c1	ZINC000872231464	CF	On-Demand	Bother	ADRB1	46	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCC2CC2)c1	ZINC000872231464	CF	On-Demand	Bother	ADRB3	56	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCCC2CC2)c1	ZINC000872231465	CF	On-Demand	Bother	ADRB1	46	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCCC2CC2)c1	ZINC000872231465	CF	On-Demand	Bother	ADRB3	56	38
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872231518	EF	On-Demand	Anodyne	ADRB2	15	44
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872231519	EF	On-Demand	Anodyne	ADRB2	15	44
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231521	EF	On-Demand	Anodyne	ADRB2	41	47
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231521	EF	On-Demand	Anodyne	ADRB1	57	41
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231521	EF	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231521	EF	On-Demand	Anodyne	PDS	61	34
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231522	EF	On-Demand	Anodyne	ADRB2	41	47
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231522	EF	On-Demand	Anodyne	ADRB1	57	41
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231522	EF	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c1	ZINC000872231522	EF	On-Demand	Anodyne	PDS	61	34
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872231525	EE	On-Demand	Anodyne	ADRB2	15	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872231526	EE	On-Demand	Anodyne	ADRB2	15	40
CC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231530	EF	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231530	EF	On-Demand	Anodyne	ADRB1	72	46
CC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231530	EF	On-Demand	Anodyne	ADRB3	39	45
CC(=O)c1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231530	EF	On-Demand	Anodyne	ABCB1	15	57
CC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231531	EF	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231531	EF	On-Demand	Anodyne	ADRB1	72	46
CC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231531	EF	On-Demand	Anodyne	ADRB3	39	45
CC(=O)c1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231531	EF	On-Demand	Anodyne	ABCB1	15	57
O=C(COc1ccc(C2SCCCS2)cc1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872231566	IJ	On-Demand	Anodyne	L3MBTL3	58	34
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231580	DE	On-Demand	Anodyne	ADRB2	36	48
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231580	DE	On-Demand	Anodyne	ADRB1	59	41
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231580	DE	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231582	DE	On-Demand	Anodyne	ADRB2	36	48
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231582	DE	On-Demand	Anodyne	ADRB1	59	41
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872231582	DE	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNCCSCCC(F)(F)F)c1cccc(F)c1	ZINC000872231599	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCCSCCC(F)(F)F)c1cccc(F)c1	ZINC000872231599	DG	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNCCSCCC(F)(F)F)c1cccc(F)c1	ZINC000872231601	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCCSCCC(F)(F)F)c1cccc(F)c1	ZINC000872231601	DG	On-Demand	Anodyne	ADRB3	24	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872231643	ED	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872231644	ED	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872231646	ED	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872231648	ED	On-Demand	Anodyne	ADRB2	20	44
CSc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231655	EG	On-Demand	Anodyne	ADRB2	36	43
CSc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231655	EG	On-Demand	Anodyne	ADRB1	47	40
CSc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231655	EG	On-Demand	Anodyne	ADRB3	25	40
CSc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231656	EG	On-Demand	Anodyne	ADRB2	36	43
CSc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231656	EG	On-Demand	Anodyne	ADRB1	47	40
CSc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231656	EG	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNCCSCCC(F)(F)F)c1cccc(Cl)c1	ZINC000872231675	EH	On-Demand	Anodyne	ADRB1	43	50
O[C@H](CNCCSCCC(F)(F)F)c1cccc(Cl)c1	ZINC000872231675	EH	On-Demand	Anodyne	ADRB3	54	50
O[C@@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(Cl)c(Cl)c1	ZINC000872231689	GF	On-Demand	Anodyne	GRIN1	19	44
O[C@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(Cl)c(Cl)c1	ZINC000872231690	GF	On-Demand	Anodyne	GRIN1	19	44
O[C@@H](CNCCSCCC(F)(F)F)c1cccc(Cl)c1	ZINC000872231691	EH	On-Demand	Anodyne	ADRB1	43	50
O[C@@H](CNCCSCCC(F)(F)F)c1cccc(Cl)c1	ZINC000872231691	EH	On-Demand	Anodyne	ADRB3	54	50
O[C@H](CNC[C@H]1CC2(CCOCC2)CO1)COc1ccc(Cl)c(Cl)c1	ZINC000872231692	GF	On-Demand	Anodyne	GRIN1	19	44
O[C@@H](CNC[C@@H]1CC2(CCOCC2)CO1)COc1ccc(Cl)c(Cl)c1	ZINC000872231694	GF	On-Demand	Anodyne	GRIN1	19	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000872231701	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000872231702	FG	On-Demand	Anodyne	ADRB2	19	41
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231704	FG	On-Demand	Mild	ADRB2	15	52
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231704	FG	On-Demand	Mild	ADRB1	67	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231704	FG	On-Demand	Mild	CASR	45	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231704	FG	On-Demand	Mild	CYP2D6	19	46
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231705	FG	On-Demand	Mild	ADRB2	15	52
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231705	FG	On-Demand	Mild	ADRB1	67	48
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231705	FG	On-Demand	Mild	CASR	45	46
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000872231705	FG	On-Demand	Mild	CYP2D6	19	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)C(C)(F)F)CC1	ZINC000872231709	FG	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)C(C)(F)F)CC1	ZINC000872231711	FG	On-Demand	Anodyne	GPR119	32	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231719	EF	On-Demand	Anodyne	ADRB2	55	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231719	EF	On-Demand	Anodyne	ADRB1	90	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231719	EF	On-Demand	Anodyne	GRIN1	25	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231719	EF	On-Demand	Anodyne	ADRB3	54	58
CC(=O)Nc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231720	EF	On-Demand	Anodyne	ADRB2	55	62
CC(=O)Nc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231720	EF	On-Demand	Anodyne	ADRB1	90	62
CC(=O)Nc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231720	EF	On-Demand	Anodyne	GRIN1	25	43
CC(=O)Nc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872231720	EF	On-Demand	Anodyne	ADRB3	54	58
Cc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c(C)c1	ZINC000872231733	DG	On-Demand	Anodyne	ADRB2	24	48
Cc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)c(C)c1	ZINC000872231733	DG	On-Demand	Anodyne	VDR	17	40
Cc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c(C)c1	ZINC000872231734	DG	On-Demand	Anodyne	ADRB2	24	48
Cc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)c(C)c1	ZINC000872231734	DG	On-Demand	Anodyne	VDR	17	40
O[C@@H](CNCCSCCC(F)(F)F)Cc1cccc(Cl)c1	ZINC000872231736	EH	On-Demand	Anodyne	ADRB1	18	42
O[C@H](CNCCSCCC(F)(F)F)Cc1cccc(Cl)c1	ZINC000872231737	EH	On-Demand	Anodyne	ADRB1	18	42
N#Cc1ccc(OC[C@@H](O)CNCCCCC2CC2)cc1	ZINC000872231738	CE	On-Demand	Mild	ADRB2	46	44
N#Cc1ccc(OC[C@@H](O)CNCCCCC2CC2)cc1	ZINC000872231738	CE	On-Demand	Mild	ADRB1	76	44
N#Cc1ccc(OC[C@@H](O)CNCCCCC2CC2)cc1	ZINC000872231738	CE	On-Demand	Mild	ADRB3	45	44
N#Cc1ccc(OC[C@H](O)CNCCCCC2CC2)cc1	ZINC000872231739	CE	On-Demand	Mild	ADRB2	46	44
N#Cc1ccc(OC[C@H](O)CNCCCCC2CC2)cc1	ZINC000872231739	CE	On-Demand	Mild	ADRB1	76	44
N#Cc1ccc(OC[C@H](O)CNCCCCC2CC2)cc1	ZINC000872231739	CE	On-Demand	Mild	ADRB3	45	44
O=C(CN1C(=O)CCOc2ccccc21)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872231754	GF	On-Demand	Anodyne	AVPR2	47	45
COc1cccc(OC)c1OC[C@H](O)CNCC(C)(C)C(C)(F)F	ZINC000872231771	EF	On-Demand	Anodyne	ADRB2	31	44
COc1cccc(OC)c1OC[C@@H](O)CNCC(C)(C)C(C)(F)F	ZINC000872231772	EF	On-Demand	Anodyne	ADRB2	31	44
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231777	EG	On-Demand	Anodyne	ADRB2	39	50
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231777	EG	On-Demand	Anodyne	ADRB1	62	43
O[C@@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231777	EG	On-Demand	Anodyne	ADRB3	38	43
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231779	EG	On-Demand	Anodyne	ADRB2	39	50
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231779	EG	On-Demand	Anodyne	ADRB1	62	43
O[C@H](CNC[C@@H]1CC=CC[C@H]1C(F)(F)F)COc1ccccc1	ZINC000872231779	EG	On-Demand	Anodyne	ADRB3	38	43
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000872231791	FG	On-Demand	Anodyne	PDS	42	36
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000872231792	FG	On-Demand	Anodyne	PDS	42	36
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231800	FG	On-Demand	Mild	ADRB1	48	39
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872231801	FG	On-Demand	Mild	ADRB1	48	39
N#Cc1ccccc1OC[C@@H](O)CNCCCCC1CC1	ZINC000872231833	CE	On-Demand	Mild	ADRB2	34	56
N#Cc1ccccc1OC[C@@H](O)CNCCCCC1CC1	ZINC000872231833	CE	On-Demand	Mild	ADRB1	81	56
N#Cc1ccccc1OC[C@@H](O)CNCCCCC1CC1	ZINC000872231833	CE	On-Demand	Mild	ADRB3	22	52
N#Cc1ccccc1OC[C@@H](O)CNCCCCC1CC1	ZINC000872231833	CE	On-Demand	Mild	CASR	46	49
N#Cc1ccccc1OC[C@@H](O)CNCCCCC1CC1	ZINC000872231833	CE	On-Demand	Mild	CYP2D6	22	52
N#Cc1ccccc1OC[C@H](O)CNCCCCC1CC1	ZINC000872231835	CE	On-Demand	Mild	ADRB2	34	56
N#Cc1ccccc1OC[C@H](O)CNCCCCC1CC1	ZINC000872231835	CE	On-Demand	Mild	ADRB1	81	56
N#Cc1ccccc1OC[C@H](O)CNCCCCC1CC1	ZINC000872231835	CE	On-Demand	Mild	ADRB3	22	52
N#Cc1ccccc1OC[C@H](O)CNCCCCC1CC1	ZINC000872231835	CE	On-Demand	Mild	CASR	46	49
N#Cc1ccccc1OC[C@H](O)CNCCCCC1CC1	ZINC000872231835	CE	On-Demand	Mild	CYP2D6	22	52
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231854	EE	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231855	EE	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231856	EE	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231857	EE	On-Demand	Bother	ADRB1	40	32
O=C(CCNCCCCC1CC1)Nc1cccnc1	ZINC000872231866	CF	On-Demand	Anodyne	NAMPT	30	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872231917	EE	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872231918	EE	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872231919	EE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231952	DG	On-Demand	Anodyne	ADRB2	28	64
O[C@@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231952	DG	On-Demand	Anodyne	ADRB1	61	64
O[C@@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231952	DG	On-Demand	Anodyne	HTR1A	18	64
O[C@@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231952	DG	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231952	DG	On-Demand	Anodyne	ADRB3	23	58
O[C@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231953	DG	On-Demand	Anodyne	ADRB2	28	64
O[C@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231953	DG	On-Demand	Anodyne	ADRB1	61	64
O[C@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231953	DG	On-Demand	Anodyne	HTR1A	18	64
O[C@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231953	DG	On-Demand	Anodyne	SLC6A4	20	45
O[C@H](CNCCCCC1CC1)COc1cccc2[nH]ccc12	ZINC000872231953	DG	On-Demand	Anodyne	ADRB3	23	58
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872231954	DE	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872231955	DE	On-Demand	Anodyne	ADRB1	37	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231961	GG	On-Demand	Mild	ADRB1	57	43
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231961	GG	On-Demand	Mild	GRIN1	15	40
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231961	GG	On-Demand	Mild	ADRB3	37	43
N#CCc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231962	GG	On-Demand	Mild	ADRB1	57	43
N#CCc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231962	GG	On-Demand	Mild	GRIN1	15	40
N#CCc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872231962	GG	On-Demand	Mild	ADRB3	37	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872231979	EE	On-Demand	Anodyne	ADRB2	19	40
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OC(F)F)cc2F)c1	ZINC000872231987	FG	On-Demand	Bother	CACNA1D	42	32
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872231991	CE	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872231991	CE	On-Demand	Anodyne	ADRB1	61	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872231991	CE	On-Demand	Anodyne	ADRB3	39	44
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OC(F)F)cc2F)c1	ZINC000872231992	FG	On-Demand	Bother	CACNA1D	42	32
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872231994	CE	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872231994	CE	On-Demand	Anodyne	ADRB1	61	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872231994	CE	On-Demand	Anodyne	ADRB3	39	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872231996	CE	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872231996	CE	On-Demand	Anodyne	ADRB1	61	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872231996	CE	On-Demand	Anodyne	ADRB3	39	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872232001	CE	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872232001	CE	On-Demand	Anodyne	ADRB1	61	44
O[C@H](CNC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872232001	CE	On-Demand	Anodyne	ADRB3	39	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232002	EF	On-Demand	Bother	ADRB2	48	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232002	EF	On-Demand	Bother	ADRB1	73	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232002	EF	On-Demand	Bother	GRIN1	18	45
Cc1ccc(OC[C@@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232002	EF	On-Demand	Bother	ADRB3	48	47
Cc1ccc(OC[C@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232003	EF	On-Demand	Bother	ADRB2	48	47
Cc1ccc(OC[C@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232003	EF	On-Demand	Bother	ADRB1	73	47
Cc1ccc(OC[C@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232003	EF	On-Demand	Bother	GRIN1	18	45
Cc1ccc(OC[C@H](O)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000872232003	EF	On-Demand	Bother	ADRB3	48	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232004	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232004	GE	On-Demand	Anodyne	ADRB1	62	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232004	GE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232006	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232006	GE	On-Demand	Anodyne	ADRB1	62	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232006	GE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232009	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232009	GE	On-Demand	Anodyne	ADRB1	62	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232009	GE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232014	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232014	GE	On-Demand	Anodyne	ADRB1	62	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC3(CCOCC3)CO2)cc1	ZINC000872232014	GE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232028	GF	On-Demand	Anodyne	ADRB2	42	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232028	GF	On-Demand	Anodyne	ADRB1	76	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232028	GF	On-Demand	Anodyne	GRIN1	30	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232028	GF	On-Demand	Anodyne	ADRB3	50	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232030	GF	On-Demand	Anodyne	ADRB2	42	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232030	GF	On-Demand	Anodyne	ADRB1	76	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232030	GF	On-Demand	Anodyne	GRIN1	30	46
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OC(F)F)cc2F)cc1	ZINC000872232030	GF	On-Demand	Anodyne	ADRB3	50	52
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000872232035	EF	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000872232035	EF	On-Demand	Anodyne	ABCB1	17	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000872232037	EF	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000872232037	EF	On-Demand	Anodyne	ABCB1	17	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000872232038	EF	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000872232038	EF	On-Demand	Anodyne	ABCB1	17	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000872232039	EF	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000872232039	EF	On-Demand	Anodyne	ABCB1	17	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232085	FD	On-Demand	Anodyne	ADRB2	27	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232085	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232085	FD	On-Demand	Anodyne	ADRB3	33	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232086	FD	On-Demand	Anodyne	ADRB2	27	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232086	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232086	FD	On-Demand	Anodyne	ADRB3	33	41
Cc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232098	DG	On-Demand	Anodyne	ADRB2	48	56
Cc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232098	DG	On-Demand	Anodyne	ADRB1	59	43
Cc1ccc(OC[C@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232098	DG	On-Demand	Anodyne	ADRB3	31	43
Cc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232100	DG	On-Demand	Anodyne	ADRB2	48	56
Cc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232100	DG	On-Demand	Anodyne	ADRB1	59	43
Cc1ccc(OC[C@@H](O)CNCC(C)(C)C(C)(F)F)cc1	ZINC000872232100	DG	On-Demand	Anodyne	ADRB3	31	43
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232126	FE	On-Demand	Mild	CTSF	54	37
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232126	FE	On-Demand	Mild	GRIA4	19	50
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232126	FE	On-Demand	Mild	LOX1.1	35	44
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232126	FE	On-Demand	Mild	O49150_SOLTU	52	44
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232129	FE	On-Demand	Mild	CTSF	54	37
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232129	FE	On-Demand	Mild	GRIA4	19	50
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232129	FE	On-Demand	Mild	LOX1.1	35	44
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232129	FE	On-Demand	Mild	O49150_SOLTU	52	44
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232132	FE	On-Demand	Mild	CTSF	54	37
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232132	FE	On-Demand	Mild	GRIA4	19	50
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232132	FE	On-Demand	Mild	LOX1.1	35	44
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232132	FE	On-Demand	Mild	O49150_SOLTU	52	44
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232136	FE	On-Demand	Mild	CTSF	54	37
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232136	FE	On-Demand	Mild	GRIA4	19	50
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232136	FE	On-Demand	Mild	LOX1.1	35	44
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000872232136	FE	On-Demand	Mild	O49150_SOLTU	52	44
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872232188	EE	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872232188	EE	On-Demand	Mild	ADRB1	48	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872232188	EE	On-Demand	Mild	ADRB3	27	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872232189	EE	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872232189	EE	On-Demand	Mild	ADRB1	48	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872232189	EE	On-Demand	Mild	ADRB3	27	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872232190	EE	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872232190	EE	On-Demand	Mild	ADRB1	48	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872232190	EE	On-Demand	Mild	ADRB3	27	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872232191	EE	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872232191	EE	On-Demand	Mild	ADRB1	48	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872232191	EE	On-Demand	Mild	ADRB3	27	40
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872232227	EF	On-Demand	Anodyne	ADRB1	18	57
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872232228	EF	On-Demand	Anodyne	ADRB1	18	57
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232254	EE	On-Demand	Mild	ADRB1	43	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872232255	EE	On-Demand	Mild	ADRB1	43	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000872232275	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000872232276	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232282	EE	On-Demand	Anodyne	ADRB2	42	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232282	EE	On-Demand	Anodyne	ADRB1	61	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232282	EE	On-Demand	Anodyne	ADRB3	36	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232283	EE	On-Demand	Anodyne	ADRB2	42	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232283	EE	On-Demand	Anodyne	ADRB1	61	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232283	EE	On-Demand	Anodyne	ADRB3	36	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232284	EE	On-Demand	Anodyne	ADRB2	42	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232284	EE	On-Demand	Anodyne	ADRB1	61	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232284	EE	On-Demand	Anodyne	ADRB3	36	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232285	EE	On-Demand	Anodyne	ADRB2	42	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232285	EE	On-Demand	Anodyne	ADRB1	61	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232285	EE	On-Demand	Anodyne	ADRB3	36	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232286	GD	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232286	GD	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232286	GD	On-Demand	Anodyne	ADRB3	43	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232286	GD	On-Demand	Anodyne	ABCB1	18	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232287	GD	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232287	GD	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232287	GD	On-Demand	Anodyne	ADRB3	43	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232287	GD	On-Demand	Anodyne	ABCB1	18	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232288	GD	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232288	GD	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232288	GD	On-Demand	Anodyne	ADRB3	43	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232288	GD	On-Demand	Anodyne	ABCB1	18	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232289	GD	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232289	GD	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232289	GD	On-Demand	Anodyne	ADRB3	43	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232289	GD	On-Demand	Anodyne	ABCB1	18	42
C[C@H](CNC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872232302	FE	On-Demand	Anodyne	GPR119	22	43
C[C@@H](CNC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872232303	FE	On-Demand	Anodyne	GPR119	22	43
Cc1cccc(CN2CCO[C@H](CNC[C@](C)(O)C(F)(F)F)C2)c1	ZINC000872232316	EE	On-Demand	Anodyne	DRD4	15	45
Cc1cccc(CN2CCO[C@@H](CNC[C@](C)(O)C(F)(F)F)C2)c1	ZINC000872232317	EE	On-Demand	Anodyne	DRD4	15	45
Cc1cccc(CN2CCO[C@H](CNC[C@@](C)(O)C(F)(F)F)C2)c1	ZINC000872232318	EE	On-Demand	Anodyne	DRD4	15	45
Cc1cccc(CN2CCO[C@@H](CNC[C@@](C)(O)C(F)(F)F)C2)c1	ZINC000872232319	EE	On-Demand	Anodyne	DRD4	15	45
O=C1C[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)Oc2ccccc21	ZINC000872232320	FE	On-Demand	Anodyne	SIGMAR1	33	57
O=C1C[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)Oc2ccccc21	ZINC000872232321	FE	On-Demand	Anodyne	SIGMAR1	33	57
O=C1C[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)Oc2ccccc21	ZINC000872232322	FE	On-Demand	Anodyne	SIGMAR1	33	57
O=C1C[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)Oc2ccccc21	ZINC000872232323	FE	On-Demand	Anodyne	SIGMAR1	33	57
O[C@H](CNC[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872232356	DG	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNC[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872232358	DG	On-Demand	Anodyne	CYP3A4	46	35
CCOc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232364	GC	On-Demand	Anodyne	ADRB2	17	43
CCOc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232364	GC	On-Demand	Anodyne	ADRB1	32	43
CCOc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232366	GC	On-Demand	Anodyne	ADRB2	17	43
CCOc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232366	GC	On-Demand	Anodyne	ADRB1	32	43
CCOc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232368	GC	On-Demand	Anodyne	ADRB2	17	43
CCOc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232368	GC	On-Demand	Anodyne	ADRB1	32	43
CCOc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232370	GC	On-Demand	Anodyne	ADRB2	17	43
CCOc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232370	GC	On-Demand	Anodyne	ADRB1	32	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232402	FG	On-Demand	Anodyne	PGC	49	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232402	FG	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232402	FG	On-Demand	Anodyne	FPR1	45	38
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872232431	EG	On-Demand	Anodyne	ADRB2	31	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872232431	EG	On-Demand	Anodyne	ADRB1	46	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872232432	EG	On-Demand	Anodyne	ADRB2	31	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000872232432	EG	On-Demand	Anodyne	ADRB1	46	40
O=C(CCNC[C@@H]1CC2(CCOCC2)CO1)Nc1cccc(C(F)(F)F)c1	ZINC000872232470	GG	On-Demand	Anodyne	EPHX2	16	42
O=C(CCNC[C@H]1CC2(CCOCC2)CO1)Nc1cccc(C(F)(F)F)c1	ZINC000872232471	GG	On-Demand	Anodyne	EPHX2	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232560	FG	On-Demand	Anodyne	PGC	49	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232560	FG	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872232560	FG	On-Demand	Anodyne	FPR1	45	38
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232567	GB	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232567	GB	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232567	GB	On-Demand	Anodyne	ADRB3	37	40
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232568	GB	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232568	GB	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232568	GB	On-Demand	Anodyne	ADRB3	37	40
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232569	GB	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232569	GB	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872232569	GB	On-Demand	Anodyne	ADRB3	37	40
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232570	GB	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232570	GB	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872232570	GB	On-Demand	Anodyne	ADRB3	37	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232585	FE	On-Demand	Mild	ADRB1	62	37
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232586	FE	On-Demand	Mild	ADRB1	62	37
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232587	FE	On-Demand	Mild	ADRB1	62	37
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232588	FE	On-Demand	Mild	ADRB1	62	37
Cc1cccc(CN2CCO[C@@H](CNC[C@@H](O)c3ccccc3)C2)c1	ZINC000872232616	EF	On-Demand	Anodyne	DRD4	18	45
Cc1cccc(CN2CCO[C@H](CNC[C@@H](O)c3ccccc3)C2)c1	ZINC000872232617	EF	On-Demand	Anodyne	DRD4	18	45
Cc1cccc(CN2CCO[C@H](CNC[C@H](O)c3ccccc3)C2)c1	ZINC000872232618	EF	On-Demand	Anodyne	DRD4	18	45
Cc1cccc(CN2CCO[C@@H](CNC[C@H](O)c3ccccc3)C2)c1	ZINC000872232619	EF	On-Demand	Anodyne	DRD4	18	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000872232644	FF	On-Demand	Anodyne	PAPA1_CARPA	28	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000872232645	FF	On-Demand	Anodyne	PAPA1_CARPA	28	46
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232650	FF	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232650	FF	On-Demand	Anodyne	ADRB1	52	37
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232651	FF	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232651	FF	On-Demand	Anodyne	ADRB1	52	37
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232652	FF	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232652	FF	On-Demand	Anodyne	ADRB1	52	37
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232653	FF	On-Demand	Anodyne	ADRB2	32	40
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232653	FF	On-Demand	Anodyne	ADRB1	52	37
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)c1	ZINC000872232660	GB	On-Demand	Anodyne	ABCB1	19	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)c1	ZINC000872232661	GB	On-Demand	Anodyne	ABCB1	19	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)c1	ZINC000872232662	GB	On-Demand	Anodyne	ABCB1	19	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)c1	ZINC000872232663	GB	On-Demand	Anodyne	ABCB1	19	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872232664	FG	On-Demand	Anodyne	ADRB1	38	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872232664	FG	On-Demand	Anodyne	ADRB3	60	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872232664	FG	On-Demand	Anodyne	CYP3A4	42	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872232665	FG	On-Demand	Anodyne	ADRB1	38	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872232665	FG	On-Demand	Anodyne	ADRB3	60	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872232665	FG	On-Demand	Anodyne	CYP3A4	42	38
O=C1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232707	FF	On-Demand	Anodyne	ADRB2	20	53
O=C1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232707	FF	On-Demand	Anodyne	ADRB1	26	51
O=C1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232707	FF	On-Demand	Anodyne	HTR1A	15	53
O=C1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232708	FF	On-Demand	Anodyne	ADRB2	20	53
O=C1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232708	FF	On-Demand	Anodyne	ADRB1	26	51
O=C1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232708	FF	On-Demand	Anodyne	HTR1A	15	53
O=C1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232709	FF	On-Demand	Anodyne	ADRB2	20	53
O=C1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232709	FF	On-Demand	Anodyne	ADRB1	26	51
O=C1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232709	FF	On-Demand	Anodyne	HTR1A	15	53
O=C1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232710	FF	On-Demand	Anodyne	ADRB2	20	53
O=C1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232710	FF	On-Demand	Anodyne	ADRB1	26	51
O=C1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)Oc2ccccc21	ZINC000872232710	FF	On-Demand	Anodyne	HTR1A	15	53
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232747	FE	On-Demand	Anodyne	ADRB1	57	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232747	FE	On-Demand	Anodyne	ABCB1	22	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232748	FE	On-Demand	Anodyne	ADRB1	57	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232748	FE	On-Demand	Anodyne	ABCB1	22	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232749	FE	On-Demand	Anodyne	ADRB1	57	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232749	FE	On-Demand	Anodyne	ABCB1	22	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232750	FE	On-Demand	Anodyne	ADRB1	57	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232750	FE	On-Demand	Anodyne	ABCB1	22	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	PGC	59	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	PAPA1_CARPA	37	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	CCKAR	26	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	CTSK	18	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	CTSL	20	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	REN	76	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000872232778	EE	On-Demand	Anodyne	FPR1	53	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	PGC	59	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	PAPA1_CARPA	37	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	CCKAR	26	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	CTSK	18	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	CTSL	20	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	REN	76	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872232780	EE	On-Demand	Anodyne	FPR1	53	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232789	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232789	GF	On-Demand	Anodyne	ADRB1	73	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232789	GF	On-Demand	Anodyne	ADRB3	51	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232789	GF	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232790	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232790	GF	On-Demand	Anodyne	ADRB1	73	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232790	GF	On-Demand	Anodyne	ADRB3	51	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232790	GF	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232791	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232791	GF	On-Demand	Anodyne	ADRB1	73	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232791	GF	On-Demand	Anodyne	ADRB3	51	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232791	GF	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232792	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232792	GF	On-Demand	Anodyne	ADRB1	73	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232792	GF	On-Demand	Anodyne	ADRB3	51	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232792	GF	On-Demand	Anodyne	ABCB1	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872232824	GF	On-Demand	Anodyne	ADRB2	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872232824	GF	On-Demand	Anodyne	ADRB1	57	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872232825	GF	On-Demand	Anodyne	ADRB2	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872232825	GF	On-Demand	Anodyne	ADRB1	57	41
CN(C[C@H](O)CNC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)C1CC1	ZINC000872232861	FE	On-Demand	Anodyne	GPR119	18	40
CN(C[C@@H](O)CNC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)C1CC1	ZINC000872232862	FE	On-Demand	Anodyne	GPR119	18	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC[C@H](O)c1ccccn1)C2	ZINC000872232866	FF	On-Demand	Anodyne	GPR119	42	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC[C@@H](O)c1ccccn1)C2	ZINC000872232867	FF	On-Demand	Anodyne	GPR119	42	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872232886	GH	On-Demand	Anodyne	CCR2	42	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872232888	GH	On-Demand	Anodyne	CCR2	42	37
CON(C)C(=O)CCNC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000872232907	ED	On-Demand	Anodyne	DRD4	26	41
CON(C)C(=O)CCNC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000872232908	ED	On-Demand	Anodyne	DRD4	26	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232926	GF	On-Demand	Anodyne	ADRB2	22	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232926	GF	On-Demand	Anodyne	ADRB1	33	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232926	GF	On-Demand	Anodyne	SLC6A4	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232926	GF	On-Demand	Anodyne	ADRB3	15	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232927	GF	On-Demand	Anodyne	ADRB2	22	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232927	GF	On-Demand	Anodyne	ADRB1	33	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232927	GF	On-Demand	Anodyne	SLC6A4	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872232927	GF	On-Demand	Anodyne	ADRB3	15	55
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232944	GE	On-Demand	Anodyne	ADRB2	42	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232944	GE	On-Demand	Anodyne	ADRB1	72	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232944	GE	On-Demand	Anodyne	ADRB3	49	41
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232945	GE	On-Demand	Anodyne	ADRB2	42	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232945	GE	On-Demand	Anodyne	ADRB1	72	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232945	GE	On-Demand	Anodyne	ADRB3	49	41
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232946	GE	On-Demand	Anodyne	ADRB2	42	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232946	GE	On-Demand	Anodyne	ADRB1	72	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232946	GE	On-Demand	Anodyne	ADRB3	49	41
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232947	GE	On-Demand	Anodyne	ADRB2	42	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232947	GE	On-Demand	Anodyne	ADRB1	72	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872232947	GE	On-Demand	Anodyne	ADRB3	49	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000872232960	FE	On-Demand	Anodyne	ADRB2	53	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000872232960	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000872232960	FE	On-Demand	Anodyne	ADRB3	48	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000872232960	FE	On-Demand	Anodyne	ABCB1	26	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000872232961	FE	On-Demand	Anodyne	ADRB2	53	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000872232961	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000872232961	FE	On-Demand	Anodyne	ADRB3	48	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000872232961	FE	On-Demand	Anodyne	ABCB1	26	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)C2	ZINC000872232986	GG	On-Demand	Mild	GPR119	28	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)C2	ZINC000872232987	GG	On-Demand	Mild	GPR119	28	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CC2CCCC2)C1	ZINC000872233086	EF	On-Demand	Anodyne	REN	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CC2CCCC2)C1	ZINC000872233087	EF	On-Demand	Anodyne	REN	36	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)c1	ZINC000872233088	FE	On-Demand	Anodyne	ABCB1	25	49
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)c1	ZINC000872233089	FE	On-Demand	Anodyne	ABCB1	25	49
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)c1	ZINC000872233090	FE	On-Demand	Anodyne	ABCB1	25	49
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)c1	ZINC000872233091	FE	On-Demand	Anodyne	ABCB1	25	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2ccccc2Br)C1	ZINC000872233095	GG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2ccccc2Br)C1	ZINC000872233096	GG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	PGC	52	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	CTSK	20	53
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	REN	62	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872233124	EF	On-Demand	Anodyne	NAAA	42	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	PGC	52	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	CTSK	20	53
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	REN	62	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872233127	EF	On-Demand	Anodyne	NAAA	42	38
Cc1cccc(CN2CCO[C@@H](CNC[C@@H](O)c3ccccn3)C2)c1	ZINC000872233132	ED	On-Demand	Anodyne	DRD4	17	41
Cc1cccc(CN2CCO[C@@H](CNC[C@H](O)c3ccccn3)C2)c1	ZINC000872233133	ED	On-Demand	Anodyne	DRD4	17	41
Cc1cccc(CN2CCO[C@H](CNC[C@H](O)c3ccccn3)C2)c1	ZINC000872233134	ED	On-Demand	Anodyne	DRD4	17	41
Cc1cccc(CN2CCO[C@H](CNC[C@@H](O)c3ccccn3)C2)c1	ZINC000872233135	ED	On-Demand	Anodyne	DRD4	17	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233152	GE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233152	GE	On-Demand	Anodyne	ADRB1	80	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233152	GE	On-Demand	Anodyne	ADRB3	52	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233152	GE	On-Demand	Anodyne	ABCB1	17	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233153	GE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233153	GE	On-Demand	Anodyne	ADRB1	80	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233153	GE	On-Demand	Anodyne	ADRB3	52	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233153	GE	On-Demand	Anodyne	ABCB1	17	40
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233154	GE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233154	GE	On-Demand	Anodyne	ADRB1	80	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233154	GE	On-Demand	Anodyne	ADRB3	52	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233154	GE	On-Demand	Anodyne	ABCB1	17	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233155	GE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233155	GE	On-Demand	Anodyne	ADRB1	80	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233155	GE	On-Demand	Anodyne	ADRB3	52	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233155	GE	On-Demand	Anodyne	ABCB1	17	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCCC(=O)Nc1cccnc1)C2	ZINC000872233166	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCCC(=O)Nc1cccnc1)C2	ZINC000872233166	GG	On-Demand	Anodyne	NAMPT	16	42
O=C1C[C@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233173	EE	On-Demand	Anodyne	ADRB2	41	47
O=C1C[C@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233173	EE	On-Demand	Anodyne	ADRB1	64	43
O=C1C[C@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233173	EE	On-Demand	Anodyne	ADRB3	44	43
O=C1C[C@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233174	EE	On-Demand	Anodyne	ADRB2	41	47
O=C1C[C@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233174	EE	On-Demand	Anodyne	ADRB1	64	43
O=C1C[C@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233174	EE	On-Demand	Anodyne	ADRB3	44	43
O=C1C[C@@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233175	EE	On-Demand	Anodyne	ADRB2	41	47
O=C1C[C@@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233175	EE	On-Demand	Anodyne	ADRB1	64	43
O=C1C[C@@H](CNC[C@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233175	EE	On-Demand	Anodyne	ADRB3	44	43
O=C1C[C@@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233176	EE	On-Demand	Anodyne	ADRB2	41	47
O=C1C[C@@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233176	EE	On-Demand	Anodyne	ADRB1	64	43
O=C1C[C@@H](CNC[C@@H](O)COc2ccccc2)Oc2ccccc21	ZINC000872233176	EE	On-Demand	Anodyne	ADRB3	44	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000872233231	FE	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000872233231	FE	On-Demand	Anodyne	ADRB1	56	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000872233233	FE	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000872233233	FE	On-Demand	Anodyne	ADRB1	56	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000872233250	GF	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000872233250	GF	On-Demand	Anodyne	ADRB1	51	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872233252	GF	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872233252	GF	On-Demand	Anodyne	ADRB1	51	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872233294	FE	On-Demand	Anodyne	ADRB2	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872233294	FE	On-Demand	Anodyne	ADRB1	60	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872233295	FE	On-Demand	Anodyne	ADRB2	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872233295	FE	On-Demand	Anodyne	ADRB1	60	41
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233317	EF	On-Demand	Anodyne	ADRB3	39	40
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233317	EF	On-Demand	Anodyne	CYP3A4	40	33
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233318	EF	On-Demand	Anodyne	ADRB3	39	40
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233318	EF	On-Demand	Anodyne	CYP3A4	40	33
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233319	EF	On-Demand	Anodyne	ADRB3	39	40
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233319	EF	On-Demand	Anodyne	CYP3A4	40	33
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233320	EF	On-Demand	Anodyne	ADRB3	39	40
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)Oc2ccccc21	ZINC000872233320	EF	On-Demand	Anodyne	CYP3A4	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000872233341	DF	On-Demand	Anodyne	ADRB3	36	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000872233341	DF	On-Demand	Anodyne	FPR1	41	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000872233342	DF	On-Demand	Anodyne	ADRB3	36	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000872233342	DF	On-Demand	Anodyne	FPR1	41	35
O=C1C[C@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233363	EE	On-Demand	Anodyne	ADRB2	36	40
O=C1C[C@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233363	EE	On-Demand	Anodyne	ADRB1	60	40
O=C1C[C@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233363	EE	On-Demand	Anodyne	ADRB3	36	40
O=C1C[C@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233364	EE	On-Demand	Anodyne	ADRB2	36	40
O=C1C[C@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233364	EE	On-Demand	Anodyne	ADRB1	60	40
O=C1C[C@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233364	EE	On-Demand	Anodyne	ADRB3	36	40
O=C1C[C@@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233365	EE	On-Demand	Anodyne	ADRB2	36	40
O=C1C[C@@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233365	EE	On-Demand	Anodyne	ADRB1	60	40
O=C1C[C@@H](CNC[C@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233365	EE	On-Demand	Anodyne	ADRB3	36	40
O=C1C[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233366	EE	On-Demand	Anodyne	ADRB2	36	40
O=C1C[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233366	EE	On-Demand	Anodyne	ADRB1	60	40
O=C1C[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)Oc2ccccc21	ZINC000872233366	EE	On-Demand	Anodyne	ADRB3	36	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233377	GE	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233377	GE	On-Demand	Anodyne	ADRB1	22	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233377	GE	On-Demand	Anodyne	ADRA1D	17	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233377	GE	On-Demand	Anodyne	ADRA1A	15	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233377	GE	On-Demand	Anodyne	ADRA1B	17	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233378	GE	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233378	GE	On-Demand	Anodyne	ADRB1	22	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233378	GE	On-Demand	Anodyne	ADRA1D	17	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233378	GE	On-Demand	Anodyne	ADRA1A	15	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233378	GE	On-Demand	Anodyne	ADRA1B	17	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233379	GE	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233379	GE	On-Demand	Anodyne	ADRB1	22	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233379	GE	On-Demand	Anodyne	ADRA1D	17	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233379	GE	On-Demand	Anodyne	ADRA1A	15	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233379	GE	On-Demand	Anodyne	ADRA1B	17	47
Cn1cc(CCNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c2cccnc21	ZINC000872233424	GE	On-Demand	Anodyne	ADRB1	49	36
Cn1cc(CCNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c2cccnc21	ZINC000872233424	GE	On-Demand	Anodyne	ADRB3	35	40
Cn1cc(CCNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c2cccnc21	ZINC000872233425	GE	On-Demand	Anodyne	ADRB1	49	36
Cn1cc(CCNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c2cccnc21	ZINC000872233425	GE	On-Demand	Anodyne	ADRB3	35	40
Cn1cc(CCNC[C@H](O)c2ccc(Br)cc2)c2cccnc21	ZINC000872233438	FG	On-Demand	Anodyne	ADRB2	21	43
Cn1cc(CCNC[C@H](O)c2ccc(Br)cc2)c2cccnc21	ZINC000872233438	FG	On-Demand	Anodyne	ADRB3	41	40
Cn1cc(CCNC[C@@H](O)c2ccc(Br)cc2)c2cccnc21	ZINC000872233439	FG	On-Demand	Anodyne	ADRB2	21	43
Cn1cc(CCNC[C@@H](O)c2ccc(Br)cc2)c2cccnc21	ZINC000872233439	FG	On-Demand	Anodyne	ADRB3	41	40
Cn1cc(CCNCCS(=O)(=O)c2ccccc2)c2cccnc21	ZINC000872233450	EE	On-Demand	Anodyne	HTR6	16	43
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233451	FD	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233451	FD	On-Demand	Anodyne	ADRB1	68	51
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233451	FD	On-Demand	Anodyne	ADRB3	43	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233452	FD	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233452	FD	On-Demand	Anodyne	ADRB1	68	51
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233452	FD	On-Demand	Anodyne	ADRB3	43	49
Cn1cc(CCNC[C@H](O)c2ccccc2)c2cccnc21	ZINC000872233453	CE	On-Demand	Anodyne	ADRB2	38	43
Cn1cc(CCNC[C@H](O)c2ccccc2)c2cccnc21	ZINC000872233453	CE	On-Demand	Anodyne	ADRB3	105	42
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233454	GE	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233454	GE	On-Demand	Anodyne	ADRB1	22	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233454	GE	On-Demand	Anodyne	ADRA1D	17	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233454	GE	On-Demand	Anodyne	ADRA1A	15	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233454	GE	On-Demand	Anodyne	ADRA1B	17	47
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2cccnc21	ZINC000872233455	CE	On-Demand	Anodyne	ADRB2	38	43
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2cccnc21	ZINC000872233455	CE	On-Demand	Anodyne	ADRB3	105	42
CSc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233456	FF	On-Demand	Anodyne	ADRB2	41	41
CSc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233456	FF	On-Demand	Anodyne	ADRB1	64	41
CSc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233456	FF	On-Demand	Anodyne	ADRB3	45	41
CSc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233459	FF	On-Demand	Anodyne	ADRB2	41	41
CSc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233459	FF	On-Demand	Anodyne	ADRB1	64	41
CSc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233459	FF	On-Demand	Anodyne	ADRB3	45	41
Cn1cc(CCNC[C@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233478	FF	On-Demand	Anodyne	ADRB2	26	53
Cn1cc(CCNC[C@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233478	FF	On-Demand	Anodyne	ADRB1	38	53
Cn1cc(CCNC[C@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233478	FF	On-Demand	Anodyne	ADRB3	24	53
Cn1cc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233481	FF	On-Demand	Anodyne	ADRB2	26	53
Cn1cc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233481	FF	On-Demand	Anodyne	ADRB1	38	53
Cn1cc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)c2cccnc21	ZINC000872233481	FF	On-Demand	Anodyne	ADRB3	24	53
Cn1cc(CCNC[C@H](O)c2ccc(F)c(F)c2)c2cccnc21	ZINC000872233499	EF	On-Demand	Anodyne	ADRB3	55	38
Cn1cc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c2cccnc21	ZINC000872233501	EF	On-Demand	Anodyne	ADRB3	55	38
Cn1cc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233506	FE	On-Demand	Mild	ADRB2	45	44
Cn1cc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233506	FE	On-Demand	Mild	ADRB1	78	44
Cn1cc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233506	FE	On-Demand	Mild	ADRB3	50	44
Cn1cc(CCNC[C@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233508	FE	On-Demand	Mild	ADRB2	45	44
Cn1cc(CCNC[C@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233508	FE	On-Demand	Mild	ADRB1	78	44
Cn1cc(CCNC[C@H](O)COc2ccc(CC#N)cc2)c2cccnc21	ZINC000872233508	FE	On-Demand	Mild	ADRB3	50	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233513	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233513	FF	On-Demand	Anodyne	ADRB1	56	42
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233514	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233514	FF	On-Demand	Anodyne	ADRB1	56	42
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233515	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233515	FF	On-Demand	Anodyne	ADRB1	56	42
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233516	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000872233516	FF	On-Demand	Anodyne	ADRB1	56	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233525	FD	On-Demand	Mild	ADRB2	15	49
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233525	FD	On-Demand	Mild	ADRB1	65	46
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233525	FD	On-Demand	Mild	CASR	40	40
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233525	FD	On-Demand	Mild	CYP2D6	15	41
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233526	FD	On-Demand	Mild	ADRB2	15	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233526	FD	On-Demand	Mild	ADRB1	65	46
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233526	FD	On-Demand	Mild	CASR	40	40
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H]1CC(=O)c2ccccc2O1	ZINC000872233526	FD	On-Demand	Mild	CYP2D6	15	41
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233527	FD	On-Demand	Mild	ADRB2	15	49
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233527	FD	On-Demand	Mild	ADRB1	65	46
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233527	FD	On-Demand	Mild	CASR	40	40
N#Cc1ccccc1OC[C@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233527	FD	On-Demand	Mild	CYP2D6	15	41
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233528	FD	On-Demand	Mild	ADRB2	15	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233528	FD	On-Demand	Mild	ADRB1	65	46
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233528	FD	On-Demand	Mild	CASR	40	40
N#Cc1ccccc1OC[C@@H](O)CNC[C@H]1CC(=O)c2ccccc2O1	ZINC000872233528	FD	On-Demand	Mild	CYP2D6	15	41
O=C1C[C@@H](CNC[C@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233548	EE	On-Demand	Anodyne	ADRB2	16	40
O=C1C[C@@H](CNC[C@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233548	EE	On-Demand	Anodyne	ADRB1	43	37
O=C1C[C@@H](CNC[C@@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233549	EE	On-Demand	Anodyne	ADRB2	16	40
O=C1C[C@@H](CNC[C@@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233549	EE	On-Demand	Anodyne	ADRB1	43	37
O=C1C[C@H](CNC[C@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233550	EE	On-Demand	Anodyne	ADRB2	16	40
O=C1C[C@H](CNC[C@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233550	EE	On-Demand	Anodyne	ADRB1	43	37
O=C1C[C@H](CNC[C@@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233551	EE	On-Demand	Anodyne	ADRB2	16	40
O=C1C[C@H](CNC[C@@H](O)COc2ccccc2F)Oc2ccccc21	ZINC000872233551	EE	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233574	GB	On-Demand	Anodyne	ADRB1	28	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233575	GB	On-Demand	Anodyne	ADRB1	28	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233576	GB	On-Demand	Anodyne	ADRB1	28	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233577	GB	On-Demand	Anodyne	ADRB1	28	43
Cn1cc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c2cccnc21	ZINC000872233591	FG	On-Demand	Anodyne	ADRB3	72	39
Cn1cc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c2cccnc21	ZINC000872233592	FG	On-Demand	Anodyne	ADRB3	72	39
Cn1cc(CCNC[C@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233599	FE	On-Demand	Mild	ADRB2	40	41
Cn1cc(CCNC[C@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233599	FE	On-Demand	Mild	ADRB1	72	41
Cn1cc(CCNC[C@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233599	FE	On-Demand	Mild	ADRB3	43	42
Cn1cc(CCNC[C@@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233600	FE	On-Demand	Mild	ADRB2	40	41
Cn1cc(CCNC[C@@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233600	FE	On-Demand	Mild	ADRB1	72	41
Cn1cc(CCNC[C@@H](O)COc2ccc(C#N)cc2)c2cccnc21	ZINC000872233600	FE	On-Demand	Mild	ADRB3	43	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233612	FG	On-Demand	Anodyne	ADRB2	44	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233612	FG	On-Demand	Anodyne	ADRB1	74	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233612	FG	On-Demand	Anodyne	ADRB3	47	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233613	FG	On-Demand	Anodyne	ADRB2	44	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233613	FG	On-Demand	Anodyne	ADRB1	74	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872233613	FG	On-Demand	Anodyne	ADRB3	47	53
CSc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233624	GG	On-Demand	Anodyne	ADRB2	28	40
CSc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233624	GG	On-Demand	Anodyne	ADRB1	40	38
CSc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233625	GG	On-Demand	Anodyne	ADRB2	28	40
CSc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233625	GG	On-Demand	Anodyne	ADRB1	40	38
Cc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233630	FB	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233630	FB	On-Demand	Anodyne	ADRB1	33	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872233631	GE	On-Demand	Bother	ADRB1	48	40
Cc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233632	FB	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872233632	FB	On-Demand	Anodyne	ADRB1	33	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872233633	GE	On-Demand	Bother	ADRB1	48	40
Cc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233634	FB	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233634	FB	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233635	GF	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233635	GF	On-Demand	Anodyne	ADRB1	63	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233635	GF	On-Demand	Anodyne	ADRB3	37	40
Cc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233636	FB	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872233636	FB	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233637	GF	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233637	GF	On-Demand	Anodyne	ADRB1	63	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233637	GF	On-Demand	Anodyne	ADRB3	37	40
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233657	FE	On-Demand	Mild	ADRB1	43	37
N#Cc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872233659	FE	On-Demand	Mild	ADRB1	43	37
Cn1cc(CCNC[C@H](O)c2ccc(F)cc2)c2cccnc21	ZINC000872233677	DF	On-Demand	Anodyne	ADRB2	28	40
Cn1cc(CCNC[C@H](O)c2ccc(F)cc2)c2cccnc21	ZINC000872233677	DF	On-Demand	Anodyne	ADRB3	58	37
Cn1cc(CCNC[C@@H](O)c2ccc(F)cc2)c2cccnc21	ZINC000872233679	DF	On-Demand	Anodyne	ADRB2	28	40
Cn1cc(CCNC[C@@H](O)c2ccc(F)cc2)c2cccnc21	ZINC000872233679	DF	On-Demand	Anodyne	ADRB3	58	37
Cn1cc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c2cccnc21	ZINC000872233681	EE	On-Demand	Bother	ADRB3	91	38
Cn1cc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c2cccnc21	ZINC000872233684	EE	On-Demand	Bother	ADRB3	91	38
Cn1cc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233688	FF	On-Demand	Anodyne	ADRB2	23	42
Cn1cc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233688	FF	On-Demand	Anodyne	ADRB1	42	42
Cn1cc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233688	FF	On-Demand	Anodyne	ADRB3	34	42
Cn1cc(CCNC[C@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233691	FF	On-Demand	Anodyne	ADRB2	23	42
Cn1cc(CCNC[C@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233691	FF	On-Demand	Anodyne	ADRB1	42	42
Cn1cc(CCNC[C@H](O)COCc2ccc(Cl)cc2)c2cccnc21	ZINC000872233691	FF	On-Demand	Anodyne	ADRB3	34	42
N#Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233743	FD	On-Demand	Mild	ADRB1	51	34
N#Cc1ccc(OC[C@H](O)CNC[C@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233744	FD	On-Demand	Mild	ADRB1	51	34
N#Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233745	FD	On-Demand	Mild	ADRB1	51	34
N#Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(=O)c3ccccc3O2)cc1	ZINC000872233747	FD	On-Demand	Mild	ADRB1	51	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872233772	GF	On-Demand	Anodyne	NPFFR1	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872233773	GF	On-Demand	Anodyne	NPFFR1	40	34
Cn1cc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c2cccnc21	ZINC000872233815	FD	On-Demand	Anodyne	ADRB3	102	41
Cn1cc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c2cccnc21	ZINC000872233817	FD	On-Demand	Anodyne	ADRB3	102	41
COC(=O)c1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233831	FD	On-Demand	Anodyne	ADRB2	29	41
COC(=O)c1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233831	FD	On-Demand	Anodyne	ADRB1	50	41
COC(=O)c1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233831	FD	On-Demand	Anodyne	ADRB3	31	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233832	FD	On-Demand	Anodyne	ADRB2	29	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233832	FD	On-Demand	Anodyne	ADRB1	50	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872233832	FD	On-Demand	Anodyne	ADRB3	31	41
Cn1cc(CCNC[C@H](O)COc2ccccc2)c2cccnc21	ZINC000872233837	EE	On-Demand	Anodyne	ADRB2	61	47
Cn1cc(CCNC[C@H](O)COc2ccccc2)c2cccnc21	ZINC000872233837	EE	On-Demand	Anodyne	ADRB1	89	49
Cn1cc(CCNC[C@H](O)COc2ccccc2)c2cccnc21	ZINC000872233837	EE	On-Demand	Anodyne	ADRB3	64	49
Cn1cc(CCNC[C@H](O)COc2ccccc2)c2cccnc21	ZINC000872233837	EE	On-Demand	Anodyne	ABCB1	17	45
Cn1cc(CCNC[C@@H](O)COc2ccccc2)c2cccnc21	ZINC000872233838	EE	On-Demand	Anodyne	ADRB2	61	47
Cn1cc(CCNC[C@@H](O)COc2ccccc2)c2cccnc21	ZINC000872233838	EE	On-Demand	Anodyne	ADRB1	89	49
Cn1cc(CCNC[C@@H](O)COc2ccccc2)c2cccnc21	ZINC000872233838	EE	On-Demand	Anodyne	ADRB3	64	49
Cn1cc(CCNC[C@@H](O)COc2ccccc2)c2cccnc21	ZINC000872233838	EE	On-Demand	Anodyne	ABCB1	17	45
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233887	GE	On-Demand	Anodyne	ADRB2	50	56
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233887	GE	On-Demand	Anodyne	ADRB1	90	56
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233887	GE	On-Demand	Anodyne	GRIN1	22	46
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233887	GE	On-Demand	Anodyne	ADRB3	76	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233889	GE	On-Demand	Anodyne	ADRB2	50	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233889	GE	On-Demand	Anodyne	ADRB1	90	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233889	GE	On-Demand	Anodyne	GRIN1	22	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872233889	GE	On-Demand	Anodyne	ADRB3	76	56
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCCS(C)(=O)=O)C2	ZINC000872233909	ED	On-Demand	Anodyne	GPR119	26	43
Cn1cc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c2cccnc21	ZINC000872233914	EE	On-Demand	Bother	ADRB3	57	36
Cn1cc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2cccnc21	ZINC000872233915	EE	On-Demand	Bother	ADRB3	57	36
CSc1ccc(OC[C@@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872234039	GC	On-Demand	Anodyne	ADRB1	19	41
CSc1ccc(OC[C@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872234041	GC	On-Demand	Anodyne	ADRB1	19	41
CSc1ccc(OC[C@@H](O)CNC[C@@]23COCCN2C(=O)COC3)cc1	ZINC000872234042	GC	On-Demand	Anodyne	ADRB1	19	41
CSc1ccc(OC[C@H](O)CNC[C@]23COCCN2C(=O)COC3)cc1	ZINC000872234043	GC	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234070	FG	On-Demand	Anodyne	ADRB2	30	41
O[C@@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234070	FG	On-Demand	Anodyne	ADRB1	46	41
O[C@@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234070	FG	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234071	FG	On-Demand	Anodyne	ADRB2	30	41
O[C@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234071	FG	On-Demand	Anodyne	ADRB1	46	41
O[C@H](CNCc1ccc(Br)cn1)COc1ccc(Cl)cc1	ZINC000872234071	FG	On-Demand	Anodyne	ADRB3	29	41
Cn1cc(CCNC[C@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234118	FF	On-Demand	Anodyne	ADRB2	36	48
Cn1cc(CCNC[C@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234118	FF	On-Demand	Anodyne	ADRB1	52	39
Cn1cc(CCNC[C@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234118	FF	On-Demand	Anodyne	ABCB1	15	42
Cn1cc(CCNC[C@@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234119	FF	On-Demand	Anodyne	ADRB2	36	48
Cn1cc(CCNC[C@@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234119	FF	On-Demand	Anodyne	ADRB1	52	39
Cn1cc(CCNC[C@@H](O)COc2ccccc2Cl)c2cccnc21	ZINC000872234119	FF	On-Demand	Anodyne	ABCB1	15	42
Cc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234143	EE	On-Demand	Anodyne	ADRB2	51	45
Cc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234143	EE	On-Demand	Anodyne	ADRB1	73	45
Cc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234143	EE	On-Demand	Anodyne	ADRB3	50	45
Cc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234152	EE	On-Demand	Anodyne	ADRB2	51	45
Cc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234152	EE	On-Demand	Anodyne	ADRB1	73	45
Cc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234152	EE	On-Demand	Anodyne	ADRB3	50	45
Cn1cc(CCNC[C@@H](O)COCc2ccccc2)c2cccnc21	ZINC000872234154	EE	On-Demand	Anodyne	ADRB1	42	39
Cn1cc(CCNC[C@H](O)COCc2ccccc2)c2cccnc21	ZINC000872234155	EE	On-Demand	Anodyne	ADRB1	42	39
O[C@H](CNCc1ccc(Br)cn1)COc1ccccc1F	ZINC000872234180	FF	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCc1ccc(Br)cn1)COc1ccccc1F	ZINC000872234180	FF	On-Demand	Anodyne	ADRB1	53	39
O[C@@H](CNCc1ccc(Br)cn1)COc1ccccc1F	ZINC000872234181	FF	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCc1ccc(Br)cn1)COc1ccccc1F	ZINC000872234181	FF	On-Demand	Anodyne	ADRB1	53	39
Cn1cc(CCNC[C@H](O)c2cccc(Br)c2)c2cccnc21	ZINC000872234182	FG	On-Demand	Anodyne	ADRB3	74	40
Cn1cc(CCNC[C@@H](O)c2cccc(Br)c2)c2cccnc21	ZINC000872234183	FG	On-Demand	Anodyne	ADRB3	74	40
Cn1cc(/C=C/C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872234185	DE	On-Demand	Anodyne	L3MBTL3	58	35
Cn1cc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000872234186	DE	On-Demand	Anodyne	L3MBTL3	58	35
C/C=C/c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234194	GG	On-Demand	Anodyne	ADRB2	17	52
C/C=C/c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234194	GG	On-Demand	Anodyne	ADRB1	24	52
C/C=C\c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234195	GG	On-Demand	Anodyne	ADRB2	17	52
C/C=C\c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234195	GG	On-Demand	Anodyne	ADRB1	24	52
C/C=C/c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234196	GG	On-Demand	Anodyne	ADRB2	17	52
C/C=C/c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234196	GG	On-Demand	Anodyne	ADRB1	24	52
C/C=C\c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234197	GG	On-Demand	Anodyne	ADRB2	17	52
C/C=C\c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c(OC)c1	ZINC000872234197	GG	On-Demand	Anodyne	ADRB1	24	52
Cn1cc(CCNC[C@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234203	EE	On-Demand	Anodyne	ADRB2	51	45
Cn1cc(CCNC[C@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234203	EE	On-Demand	Anodyne	ADRB1	78	45
Cn1cc(CCNC[C@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234203	EE	On-Demand	Anodyne	ADRB3	52	45
Cn1cc(CCNC[C@@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234204	EE	On-Demand	Anodyne	ADRB2	51	45
Cn1cc(CCNC[C@@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234204	EE	On-Demand	Anodyne	ADRB1	78	45
Cn1cc(CCNC[C@@H](O)COc2ccc(F)cc2)c2cccnc21	ZINC000872234204	EE	On-Demand	Anodyne	ADRB3	52	45
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234210	FE	On-Demand	Anodyne	ADRB2	23	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234221	GE	On-Demand	Bother	ADRB2	16	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234221	GE	On-Demand	Bother	ADRB1	19	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234221	GE	On-Demand	Bother	ADRB3	16	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234222	GE	On-Demand	Bother	ADRB2	16	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234222	GE	On-Demand	Bother	ADRB1	19	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234222	GE	On-Demand	Bother	ADRB3	16	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234273	GE	On-Demand	Anodyne	ADRB2	45	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234273	GE	On-Demand	Anodyne	ADRB1	79	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234273	GE	On-Demand	Anodyne	GRIN1	23	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234273	GE	On-Demand	Anodyne	ADRB3	50	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234274	GE	On-Demand	Anodyne	ADRB2	45	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234274	GE	On-Demand	Anodyne	ADRB1	79	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234274	GE	On-Demand	Anodyne	GRIN1	23	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234274	GE	On-Demand	Anodyne	ADRB3	50	53
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234277	GE	On-Demand	Mild	ADRB2	32	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234277	GE	On-Demand	Mild	ADRB1	52	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234277	GE	On-Demand	Mild	ADRB3	35	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234278	GE	On-Demand	Mild	ADRB2	32	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234278	GE	On-Demand	Mild	ADRB1	52	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234278	GE	On-Demand	Mild	ADRB3	35	41
COc1cccc(OC)c1OC[C@@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234289	GE	On-Demand	Anodyne	ADRB2	34	42
COc1cccc(OC)c1OC[C@@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234289	GE	On-Demand	Anodyne	ADRB1	45	44
COc1cccc(OC)c1OC[C@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234290	GE	On-Demand	Anodyne	ADRB2	34	42
COc1cccc(OC)c1OC[C@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234290	GE	On-Demand	Anodyne	ADRB1	45	44
Cn1cc(CCNC[C@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234321	EE	On-Demand	Anodyne	ADRB2	33	41
Cn1cc(CCNC[C@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234321	EE	On-Demand	Anodyne	ADRB1	52	40
Cn1cc(CCNC[C@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234321	EE	On-Demand	Anodyne	ABCB1	15	42
Cn1cc(CCNC[C@@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234322	EE	On-Demand	Anodyne	ADRB2	33	41
Cn1cc(CCNC[C@@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234322	EE	On-Demand	Anodyne	ADRB1	52	40
Cn1cc(CCNC[C@@H](O)COc2ccccc2F)c2cccnc21	ZINC000872234322	EE	On-Demand	Anodyne	ABCB1	15	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872234338	GE	On-Demand	Anodyne	ADRB2	25	41
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872234339	GE	On-Demand	Anodyne	ADRB2	25	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234344	GF	On-Demand	Anodyne	ADRB2	30	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234344	GF	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234344	GF	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234344	GF	On-Demand	Anodyne	PDS	54	35
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234345	GF	On-Demand	Anodyne	ADRB2	30	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234345	GF	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234345	GF	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cn2)c1	ZINC000872234345	GF	On-Demand	Anodyne	PDS	54	35
Cn1cc(CCNC[C@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234351	EG	On-Demand	Anodyne	ADRB2	54	39
Cn1cc(CCNC[C@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234351	EG	On-Demand	Anodyne	ADRB1	61	47
Cn1cc(CCNC[C@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234351	EG	On-Demand	Anodyne	ADRB3	107	54
Cn1cc(CCNC[C@@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234352	EG	On-Demand	Anodyne	ADRB2	54	39
Cn1cc(CCNC[C@@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234352	EG	On-Demand	Anodyne	ADRB1	61	47
Cn1cc(CCNC[C@@H](O)c2cccc(Cl)c2)c2cccnc21	ZINC000872234352	EG	On-Demand	Anodyne	ADRB3	107	54
CC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234380	FE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234380	FE	On-Demand	Anodyne	ADRB1	78	43
CC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234380	FE	On-Demand	Anodyne	ADRB3	50	44
CC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234380	FE	On-Demand	Anodyne	ABCB1	19	57
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234381	FE	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234381	FE	On-Demand	Anodyne	ADRB1	78	43
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234381	FE	On-Demand	Anodyne	ADRB3	50	44
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234381	FE	On-Demand	Anodyne	ABCB1	19	57
Cc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234386	FF	On-Demand	Anodyne	ADRB2	40	51
Cc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234386	FF	On-Demand	Anodyne	ADRB1	52	40
Cc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234386	FF	On-Demand	Anodyne	ADRB3	32	40
Cc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234387	FF	On-Demand	Anodyne	ADRB2	40	51
Cc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234387	FF	On-Demand	Anodyne	ADRB1	52	40
Cc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234387	FF	On-Demand	Anodyne	ADRB3	32	40
CC(=O)c1cccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234450	FE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1cccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234450	FE	On-Demand	Anodyne	ADRB1	68	42
CC(=O)c1cccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234450	FE	On-Demand	Anodyne	ADRB3	47	42
CC(=O)c1cccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234450	FE	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234451	FE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234451	FE	On-Demand	Anodyne	ADRB1	68	42
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234451	FE	On-Demand	Anodyne	ADRB3	47	42
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)c1	ZINC000872234451	FE	On-Demand	Anodyne	ABCB1	21	47
Cn1cc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c2cccnc21	ZINC000872234469	GG	On-Demand	Anodyne	ADRB3	48	41
Cn1cc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c2cccnc21	ZINC000872234471	GG	On-Demand	Anodyne	ADRB3	48	41
O[C@H](CNCc1ccc(Br)cn1)COc1ccccc1Cl	ZINC000872234473	FG	On-Demand	Anodyne	ADRB2	23	48
O[C@H](CNCc1ccc(Br)cn1)COc1ccccc1Cl	ZINC000872234473	FG	On-Demand	Anodyne	ADRB1	44	39
O[C@@H](CNCc1ccc(Br)cn1)COc1ccccc1Cl	ZINC000872234475	FG	On-Demand	Anodyne	ADRB2	23	48
O[C@@H](CNCc1ccc(Br)cn1)COc1ccccc1Cl	ZINC000872234475	FG	On-Demand	Anodyne	ADRB1	44	39
C[C@H](NC[C@H](O)CC(C)(C)C#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234481	FF	On-Demand	Mild	GPR119	33	43
C[C@@H](NC[C@@H](O)CC(C)(C)C#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234484	FF	On-Demand	Mild	GPR119	33	43
O=C1NCCN1Cc1ccc(CNC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000872234485	GD	On-Demand	Anodyne	NOD2	43	37
O=C1NCCN1Cc1ccc(CNC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000872234486	GD	On-Demand	Anodyne	NOD2	43	37
COc1ccccc1COC[C@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234490	FE	On-Demand	Anodyne	ADRB2	23	40
COc1ccccc1COC[C@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234490	FE	On-Demand	Anodyne	ADRB1	31	41
COc1ccccc1COC[C@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234490	FE	On-Demand	Anodyne	ADRB3	20	41
COc1ccccc1COC[C@@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234493	FE	On-Demand	Anodyne	ADRB2	23	40
COc1ccccc1COC[C@@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234493	FE	On-Demand	Anodyne	ADRB1	31	41
COc1ccccc1COC[C@@H](O)CNCCc1cn(C)c2ncccc12	ZINC000872234493	FE	On-Demand	Anodyne	ADRB3	20	41
Cn1cc(CCNC[C@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234494	FE	On-Demand	Mild	ADRB2	29	49
Cn1cc(CCNC[C@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234494	FE	On-Demand	Mild	ADRB1	74	46
Cn1cc(CCNC[C@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234494	FE	On-Demand	Mild	ADRB3	24	43
Cn1cc(CCNC[C@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234494	FE	On-Demand	Mild	CASR	43	42
Cn1cc(CCNC[C@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234494	FE	On-Demand	Mild	CYP2D6	22	49
Cn1cc(CCNC[C@@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234495	FE	On-Demand	Mild	ADRB2	29	49
Cn1cc(CCNC[C@@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234495	FE	On-Demand	Mild	ADRB1	74	46
Cn1cc(CCNC[C@@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234495	FE	On-Demand	Mild	ADRB3	24	43
Cn1cc(CCNC[C@@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234495	FE	On-Demand	Mild	CASR	43	42
Cn1cc(CCNC[C@@H](O)COc2ccccc2C#N)c2cccnc21	ZINC000872234495	FE	On-Demand	Mild	CYP2D6	22	49
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872234507	EG	On-Demand	Anodyne	ADRB2	34	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872234507	EG	On-Demand	Anodyne	ADRB1	52	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872234509	EG	On-Demand	Anodyne	ADRB2	34	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)cc1	ZINC000872234509	EG	On-Demand	Anodyne	ADRB1	52	40
O=C(CCNCc1ccc(CN2CCNC2=O)cc1)Nc1cccnc1	ZINC000872234515	FD	On-Demand	Anodyne	NAMPT	41	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234516	GD	On-Demand	Anodyne	ADRB1	52	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234516	GD	On-Demand	Anodyne	ADRB3	41	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234516	GD	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234516	GD	On-Demand	Anodyne	PDS	48	34
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234517	GD	On-Demand	Anodyne	ADRB1	52	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234517	GD	On-Demand	Anodyne	ADRB3	41	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234517	GD	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000872234517	GD	On-Demand	Anodyne	PDS	48	34
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234520	GD	On-Demand	Anodyne	ADRB2	46	48
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234520	GD	On-Demand	Anodyne	ADRB1	80	48
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234520	GD	On-Demand	Anodyne	ADRB3	54	48
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234520	GD	On-Demand	Anodyne	ABCB1	20	48
COC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234523	GD	On-Demand	Anodyne	ADRB2	46	48
COC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234523	GD	On-Demand	Anodyne	ADRB1	80	48
COC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234523	GD	On-Demand	Anodyne	ADRB3	54	48
COC(=O)c1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234523	GD	On-Demand	Anodyne	ABCB1	20	48
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cc(Cl)cc(Cl)c2F)cc1	ZINC000872234534	GG	On-Demand	Anodyne	PTGS2	21	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2cc(Cl)cc(Cl)c2F)cc1	ZINC000872234535	GG	On-Demand	Anodyne	PTGS2	21	42
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234551	GE	On-Demand	Anodyne	ADRB2	35	42
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234551	GE	On-Demand	Anodyne	ADRB1	65	43
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234551	GE	On-Demand	Anodyne	GRIN1	16	45
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234551	GE	On-Demand	Anodyne	ADRB3	45	42
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234552	GE	On-Demand	Anodyne	ADRB2	35	42
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234552	GE	On-Demand	Anodyne	ADRB1	65	43
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234552	GE	On-Demand	Anodyne	GRIN1	16	45
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000872234552	GE	On-Demand	Anodyne	ADRB3	45	42
C#CCNC(=O)CCN[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234553	ED	On-Demand	Mild	GPR119	29	43
C#CCNC(=O)CCN[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234555	ED	On-Demand	Mild	GPR119	29	43
Cn1cc(CCNC[C@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234588	FF	On-Demand	Anodyne	ADRB2	45	45
Cn1cc(CCNC[C@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234588	FF	On-Demand	Anodyne	ADRB1	73	45
Cn1cc(CCNC[C@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234588	FF	On-Demand	Anodyne	GRIN1	15	47
Cn1cc(CCNC[C@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234588	FF	On-Demand	Anodyne	ADRB3	50	45
Cn1cc(CCNC[C@@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234589	FF	On-Demand	Anodyne	ADRB2	45	45
Cn1cc(CCNC[C@@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234589	FF	On-Demand	Anodyne	ADRB1	73	45
Cn1cc(CCNC[C@@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234589	FF	On-Demand	Anodyne	GRIN1	15	47
Cn1cc(CCNC[C@@H](O)COc2ccc(Cl)cc2)c2cccnc21	ZINC000872234589	FF	On-Demand	Anodyne	ADRB3	50	45
CC(=O)c1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234590	FE	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234592	FE	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)c1	ZINC000872234597	EG	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)C)o2)c1	ZINC000872234597	EG	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)c1	ZINC000872234598	EG	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)C)o2)c1	ZINC000872234598	EG	On-Demand	Anodyne	ABCB1	15	43
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA2	35	45
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA1	35	45
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA7	19	41
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA5B	18	40
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA4	25	45
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA5A	20	41
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA14	19	43
C#CCNC(=O)CCNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234610	DB	On-Demand	Mild	CA12	24	44
CCOc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234629	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234629	GF	On-Demand	Anodyne	ADRB1	51	43
CCOc1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234629	GF	On-Demand	Anodyne	ADRB3	32	40
CCOc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234631	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234631	GF	On-Demand	Anodyne	ADRB1	51	43
CCOc1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234631	GF	On-Demand	Anodyne	ADRB3	32	40
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000872234632	FD	On-Demand	Anodyne	ADRB2	49	46
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000872234632	FD	On-Demand	Anodyne	ADRB1	80	45
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000872234632	FD	On-Demand	Anodyne	ADRB3	57	45
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000872234635	FD	On-Demand	Anodyne	ADRB2	49	46
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000872234635	FD	On-Demand	Anodyne	ADRB1	80	45
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000872234635	FD	On-Demand	Anodyne	ADRB3	57	45
Cn1cc(CCNC[C@H](O)c2ccc(Cl)cc2)c2cccnc21	ZINC000872234659	EG	On-Demand	Anodyne	ADRB2	24	40
Cn1cc(CCNC[C@H](O)c2ccc(Cl)cc2)c2cccnc21	ZINC000872234659	EG	On-Demand	Anodyne	ADRB3	58	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1=CN2CCS(=O)(=O)N=C2C=C1	ZINC000872234670	HD	On-Demand	Anodyne	L3MBTL3	55	34
CCOc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234688	FF	On-Demand	Anodyne	ADRB2	49	43
CCOc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234688	FF	On-Demand	Anodyne	ADRB1	73	43
CCOc1ccc(OC[C@@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234688	FF	On-Demand	Anodyne	ADRB3	49	43
CCOc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234690	FF	On-Demand	Anodyne	ADRB2	49	43
CCOc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234690	FF	On-Demand	Anodyne	ADRB1	73	43
CCOc1ccc(OC[C@H](O)CNCCc2cn(C)c3ncccc23)cc1	ZINC000872234690	FF	On-Demand	Anodyne	ADRB3	49	43
C[C@@H](NCCC(=O)Nc1cccnc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234697	GG	On-Demand	Anodyne	GPR119	52	44
C[C@@H](NCCC(=O)Nc1cccnc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234697	GG	On-Demand	Anodyne	NAMPT	15	43
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000872234699	GE	On-Demand	Anodyne	ADRB1	28	52
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000872234699	GE	On-Demand	Anodyne	ADRB3	15	52
Cc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234700	EE	On-Demand	Anodyne	ADRB2	23	46
Cc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234701	EE	On-Demand	Anodyne	ADRB2	23	46
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000872234702	GE	On-Demand	Anodyne	ADRB1	28	52
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000872234702	GE	On-Demand	Anodyne	ADRB3	15	52
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872234731	FE	On-Demand	Mild	ADRB2	16	55
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872234731	FE	On-Demand	Mild	ADRB1	72	56
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872234731	FE	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(Br)cn1	ZINC000872234731	FE	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872234732	FE	On-Demand	Mild	ADRB2	16	55
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872234732	FE	On-Demand	Mild	ADRB1	72	56
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872234732	FE	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(Br)cn1	ZINC000872234732	FE	On-Demand	Mild	CYP2D6	19	45
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	AVPR2	44	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	AVPR1A	22	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	PRNP	51	34
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	EPHX2	19	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	L3MBTL3	54	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872234755	HI	On-Demand	Anodyne	NOD2	45	37
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234762	GD	On-Demand	Mild	ADRB1	59	38
N#CCc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234764	GD	On-Demand	Mild	ADRB1	59	38
C[C@H](NC[C@H](O)CC1(O)CCOCC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234765	GD	On-Demand	Anodyne	GPR119	28	41
C[C@@H](NC[C@@H](O)CC1(O)CCOCC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234768	GD	On-Demand	Anodyne	GPR119	28	41
C[C@@H](NC[C@@H](O)c1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234782	EF	On-Demand	Anodyne	GRIN2B	20	43
C[C@@H](NC[C@@H](O)c1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234782	EF	On-Demand	Anodyne	GPR119	74	51
C[C@H](NC[C@H](O)c1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234784	EF	On-Demand	Anodyne	GRIN2B	20	43
C[C@H](NC[C@H](O)c1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234784	EF	On-Demand	Anodyne	GPR119	74	51
C[C@H](NC[C@H](O)CC(F)(F)F)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234791	FF	On-Demand	Anodyne	GPR119	43	46
C[C@@H](NC[C@@H](O)CC(F)(F)F)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234792	FF	On-Demand	Anodyne	GPR119	43	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234835	GE	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234835	GE	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234835	GE	On-Demand	Anodyne	ADRB3	43	45
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234836	GE	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234836	GE	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cn2)cc1	ZINC000872234836	GE	On-Demand	Anodyne	ADRB3	43	45
CCOc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234844	FE	On-Demand	Anodyne	ADRB2	25	40
CCOc1ccc(OC[C@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234844	FE	On-Demand	Anodyne	ADRB1	34	40
CCOc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234845	FE	On-Demand	Anodyne	ADRB2	25	40
CCOc1ccc(OC[C@@H](O)CNCc2nn(C)cc2C(F)F)cc1	ZINC000872234845	FE	On-Demand	Anodyne	ADRB1	34	40
Cn1cc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c2cccnc21	ZINC000872234846	EG	On-Demand	Anodyne	ADRB3	40	39
Cn1cc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c2cccnc21	ZINC000872234847	EG	On-Demand	Anodyne	ADRB3	40	39
Cn1cc(CCNC[C@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234850	DF	On-Demand	Anodyne	ADRB2	33	40
Cn1cc(CCNC[C@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234850	DF	On-Demand	Anodyne	ADRB1	33	40
Cn1cc(CCNC[C@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234850	DF	On-Demand	Anodyne	ADRB3	89	43
Cn1cc(CCNC[C@@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234851	DF	On-Demand	Anodyne	ADRB2	33	40
Cn1cc(CCNC[C@@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234851	DF	On-Demand	Anodyne	ADRB1	33	40
Cn1cc(CCNC[C@@H](O)c2cccc(F)c2)c2cccnc21	ZINC000872234851	DF	On-Demand	Anodyne	ADRB3	89	43
O=C1NCCN1Cc1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872234870	GD	On-Demand	Anodyne	NPFFR1	44	39
O=C1NCCN1Cc1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000872234873	GD	On-Demand	Anodyne	NPFFR1	44	39
C[C@@H](NC[C@@H](O)CN(C)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234887	FE	On-Demand	Anodyne	GPR119	43	46
C[C@H](NC[C@H](O)CN(C)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234890	FE	On-Demand	Anodyne	GPR119	43	46
Cc1ccc(CN2CCO[C@H](CNC[C@@H](C)O)C2)cc1	ZINC000872234905	CD	On-Demand	Anodyne	DRD4	16	47
Cc1ccc(CN2CCO[C@H](CNC[C@H](C)O)C2)cc1	ZINC000872234908	CD	On-Demand	Anodyne	DRD4	16	47
C[C@@H](NC[C@@H](O)COC1CCOCC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234912	GE	On-Demand	Anodyne	GPR119	29	41
C[C@H](NC[C@H](O)COC1CCOCC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234914	GE	On-Demand	Anodyne	GPR119	29	41
O=C(CCNCc1ccc(CN2CCNC2=O)cc1)Nc1ccccc1	ZINC000872234927	FE	On-Demand	Anodyne	LTA4H	16	42
C[C@@H](NC[C@@H](O)Cn1cccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234931	FD	On-Demand	Anodyne	GPR119	43	44
C[C@H](NC[C@H](O)Cn1cccn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234935	FD	On-Demand	Anodyne	GPR119	43	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234938	FE	On-Demand	Anodyne	ADRB2	41	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234938	FE	On-Demand	Anodyne	ADRB1	67	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234938	FE	On-Demand	Anodyne	ADRB3	45	41
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234939	FE	On-Demand	Anodyne	ADRB2	41	44
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234939	FE	On-Demand	Anodyne	ADRB1	67	41
Cc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872234939	FE	On-Demand	Anodyne	ADRB3	45	41
Cc1ccc(CN2CCO[C@H](CNC[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000872234942	ED	On-Demand	Anodyne	DRD4	15	42
Cc1ccc(CN2CCO[C@H](CNC[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000872234944	ED	On-Demand	Anodyne	DRD4	15	42
C[C@@H](NC[C@@H](O)CN1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234948	GD	On-Demand	Anodyne	GPR119	30	43
C[C@H](NC[C@H](O)CN1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234949	GD	On-Demand	Anodyne	GPR119	30	43
C[C@H](NC[C@H](O)CC(C)(C)O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234952	EE	On-Demand	Anodyne	GPR119	43	46
C[C@@H](NC[C@@H](O)CC(C)(C)O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872234954	EE	On-Demand	Anodyne	GPR119	43	46
CC[C@@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234979	CC	On-Demand	Anodyne	CA2	22	43
CC[C@@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234979	CC	On-Demand	Anodyne	ADRB2	55	50
CC[C@@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234979	CC	On-Demand	Anodyne	ADRB1	73	50
CC[C@@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234979	CC	On-Demand	Anodyne	ADRB3	131	50
CC[C@@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234979	CC	On-Demand	Anodyne	CA1	23	43
CC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234980	CC	On-Demand	Anodyne	CA2	22	43
CC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234980	CC	On-Demand	Anodyne	ADRB2	55	50
CC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234980	CC	On-Demand	Anodyne	ADRB1	73	50
CC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234980	CC	On-Demand	Anodyne	ADRB3	131	50
CC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872234980	CC	On-Demand	Anodyne	CA1	23	43
O=C1NCCN1Cc1ccc(CN[C@@H]2CCCC[C@H]2O)cc1	ZINC000872234981	DD	On-Demand	Anodyne	SSTR3	23	42
C[C@@H](NC[C@@H](O)COCc1ccco1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235010	GF	On-Demand	Anodyne	GPR119	40	44
C[C@H](NC[C@H](O)COCc1ccco1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235012	GF	On-Demand	Anodyne	GPR119	40	44
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000872235020	FE	On-Demand	Bother	ADRB1	43	34
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000872235021	FE	On-Demand	Bother	ADRB1	43	34
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000872235022	FE	On-Demand	Bother	ADRB1	43	34
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000872235023	FE	On-Demand	Bother	ADRB1	43	34
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872235025	EF	On-Demand	Anodyne	ADRB2	23	47
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872235025	EF	On-Demand	Anodyne	ADRB1	42	33
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000872235028	EF	On-Demand	Anodyne	ADRB2	23	47
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000872235028	EF	On-Demand	Anodyne	ADRB1	42	33
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872235030	EF	On-Demand	Anodyne	ADRB2	23	47
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872235030	EF	On-Demand	Anodyne	ADRB1	42	33
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000872235031	EF	On-Demand	Anodyne	ADRB2	23	47
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000872235031	EF	On-Demand	Anodyne	ADRB1	42	33
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000872235071	FF	On-Demand	Anodyne	ADRB1	43	48
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000872235071	FF	On-Demand	Anodyne	ADRB3	64	48
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000872235071	FF	On-Demand	Anodyne	CYP3A4	43	34
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000872235072	FF	On-Demand	Anodyne	ADRB1	43	48
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000872235072	FF	On-Demand	Anodyne	ADRB3	64	48
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000872235072	FF	On-Demand	Anodyne	CYP3A4	43	34
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000872235089	FD	On-Demand	Anodyne	ADRB2	38	42
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000872235089	FD	On-Demand	Anodyne	ADRB1	71	45
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000872235089	FD	On-Demand	Anodyne	ADRB3	47	45
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000872235090	FD	On-Demand	Anodyne	ADRB2	38	42
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000872235090	FD	On-Demand	Anodyne	ADRB1	71	45
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000872235090	FD	On-Demand	Anodyne	ADRB3	47	45
O=C1NCCN1Cc1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872235109	FF	On-Demand	Anodyne	DPP7	24	41
O=C1NCCN1Cc1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872235110	FF	On-Demand	Anodyne	DPP7	24	41
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000872235129	DF	On-Demand	Anodyne	ACE	16	40
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000872235130	DF	On-Demand	Anodyne	ACE	16	40
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000872235131	DF	On-Demand	Anodyne	ACE	16	40
CN1Cc2ccccc2[C@H]1CNC[C@H](O)CCc1ccccc1	ZINC000872235132	DF	On-Demand	Anodyne	ACE	16	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235140	GD	On-Demand	Anodyne	ADRB2	35	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235140	GD	On-Demand	Anodyne	ADRB1	69	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235140	GD	On-Demand	Anodyne	ADRB3	47	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235142	GD	On-Demand	Anodyne	ADRB2	35	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235142	GD	On-Demand	Anodyne	ADRB1	69	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235142	GD	On-Demand	Anodyne	ADRB3	47	40
C[C@@H](NC[C@@H](O)COCc1cccs1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235176	GG	On-Demand	Anodyne	GPR119	44	44
Cc1ccc(CN2CCO[C@H](CNC[C@@H](O)c3ccccc3)C2)cc1	ZINC000872235177	EF	On-Demand	Anodyne	DRD4	21	47
Cc1ccc(CN2CCO[C@H](CNC[C@H](O)c3ccccc3)C2)cc1	ZINC000872235178	EF	On-Demand	Anodyne	DRD4	21	47
C[C@H](NC[C@H](O)COCc1cccs1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235179	GG	On-Demand	Anodyne	GPR119	44	44
C#CCNC(=O)CCNC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872235229	EC	On-Demand	Mild	DRD4	15	43
C#CCNC(=O)CCNC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872235230	EC	On-Demand	Mild	DRD4	15	43
Cc1ccc(CN2CCO[C@H](CNC[C@H](O)C3CC3)C2)cc1	ZINC000872235235	DD	On-Demand	Anodyne	DRD4	15	45
Cc1ccc(CN2CCO[C@H](CNC[C@@H](O)C3CC3)C2)cc1	ZINC000872235236	DD	On-Demand	Anodyne	DRD4	15	45
Cc1ccc(CN2CCO[C@H](CNCCC#N)C2)cc1	ZINC000872235246	CD	On-Demand	Mild	DRD4	15	47
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	AVPR2	61	44
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	AVPR1A	36	44
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	PRNP	67	40
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	EPHX2	25	43
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	ACR	46	35
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	DPP7	22	42
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	MLYCD	18	41
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	L3MBTL3	79	48
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	NOD1	17	45
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872235254	GH	On-Demand	Anodyne	NOD2	47	45
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235257	GD	On-Demand	Mild	ADRB2	18	48
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235257	GD	On-Demand	Mild	ADRB1	66	47
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235257	GD	On-Demand	Mild	ADRB3	15	44
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235257	GD	On-Demand	Mild	CASR	44	44
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235257	GD	On-Demand	Mild	CYP2D6	17	44
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235258	GD	On-Demand	Mild	ADRB2	18	48
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235258	GD	On-Demand	Mild	ADRB1	66	47
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235258	GD	On-Demand	Mild	ADRB3	15	44
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235258	GD	On-Demand	Mild	CASR	44	44
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(CN2CCNC2=O)cc1	ZINC000872235258	GD	On-Demand	Mild	CYP2D6	17	44
Cc1cc(OCC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)no1	ZINC000872235272	EE	On-Demand	Anodyne	ADORA2B	33	41
Cc1cc(OCC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)no1	ZINC000872235272	EE	On-Demand	Anodyne	MCHR1	23	43
Cc1cc(OCC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)no1	ZINC000872235272	EE	On-Demand	Anodyne	L3MBTL3	60	35
C[C@H](NC[C@H](O)CC1(C#N)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235279	FF	On-Demand	Mild	GPR119	29	42
C[C@@H](NC[C@@H](O)CC1(C#N)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235281	FF	On-Demand	Mild	GPR119	29	42
Cc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235320	EF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235320	EF	On-Demand	Anodyne	ADRB1	57	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235320	EF	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235322	EF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235322	EF	On-Demand	Anodyne	ADRB1	57	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235322	EF	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235324	EF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235324	EF	On-Demand	Anodyne	ADRB1	57	41
Cc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872235324	EF	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235326	EF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235326	EF	On-Demand	Anodyne	ADRB1	57	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872235326	EF	On-Demand	Anodyne	ADRB3	32	41
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000872235329	EE	On-Demand	Anodyne	ADRB3	55	37
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000872235330	EE	On-Demand	Anodyne	ADRB3	55	37
Cc1cccc(CN2CCO[C@H](CN[C@@H]3CCCC[C@H]3O)C2)c1	ZINC000872235336	DE	On-Demand	Anodyne	DRD4	17	41
Cc1cccc(CN2CCO[C@@H](CN[C@@H]3CCCC[C@H]3O)C2)c1	ZINC000872235338	DE	On-Demand	Anodyne	DRD4	17	41
Cc1ccc(CN2CCO[C@H](CNCC3(O)CCC3)C2)cc1	ZINC000872235354	DD	On-Demand	Anodyne	DRD4	15	46
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235364	EF	On-Demand	Anodyne	ADRB2	36	42
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235364	EF	On-Demand	Anodyne	ADRB1	56	40
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235364	EF	On-Demand	Anodyne	ADRB3	33	40
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235365	EF	On-Demand	Anodyne	ADRB2	36	42
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235365	EF	On-Demand	Anodyne	ADRB1	56	40
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235365	EF	On-Demand	Anodyne	ADRB3	33	40
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235366	EF	On-Demand	Anodyne	ADRB2	36	42
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235366	EF	On-Demand	Anodyne	ADRB1	56	40
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872235366	EF	On-Demand	Anodyne	ADRB3	33	40
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235367	EF	On-Demand	Anodyne	ADRB2	36	42
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235367	EF	On-Demand	Anodyne	ADRB1	56	40
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872235367	EF	On-Demand	Anodyne	ADRB3	33	40
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000872235371	EE	On-Demand	Anodyne	ADRB1	22	40
O=C1NCCN1Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000872235371	EE	On-Demand	Anodyne	ADRB3	41	40
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000872235374	EE	On-Demand	Anodyne	ADRB1	22	40
O=C1NCCN1Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000872235374	EE	On-Demand	Anodyne	ADRB3	41	40
C[C@@H](NC[C@@H](O)CN(C)CCC#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235394	FD	On-Demand	Mild	GPR119	23	40
C[C@H](NC[C@H](O)CN(C)CCC#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235395	FD	On-Demand	Mild	GPR119	23	40
Cc1ccc(CN2CCO[C@H](CNCCC(=O)Nc3cc(C)on3)C2)cc1	ZINC000872235425	FE	On-Demand	Anodyne	DRD4	16	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235431	GF	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235431	GF	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235431	GF	On-Demand	Anodyne	ADRB3	57	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235432	GF	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235432	GF	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235432	GF	On-Demand	Anodyne	ADRB3	57	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235433	GF	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235433	GF	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000872235433	GF	On-Demand	Anodyne	ADRB3	57	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235434	GF	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235434	GF	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000872235434	GF	On-Demand	Anodyne	ADRB3	57	51
O[C@@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)c1cccc(Cl)c1	ZINC000872235439	FH	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)c1cccc(Cl)c1	ZINC000872235439	FH	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)c1cccc(Cl)c1	ZINC000872235440	FH	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)c1cccc(Cl)c1	ZINC000872235440	FH	On-Demand	Anodyne	ADRB3	35	41
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235441	DE	On-Demand	Anodyne	ADRB2	46	51
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235441	DE	On-Demand	Anodyne	ADRB1	65	44
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235441	DE	On-Demand	Anodyne	ADRB3	41	44
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235441	DE	On-Demand	Anodyne	ABCB1	15	41
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235443	DE	On-Demand	Anodyne	ADRB2	46	51
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235443	DE	On-Demand	Anodyne	ADRB1	65	44
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235443	DE	On-Demand	Anodyne	ADRB3	41	44
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235443	DE	On-Demand	Anodyne	ABCB1	15	41
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235444	DE	On-Demand	Anodyne	ADRB2	46	51
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235444	DE	On-Demand	Anodyne	ADRB1	65	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235444	DE	On-Demand	Anodyne	ADRB3	41	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000872235444	DE	On-Demand	Anodyne	ABCB1	15	41
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235445	DE	On-Demand	Anodyne	ADRB2	46	51
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235445	DE	On-Demand	Anodyne	ADRB1	65	44
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235445	DE	On-Demand	Anodyne	ADRB3	41	44
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000872235445	DE	On-Demand	Anodyne	ABCB1	15	41
O=C(CCNCc1nc(C(F)(F)F)n2c1CCCC2)Nc1cccnc1	ZINC000872235456	FF	On-Demand	Anodyne	NAMPT	20	40
Cn1c2ccccc2c2cc(C(=O)Nc3ccc(C(=O)N4CCCC4)cc3)sc21	ZINC000872235458	HJ	On-Demand	Anodyne	AVPR2	54	37
Cn1c2ccccc2c2cc(C(=O)Nc3ccc(C(=O)N4CCCC4)cc3)sc21	ZINC000872235458	HJ	On-Demand	Anodyne	L3MBTL3	46	38
Cn1c2ccccc2c2cc(C(=O)Nc3ccc(C(=O)N4CCCC4)cc3)sc21	ZINC000872235458	HJ	On-Demand	Anodyne	HPGD	43	37
N#Cc1ccccc1OC[C@@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235483	GF	On-Demand	Mild	ADRB1	61	42
N#Cc1ccccc1OC[C@@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235483	GF	On-Demand	Mild	CASR	44	45
N#Cc1ccccc1OC[C@@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235483	GF	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235484	GF	On-Demand	Mild	ADRB1	61	42
N#Cc1ccccc1OC[C@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235484	GF	On-Demand	Mild	CASR	44	45
N#Cc1ccccc1OC[C@H](O)CNCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000872235484	GF	On-Demand	Mild	CYP2D6	19	45
Cc1cccc(CN2CCO[C@@H](CNCCC#N)C2)c1	ZINC000872235511	CD	On-Demand	Mild	DRD4	15	43
Cc1cccc(CN2CCO[C@H](CNCCC#N)C2)c1	ZINC000872235513	CD	On-Demand	Mild	DRD4	15	43
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235514	FF	On-Demand	Anodyne	ADRB2	22	54
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235514	FF	On-Demand	Anodyne	ADRB1	38	54
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235514	FF	On-Demand	Anodyne	HTR1A	15	54
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235514	FF	On-Demand	Anodyne	SLC6A4	19	42
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235516	FF	On-Demand	Anodyne	ADRB2	22	54
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235516	FF	On-Demand	Anodyne	ADRB1	38	54
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235516	FF	On-Demand	Anodyne	HTR1A	15	54
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872235516	FF	On-Demand	Anodyne	SLC6A4	19	42
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235518	FF	On-Demand	Anodyne	ADRB2	22	54
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235518	FF	On-Demand	Anodyne	ADRB1	38	54
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235518	FF	On-Demand	Anodyne	HTR1A	15	54
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235518	FF	On-Demand	Anodyne	SLC6A4	19	42
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235519	FF	On-Demand	Anodyne	ADRB2	22	54
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235519	FF	On-Demand	Anodyne	ADRB1	38	54
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235519	FF	On-Demand	Anodyne	HTR1A	15	54
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872235519	FF	On-Demand	Anodyne	SLC6A4	19	42
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235551	EE	On-Demand	Anodyne	ADRB2	42	42
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235551	EE	On-Demand	Anodyne	ADRB1	62	40
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235551	EE	On-Demand	Anodyne	ADRB3	36	40
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235553	EE	On-Demand	Anodyne	ADRB2	42	42
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235553	EE	On-Demand	Anodyne	ADRB1	62	40
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235553	EE	On-Demand	Anodyne	ADRB3	36	40
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235555	EE	On-Demand	Anodyne	ADRB2	42	42
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235555	EE	On-Demand	Anodyne	ADRB1	62	40
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872235555	EE	On-Demand	Anodyne	ADRB3	36	40
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235556	EE	On-Demand	Anodyne	ADRB2	42	42
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235556	EE	On-Demand	Anodyne	ADRB1	62	40
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872235556	EE	On-Demand	Anodyne	ADRB3	36	40
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000872235572	FD	On-Demand	Anodyne	ADRB1	52	39
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000872235575	FD	On-Demand	Anodyne	ADRB1	52	39
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235578	GF	On-Demand	Anodyne	GPR119	37	47
CN1Cc2ccccc2[C@H]1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235580	GF	On-Demand	Anodyne	GPR119	37	47
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235581	GF	On-Demand	Anodyne	GPR119	37	47
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235583	GF	On-Demand	Anodyne	GPR119	37	47
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000872235598	GE	On-Demand	Anodyne	ADRB2	29	46
O=C1NCCN1Cc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000872235598	GE	On-Demand	Anodyne	ADRB1	47	44
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000872235599	GE	On-Demand	Anodyne	ADRB2	29	46
O=C1NCCN1Cc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000872235599	GE	On-Demand	Anodyne	ADRB1	47	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000872235628	IJ	On-Demand	Anodyne	AVPR2	72	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000872235628	IJ	On-Demand	Anodyne	AVPR1A	37	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000872235628	IJ	On-Demand	Anodyne	L3MBTL3	61	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000872235629	IJ	On-Demand	Anodyne	AVPR2	72	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000872235629	IJ	On-Demand	Anodyne	AVPR1A	37	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000872235629	IJ	On-Demand	Anodyne	L3MBTL3	61	40
CON(C)C(=O)CCN[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235632	EE	On-Demand	Anodyne	GPR119	28	41
CON(C)C(=O)CCN[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235633	EE	On-Demand	Anodyne	GPR119	28	41
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235640	GD	On-Demand	Mild	ADRB1	65	39
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235640	GD	On-Demand	Mild	ADRB3	40	39
N#Cc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235641	GD	On-Demand	Mild	ADRB1	65	39
N#Cc1ccc(OC[C@H](O)CNCc2ccc(CN3CCNC3=O)cc2)cc1	ZINC000872235641	GD	On-Demand	Mild	ADRB3	40	39
CCOC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872235674	DC	On-Demand	Anodyne	ADRB2	60	54
CCOC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872235674	DC	On-Demand	Anodyne	ADRB1	82	54
CCOC[C@H](O)CNCCc1ccc(S(=O)(=O)NC)cc1	ZINC000872235674	DC	On-Demand	Anodyne	ADRB3	125	54
C[C@@H](NC[C@@H](O)C[C@@](C)(O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235682	FF	On-Demand	Anodyne	GPR119	37	44
C[C@H](NC[C@H](O)C[C@@](C)(O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235684	FF	On-Demand	Anodyne	GPR119	37	44
C[C@@H](NC[C@@H](O)C[C@](C)(O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235685	FF	On-Demand	Anodyne	GPR119	37	44
C[C@H](NC[C@H](O)C[C@](C)(O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235686	FF	On-Demand	Anodyne	GPR119	37	44
C[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235701	FG	On-Demand	Mild	GPR119	56	46
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872235705	FG	On-Demand	Mild	GPR119	56	46
Cc1ccc(CN2CCO[C@H](CNC[C@H](O)c3ccccn3)C2)cc1	ZINC000872235801	ED	On-Demand	Anodyne	DRD4	17	42
Cc1ccc(CN2CCO[C@H](CNC[C@@H](O)c3ccccn3)C2)cc1	ZINC000872235802	ED	On-Demand	Anodyne	DRD4	17	42
Cc1ccc(CN2CCO[C@H](CNCCC(=O)NC(N)=O)C2)cc1	ZINC000872235839	EC	On-Demand	Anodyne	DRD4	17	42
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872235844	FE	On-Demand	Mild	ADRB1	61	37
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872235844	FE	On-Demand	Mild	ADRB3	40	37
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872235845	FE	On-Demand	Mild	ADRB1	61	37
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872235845	FE	On-Demand	Mild	ADRB3	40	37
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872235846	FE	On-Demand	Mild	ADRB1	61	37
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872235846	FE	On-Demand	Mild	ADRB3	40	37
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872235847	FE	On-Demand	Mild	ADRB1	61	37
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872235847	FE	On-Demand	Mild	ADRB3	40	37
COCC1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235863	DD	On-Demand	Anodyne	ADRB2	47	58
COCC1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235863	DD	On-Demand	Anodyne	ADRB1	80	58
COCC1CC(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235863	DD	On-Demand	Anodyne	ADRB3	52	50
COCC1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235866	DD	On-Demand	Anodyne	ADRB2	47	58
COCC1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235866	DD	On-Demand	Anodyne	ADRB1	80	58
COCC1CC(NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000872235866	DD	On-Demand	Anodyne	ADRB3	52	50
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	ADRB2	21	47
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	HTR1A	40	41
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	DRD2	29	41
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	ADRA1D	21	42
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	ADRA1A	20	42
COc1ccccc1[C@H](C)NC[C@H](O)CN1CCN(C)CC1	ZINC000872235869	DC	On-Demand	Anodyne	ABCB1	51	40
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	ADRB2	21	47
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	HTR1A	40	41
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	DRD2	29	41
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	ADRA1D	21	42
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	ADRA1A	20	42
COc1ccccc1[C@H](C)NC[C@@H](O)CN1CCN(C)CC1	ZINC000872235871	DC	On-Demand	Anodyne	ABCB1	51	40
COCC1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235878	DD	On-Demand	Anodyne	ADRB2	26	73
COCC1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235878	DD	On-Demand	Anodyne	ADRB1	32	73
COCC1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235878	DD	On-Demand	Anodyne	HTR1A	17	73
COCC1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235878	DD	On-Demand	Anodyne	SLC6A4	20	45
COCC1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235878	DD	On-Demand	Anodyne	ADRB3	15	61
COCC1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235879	DD	On-Demand	Anodyne	ADRB2	26	73
COCC1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235879	DD	On-Demand	Anodyne	ADRB1	32	73
COCC1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235879	DD	On-Demand	Anodyne	HTR1A	17	73
COCC1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235879	DD	On-Demand	Anodyne	SLC6A4	20	45
COCC1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872235879	DD	On-Demand	Anodyne	ADRB3	15	61
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](CF)c1ccc(F)cc1	ZINC000872235907	EF	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](CF)c1ccc(F)cc1	ZINC000872235908	EF	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](CF)c1ccc(F)cc1	ZINC000872235909	EF	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](CF)c1ccc(F)cc1	ZINC000872235910	EF	On-Demand	Anodyne	PAPA1_CARPA	24	40
COCC1CC(NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000872235912	EF	On-Demand	Anodyne	EGFR	24	40
COCC1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235933	FG	On-Demand	Anodyne	ADRB2	52	48
COCC1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235933	FG	On-Demand	Anodyne	ADRB1	62	46
COCC1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235933	FG	On-Demand	Anodyne	ADRB3	48	44
COCC1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235934	FG	On-Demand	Anodyne	ADRB2	52	48
COCC1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235934	FG	On-Demand	Anodyne	ADRB1	62	46
COCC1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872235934	FG	On-Demand	Anodyne	ADRB3	48	44
COCC1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235945	DD	On-Demand	Mild	ADRB2	38	43
COCC1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235945	DD	On-Demand	Mild	ADRB1	51	49
COCC1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235945	DD	On-Demand	Mild	ADRB3	34	40
COCC1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235946	DD	On-Demand	Mild	ADRB2	38	43
COCC1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235946	DD	On-Demand	Mild	ADRB1	51	49
COCC1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000872235946	DD	On-Demand	Mild	ADRB3	34	40
CON(C)C(=O)CCNC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872235990	ED	On-Demand	Anodyne	DRD4	18	43
CON(C)C(=O)CCNC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872235991	ED	On-Demand	Anodyne	DRD4	18	43
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236005	FE	On-Demand	Bother	ADRB2	15	44
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236005	FE	On-Demand	Bother	ADRB1	21	44
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236007	FE	On-Demand	Bother	ADRB2	15	44
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236007	FE	On-Demand	Bother	ADRB1	21	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236009	FE	On-Demand	Bother	ADRB2	15	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236009	FE	On-Demand	Bother	ADRB1	21	44
COC[C@H](NC[C@@H](O)COCC(C)C)c1cccc(Br)c1	ZINC000872236011	FF	On-Demand	Anodyne	ADRB2	15	40
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236012	FE	On-Demand	Bother	ADRB2	15	44
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872236012	FE	On-Demand	Bother	ADRB1	21	44
COC[C@H](NC[C@H](O)COCC(C)C)c1cccc(Br)c1	ZINC000872236013	FF	On-Demand	Anodyne	ADRB2	15	40
COC[C@@H](NC[C@@H](O)COCC(C)C)c1cccc(Br)c1	ZINC000872236015	FF	On-Demand	Anodyne	ADRB2	15	40
COC[C@@H](NC[C@H](O)COCC(C)C)c1cccc(Br)c1	ZINC000872236017	FF	On-Demand	Anodyne	ADRB2	15	40
COCC1CC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872236019	EE	On-Demand	Anodyne	GPR119	29	41
COCC1CC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000872236021	EE	On-Demand	Anodyne	GPR119	29	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000872236038	FF	On-Demand	Anodyne	PTGS2	47	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000872236038	FF	On-Demand	Anodyne	ADRB3	17	47
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](CF)c2ccc(F)cc2)cc1	ZINC000872236040	FF	On-Demand	Anodyne	PTGS2	47	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](CF)c2ccc(F)cc2)cc1	ZINC000872236040	FF	On-Demand	Anodyne	ADRB3	17	47
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000872236042	FF	On-Demand	Anodyne	PTGS2	47	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000872236042	FF	On-Demand	Anodyne	ADRB3	17	47
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H](CF)c2ccc(F)cc2)cc1	ZINC000872236044	FF	On-Demand	Anodyne	PTGS2	47	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H](CF)c2ccc(F)cc2)cc1	ZINC000872236044	FF	On-Demand	Anodyne	ADRB3	17	47
COCC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872236046	CE	On-Demand	Anodyne	ADRB1	33	46
COCC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872236046	CE	On-Demand	Anodyne	ADRB3	53	46
COCC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872236046	CE	On-Demand	Anodyne	CYP3A4	48	37
COCC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872236048	CE	On-Demand	Anodyne	ADRB1	33	46
COCC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872236048	CE	On-Demand	Anodyne	ADRB3	53	46
COCC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872236048	CE	On-Demand	Anodyne	CYP3A4	48	37
COCC1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872236052	EE	On-Demand	Anodyne	ADRB2	32	46
COCC1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872236053	EE	On-Demand	Anodyne	ADRB2	32	46
COCC1CC(NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872236055	DD	On-Demand	Bother	ADRB2	27	44
COCC1CC(NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872236055	DD	On-Demand	Bother	ADRB1	56	33
COCC1CC(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872236057	DD	On-Demand	Bother	ADRB2	27	44
COCC1CC(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000872236057	DD	On-Demand	Bother	ADRB1	56	33
Cc1ccc(CN2CCO[C@H](CNC[C@](C)(O)C(F)(F)F)C2)cc1	ZINC000872236063	EE	On-Demand	Anodyne	DRD4	19	48
Cc1ccc(CN2CCO[C@H](CNC[C@@](C)(O)C(F)(F)F)C2)cc1	ZINC000872236068	EE	On-Demand	Anodyne	DRD4	19	48
COCC1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236091	CD	On-Demand	Mild	ADRB2	32	44
COCC1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236091	CD	On-Demand	Mild	ADRB1	38	47
COCC1CC(NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236091	CD	On-Demand	Mild	ADRB3	23	42
COCC1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236099	CD	On-Demand	Mild	ADRB2	32	44
COCC1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236099	CD	On-Demand	Mild	ADRB1	38	47
COCC1CC(NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000872236099	CD	On-Demand	Mild	ADRB3	23	42
COCC1CC(NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872236108	FG	On-Demand	Anodyne	SLC6A3	26	42
COCC1CC(NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872236110	FG	On-Demand	Anodyne	SLC6A3	26	42
COCC1CC(NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000872236124	CE	On-Demand	Anodyne	ADRB2	25	46
COCC1CC(NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000872236130	CE	On-Demand	Anodyne	ADRB2	25	46
COCC1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872236141	CE	On-Demand	Anodyne	HDAC11	15	41
CCOc1ccc(OC[C@@H](O)CNC2CC(COC)C2)cc1	ZINC000872236157	DD	On-Demand	Anodyne	ADRB2	42	43
CCOc1ccc(OC[C@@H](O)CNC2CC(COC)C2)cc1	ZINC000872236157	DD	On-Demand	Anodyne	ADRB1	45	48
CCOc1ccc(OC[C@@H](O)CNC2CC(COC)C2)cc1	ZINC000872236157	DD	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@H](O)CNC2CC(COC)C2)cc1	ZINC000872236158	DD	On-Demand	Anodyne	ADRB2	42	43
CCOc1ccc(OC[C@H](O)CNC2CC(COC)C2)cc1	ZINC000872236158	DD	On-Demand	Anodyne	ADRB1	45	48
CCOc1ccc(OC[C@H](O)CNC2CC(COC)C2)cc1	ZINC000872236158	DD	On-Demand	Anodyne	ADRB3	29	44
Cc1ccc(CN2CCO[C@H](CNCCC(N)=O)C2)cc1	ZINC000872236187	CC	On-Demand	Anodyne	DRD4	22	45
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000872236213	EE	On-Demand	Anodyne	ADRB2	20	42
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000872236213	EE	On-Demand	Anodyne	ADRB1	53	38
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000872236214	EE	On-Demand	Anodyne	ADRB2	20	42
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000872236214	EE	On-Demand	Anodyne	ADRB1	53	38
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000872236215	EE	On-Demand	Anodyne	ADRB2	20	42
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000872236215	EE	On-Demand	Anodyne	ADRB1	53	38
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1F	ZINC000872236216	EE	On-Demand	Anodyne	ADRB2	20	42
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1F	ZINC000872236216	EE	On-Demand	Anodyne	ADRB1	53	38
COCC1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872236225	CD	On-Demand	Bother	CACNA1C	64	42
COCC1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872236225	CD	On-Demand	Bother	CACNA1D	97	42
COCC1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872236227	CD	On-Demand	Bother	CACNA1C	64	42
COCC1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000872236227	CD	On-Demand	Bother	CACNA1D	97	42
CC[C@H](O)CNC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236239	CD	On-Demand	Anodyne	DRD4	15	46
CC[C@@H](O)CNC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236241	CD	On-Demand	Anodyne	DRD4	15	46
CC[C@H](O)CNC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236242	CD	On-Demand	Anodyne	DRD4	15	46
CC[C@@H](O)CNC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236244	CD	On-Demand	Anodyne	DRD4	15	46
COCCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236246	FE	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236246	FE	On-Demand	Anodyne	ADRB1	73	52
COCCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236246	FE	On-Demand	Anodyne	ADRB3	50	43
COCCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236248	FE	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236248	FE	On-Demand	Anodyne	ADRB1	73	52
COCCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236248	FE	On-Demand	Anodyne	ADRB3	50	43
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236250	FE	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236250	FE	On-Demand	Anodyne	ADRB1	73	52
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236250	FE	On-Demand	Anodyne	ADRB3	50	43
COCCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236253	FE	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236253	FE	On-Demand	Anodyne	ADRB1	73	52
COCCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236253	FE	On-Demand	Anodyne	ADRB3	50	43
COCC1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872236269	DE	On-Demand	Anodyne	ADRB2	31	41
COCC1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872236269	DE	On-Demand	Anodyne	ADRB1	35	46
COCC1CC(NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000872236269	DE	On-Demand	Anodyne	ADRB3	23	42
COCC1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872236271	DE	On-Demand	Anodyne	ADRB2	31	41
COCC1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872236271	DE	On-Demand	Anodyne	ADRB1	35	46
COCC1CC(NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000872236271	DE	On-Demand	Anodyne	ADRB3	23	42
Cc1ccc(CN2CCO[C@H](CNC[C@H](O)C(F)(F)F)C2)cc1	ZINC000872236280	ED	On-Demand	Anodyne	DRD4	15	44
Cc1ccc(CN2CCO[C@H](CNC[C@@H](O)C(F)(F)F)C2)cc1	ZINC000872236284	ED	On-Demand	Anodyne	DRD4	15	44
COCC1CC(NC[C@H](O)COc2ccc(C(C)(C)C)cc2C)C1	ZINC000872236285	EG	On-Demand	Anodyne	VDR	19	42
COC[C@@H](O)CNC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236287	DC	On-Demand	Anodyne	DRD4	15	46
COC[C@@H](O)CNC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000872236289	DC	On-Demand	Anodyne	DRD4	15	46
COCC1CC(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)C1	ZINC000872236296	EG	On-Demand	Anodyne	VDR	19	42
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236313	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236313	CF	On-Demand	Anodyne	ADRB3	69	44
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236314	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236314	CF	On-Demand	Anodyne	ADRB3	69	44
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236315	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236315	CF	On-Demand	Anodyne	ADRB3	69	44
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236316	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccnc1	ZINC000872236316	CF	On-Demand	Anodyne	ADRB3	69	44
COCC1CC(NC[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872236319	GG	On-Demand	Anodyne	SLC6A3	43	44
COCC1CC(NC[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872236320	GG	On-Demand	Anodyne	SLC6A3	43	44
COCC1CC(NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000872236321	DD	On-Demand	Anodyne	ADRB1	18	46
COCC1CC(NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000872236322	DD	On-Demand	Anodyne	ADRB1	18	46
COCC1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872236328	DD	On-Demand	Anodyne	ADRB3	18	43
COCC1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000872236329	DD	On-Demand	Anodyne	ADRB3	18	43
COCC1CC(NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000872236333	CE	On-Demand	Anodyne	ADRB2	22	46
COCC1CC(NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000872236334	CE	On-Demand	Anodyne	ADRB2	22	46
COCC1CC(NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872236361	DE	On-Demand	Anodyne	ADRB2	17	44
COCC1CC(NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000872236362	DE	On-Demand	Anodyne	ADRB2	17	44
COCC1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236363	DF	On-Demand	Anodyne	ADRB2	48	57
COCC1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236363	DF	On-Demand	Anodyne	ADRB1	43	43
COCC1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236363	DF	On-Demand	Anodyne	ADRB3	31	41
COCC1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236363	DF	On-Demand	Anodyne	CASR	40	37
COCC1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236364	DF	On-Demand	Anodyne	ADRB2	48	57
COCC1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236364	DF	On-Demand	Anodyne	ADRB1	43	43
COCC1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236364	DF	On-Demand	Anodyne	ADRB3	31	41
COCC1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872236364	DF	On-Demand	Anodyne	CASR	40	37
CN1Cc2ccccc2[C@@H]1CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872236382	FE	On-Demand	Anodyne	SIGMAR1	39	40
CN1Cc2ccccc2[C@H]1CNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872236383	FE	On-Demand	Anodyne	SIGMAR1	39	40
CN1Cc2ccccc2[C@@H]1CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872236384	FE	On-Demand	Anodyne	SIGMAR1	39	40
CN1Cc2ccccc2[C@H]1CNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872236385	FE	On-Demand	Anodyne	SIGMAR1	39	40
Cc1ccc(CN2CCO[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000872236403	GE	On-Demand	Anodyne	DRD4	22	44
Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n3c2CCCC3)cc1	ZINC000872236425	GG	On-Demand	Anodyne	ADRB2	26	43
Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n3c2CCCC3)cc1	ZINC000872236426	GG	On-Demand	Anodyne	ADRB2	26	43
O=C(CCNC[C@H]1CCN1C1CCCCCC1)Nc1cccnc1	ZINC000872236451	EF	On-Demand	Anodyne	CHRNA7	29	41
O=C(CCNC[C@H]1CCN1C1CCCCCC1)Nc1cccnc1	ZINC000872236451	EF	On-Demand	Anodyne	NAMPT	21	43
O=C(CCNC[C@@H]1CCN1C1CCCCCC1)Nc1cccnc1	ZINC000872236452	EF	On-Demand	Anodyne	CHRNA7	29	41
O=C(CCNC[C@@H]1CCN1C1CCCCCC1)Nc1cccnc1	ZINC000872236452	EF	On-Demand	Anodyne	NAMPT	21	43
COCC1CC(NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872236476	EF	On-Demand	Anodyne	ADRB2	18	40
COCC1CC(NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872236476	EF	On-Demand	Anodyne	ADRB1	18	40
COCC1CC(NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872236478	EF	On-Demand	Anodyne	ADRB2	18	40
COCC1CC(NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000872236478	EF	On-Demand	Anodyne	ADRB1	18	40
COCC1CC(NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872236490	CE	On-Demand	Anodyne	ADRB2	26	55
COCC1CC(NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872236490	CE	On-Demand	Anodyne	ADRB1	21	41
COCC1CC(NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872236491	CE	On-Demand	Anodyne	ADRB2	26	55
COCC1CC(NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000872236491	CE	On-Demand	Anodyne	ADRB1	21	41
COCC1CC(NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872236492	CE	On-Demand	Anodyne	ADRB2	25	41
COCC1CC(NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000872236492	CE	On-Demand	Anodyne	ADRB1	23	41
COCC1CC(NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872236493	CE	On-Demand	Anodyne	ADRB2	25	41
COCC1CC(NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000872236493	CE	On-Demand	Anodyne	ADRB1	23	41
COCC1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236496	DD	On-Demand	Bother	ADRB2	24	44
COCC1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236496	DD	On-Demand	Bother	ADRB1	25	44
COCC1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236496	DD	On-Demand	Bother	CACNA1C	59	40
COCC1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236496	DD	On-Demand	Bother	ADRB3	18	44
COCC1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236496	DD	On-Demand	Bother	CACNA1D	92	40
COCC1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236497	DD	On-Demand	Bother	ADRB2	24	44
COCC1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236497	DD	On-Demand	Bother	ADRB1	25	44
COCC1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236497	DD	On-Demand	Bother	CACNA1C	59	40
COCC1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236497	DD	On-Demand	Bother	ADRB3	18	44
COCC1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000872236497	DD	On-Demand	Bother	CACNA1D	92	40
COCC1CC(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236530	DF	On-Demand	Anodyne	ADRB2	34	44
COCC1CC(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236530	DF	On-Demand	Anodyne	ADRB1	39	47
COCC1CC(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236530	DF	On-Demand	Anodyne	ADRB3	24	42
COCC1CC(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236531	DF	On-Demand	Anodyne	ADRB2	34	44
COCC1CC(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236531	DF	On-Demand	Anodyne	ADRB1	39	47
COCC1CC(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000872236531	DF	On-Demand	Anodyne	ADRB3	24	42
COC[C@@H](NC[C@@H](O)COC)c1cccc(Br)c1	ZINC000872236542	DD	On-Demand	Anodyne	ADRB2	21	42
COC[C@@H](O)CN[C@H](COC)c1cccc(Br)c1	ZINC000872236544	DD	On-Demand	Anodyne	ADRB2	21	42
COC[C@@H](O)CN[C@@H](COC)c1cccc(Br)c1	ZINC000872236545	DD	On-Demand	Anodyne	ADRB2	21	42
COCC1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236557	EE	On-Demand	Anodyne	ADRB2	27	42
COCC1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236557	EE	On-Demand	Anodyne	ADRB1	27	42
COCC1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236557	EE	On-Demand	Anodyne	PDS	47	41
COCC1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236558	EE	On-Demand	Anodyne	ADRB2	27	42
COCC1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236558	EE	On-Demand	Anodyne	ADRB1	27	42
COCC1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872236558	EE	On-Demand	Anodyne	PDS	47	41
NC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236559	DD	On-Demand	Anodyne	ADRB2	39	62
NC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236559	DD	On-Demand	Anodyne	ADRB1	58	37
NC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236559	DD	On-Demand	Anodyne	ADRB3	25	54
NC(=O)C1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236559	DD	On-Demand	Anodyne	ABCB1	34	45
NC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236560	DD	On-Demand	Anodyne	ADRB2	39	62
NC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236560	DD	On-Demand	Anodyne	ADRB1	58	37
NC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236560	DD	On-Demand	Anodyne	ADRB3	25	54
NC(=O)C1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236560	DD	On-Demand	Anodyne	ABCB1	34	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236594	FE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236594	FE	On-Demand	Anodyne	ADRA1D	15	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236594	FE	On-Demand	Anodyne	ADRA1B	15	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236595	FE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236595	FE	On-Demand	Anodyne	ADRA1D	15	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236595	FE	On-Demand	Anodyne	ADRA1B	15	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236596	FE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236596	FE	On-Demand	Anodyne	ADRA1D	15	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1c2ccccc2CN1C	ZINC000872236596	FE	On-Demand	Anodyne	ADRA1B	15	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236597	FE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236597	FE	On-Demand	Anodyne	ADRA1D	15	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1c2ccccc2CN1C	ZINC000872236597	FE	On-Demand	Anodyne	ADRA1B	15	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236626	FE	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236626	FE	On-Demand	Anodyne	ADRB1	49	37
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236626	FE	On-Demand	Anodyne	ABCB1	23	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236627	FE	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236627	FE	On-Demand	Anodyne	ADRB1	49	37
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236627	FE	On-Demand	Anodyne	ABCB1	23	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236628	FE	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236628	FE	On-Demand	Anodyne	ADRB1	49	37
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)c1	ZINC000872236628	FE	On-Demand	Anodyne	ABCB1	23	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236629	FE	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236629	FE	On-Demand	Anodyne	ADRB1	49	37
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)c1	ZINC000872236629	FE	On-Demand	Anodyne	ABCB1	23	47
COC[C@H](NC[C@@H](O)COC(C)C)c1cccc(Br)c1	ZINC000872236683	EF	On-Demand	Anodyne	ADRB2	17	43
COC[C@H](NC[C@H](O)COC(C)C)c1cccc(Br)c1	ZINC000872236684	EF	On-Demand	Anodyne	ADRB2	17	43
COC[C@@H](NC[C@@H](O)COC(C)C)c1cccc(Br)c1	ZINC000872236685	EF	On-Demand	Anodyne	ADRB2	17	43
COC[C@@H](NC[C@H](O)COC(C)C)c1cccc(Br)c1	ZINC000872236686	EF	On-Demand	Anodyne	ADRB2	17	43
COCC1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872236687	EF	On-Demand	Anodyne	ADRB2	21	41
COCC1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872236687	EF	On-Demand	Anodyne	ADRB1	19	41
COCC1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872236689	EF	On-Demand	Anodyne	ADRB2	21	41
COCC1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872236689	EF	On-Demand	Anodyne	ADRB1	19	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](CF)c2ccc(F)cc2)c1	ZINC000872236690	DG	On-Demand	Bother	ADRB3	15	42
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](CF)c2ccc(F)cc2)c1	ZINC000872236691	DG	On-Demand	Bother	ADRB3	15	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@H](CF)c2ccc(F)cc2)c1	ZINC000872236692	DG	On-Demand	Bother	ADRB3	15	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](CF)c2ccc(F)cc2)c1	ZINC000872236694	DG	On-Demand	Bother	ADRB3	15	42
COCC1CC(NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000872236696	EF	On-Demand	Anodyne	CYNT	36	47
COCC1CC(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236709	DD	On-Demand	Anodyne	ADRB2	46	46
COCC1CC(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236709	DD	On-Demand	Anodyne	ADRB1	66	46
COCC1CC(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236709	DD	On-Demand	Anodyne	ADRB3	45	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872236713	EE	On-Demand	Mild	ADRB2	32	41
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872236713	EE	On-Demand	Mild	ADRB1	53	35
COCC1CC(NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236714	DD	On-Demand	Anodyne	ADRB2	46	46
COCC1CC(NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236714	DD	On-Demand	Anodyne	ADRB1	66	46
COCC1CC(NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000872236714	DD	On-Demand	Anodyne	ADRB3	45	44
COCC1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872236717	DD	On-Demand	Anodyne	SIGMAR1	64	38
COCC1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872236717	DD	On-Demand	Anodyne	NPFFR1	41	37
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872236718	EE	On-Demand	Mild	ADRB2	32	41
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872236718	EE	On-Demand	Mild	ADRB1	53	35
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872236719	EE	On-Demand	Mild	ADRB2	32	41
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872236719	EE	On-Demand	Mild	ADRB1	53	35
COCC1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872236720	DD	On-Demand	Anodyne	SIGMAR1	64	38
COCC1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872236720	DD	On-Demand	Anodyne	NPFFR1	41	37
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236721	DH	On-Demand	Anodyne	ADRB1	28	46
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236721	DH	On-Demand	Anodyne	ADRB3	46	46
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236722	DH	On-Demand	Anodyne	ADRB1	28	46
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236722	DH	On-Demand	Anodyne	ADRB3	46	46
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236723	DH	On-Demand	Anodyne	ADRB1	28	46
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236723	DH	On-Demand	Anodyne	ADRB3	46	46
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236724	DH	On-Demand	Anodyne	ADRB1	28	46
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000872236724	DH	On-Demand	Anodyne	ADRB3	46	46
COCC1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872236725	ED	On-Demand	Anodyne	ADRB2	33	46
COCC1CC(NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000872236725	ED	On-Demand	Anodyne	ADRB1	32	46
COCC1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872236726	ED	On-Demand	Anodyne	ADRB2	33	46
COCC1CC(NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000872236726	ED	On-Demand	Anodyne	ADRB1	32	46
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872236727	EE	On-Demand	Mild	ADRB2	32	41
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872236727	EE	On-Demand	Mild	ADRB1	53	35
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236732	FE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236732	FE	On-Demand	Anodyne	ADRB1	82	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236732	FE	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236732	FE	On-Demand	Anodyne	ADRB3	51	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236732	FE	On-Demand	Anodyne	ABCB1	16	42
COCC1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236735	EF	On-Demand	Anodyne	ADRB2	33	41
COCC1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236735	EF	On-Demand	Anodyne	ADRB1	32	43
COCC1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236735	EF	On-Demand	Anodyne	GRIN1	25	40
COCC1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236735	EF	On-Demand	Anodyne	ADRB3	25	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236736	FE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236736	FE	On-Demand	Anodyne	ADRB1	82	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236736	FE	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236736	FE	On-Demand	Anodyne	ADRB3	51	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236736	FE	On-Demand	Anodyne	ABCB1	16	42
COCC1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236737	EF	On-Demand	Anodyne	ADRB2	33	41
COCC1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236737	EF	On-Demand	Anodyne	ADRB1	32	43
COCC1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236737	EF	On-Demand	Anodyne	GRIN1	25	40
COCC1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872236737	EF	On-Demand	Anodyne	ADRB3	25	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236740	FE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236740	FE	On-Demand	Anodyne	ADRB1	82	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236740	FE	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236740	FE	On-Demand	Anodyne	ADRB3	51	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236740	FE	On-Demand	Anodyne	ABCB1	16	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236745	FE	On-Demand	Anodyne	ADRB2	44	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236745	FE	On-Demand	Anodyne	ADRB1	82	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236745	FE	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236745	FE	On-Demand	Anodyne	ADRB3	51	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236745	FE	On-Demand	Anodyne	ABCB1	16	42
COCC1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236752	DD	On-Demand	Anodyne	ADRB2	32	44
COCC1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236752	DD	On-Demand	Anodyne	ADRB1	41	42
COCC1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236752	DD	On-Demand	Anodyne	ADRB3	28	40
COCC1CC(NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236752	DD	On-Demand	Anodyne	ABCB1	17	45
COCC1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236753	DD	On-Demand	Anodyne	ADRB2	32	44
COCC1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236753	DD	On-Demand	Anodyne	ADRB1	41	42
COCC1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236753	DD	On-Demand	Anodyne	ADRB3	28	40
COCC1CC(NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000872236753	DD	On-Demand	Anodyne	ABCB1	17	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236764	FD	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236764	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236764	FD	On-Demand	Anodyne	ADRB3	46	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236764	FD	On-Demand	Anodyne	ABCB1	20	45
COCC1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236766	EG	On-Demand	Anodyne	ADRB2	52	45
COCC1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236766	EG	On-Demand	Anodyne	ADRB1	60	46
COCC1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236766	EG	On-Demand	Anodyne	ADRB3	45	44
COCC1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236767	EG	On-Demand	Anodyne	ADRB2	52	45
COCC1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236767	EG	On-Demand	Anodyne	ADRB1	60	46
COCC1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236767	EG	On-Demand	Anodyne	ADRB3	45	44
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236769	FD	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236769	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236769	FD	On-Demand	Anodyne	ADRB3	46	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236769	FD	On-Demand	Anodyne	ABCB1	20	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236770	FD	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236770	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236770	FD	On-Demand	Anodyne	ADRB3	46	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236770	FD	On-Demand	Anodyne	ABCB1	20	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	AVPR2	104	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	AVPR1A	58	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	PRNP	52	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	EPHX2	15	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	L3MBTL3	79	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	NOD2	42	35
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)-c1ccccc1C2	ZINC000872236773	GJ	On-Demand	Anodyne	KCNK3	44	35
COCC1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236774	DF	On-Demand	Anodyne	ADRB2	43	57
COCC1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236774	DF	On-Demand	Anodyne	ADRB1	42	39
COCC1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236774	DF	On-Demand	Anodyne	ADRB3	23	57
COCC1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236774	DF	On-Demand	Anodyne	CYP2D6	19	44
COCC1CC(NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872236774	DF	On-Demand	Anodyne	ABCB1	18	41
COCC1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236775	DF	On-Demand	Anodyne	ADRB2	43	57
COCC1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236775	DF	On-Demand	Anodyne	ADRB1	42	39
COCC1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236775	DF	On-Demand	Anodyne	ADRB3	23	57
COCC1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236775	DF	On-Demand	Anodyne	CYP2D6	19	44
COCC1CC(NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872236775	DF	On-Demand	Anodyne	ABCB1	18	41
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(F)c1	ZINC000872236779	CG	On-Demand	Anodyne	ADRB3	20	45
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(F)c1	ZINC000872236780	CG	On-Demand	Anodyne	ADRB3	20	45
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1cccc(F)c1	ZINC000872236781	CG	On-Demand	Anodyne	ADRB3	20	45
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1cccc(F)c1	ZINC000872236782	CG	On-Demand	Anodyne	ADRB3	20	45
COCC1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872236785	CD	On-Demand	Mild	ADRB2	32	60
COCC1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872236785	CD	On-Demand	Mild	ADRB1	74	47
COCC1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872236785	CD	On-Demand	Mild	ADRB3	15	51
COCC1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872236785	CD	On-Demand	Mild	CASR	45	48
COCC1CC(NC[C@@H](O)COc2ccccc2C#N)C1	ZINC000872236785	CD	On-Demand	Mild	CYP2D6	21	51
COCC1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872236786	CD	On-Demand	Mild	ADRB2	32	60
COCC1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872236786	CD	On-Demand	Mild	ADRB1	74	47
COCC1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872236786	CD	On-Demand	Mild	ADRB3	15	51
COCC1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872236786	CD	On-Demand	Mild	CASR	45	48
COCC1CC(NC[C@H](O)COc2ccccc2C#N)C1	ZINC000872236786	CD	On-Demand	Mild	CYP2D6	21	51
NC(=O)C1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236791	ED	On-Demand	Anodyne	ADRB2	55	45
NC(=O)C1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236791	ED	On-Demand	Anodyne	ADRB1	78	43
NC(=O)C1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236791	ED	On-Demand	Anodyne	ADRB3	62	43
NC(=O)C1CC(NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236791	ED	On-Demand	Anodyne	ABCB1	18	41
NC(=O)C1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236792	ED	On-Demand	Anodyne	ADRB2	55	45
NC(=O)C1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236792	ED	On-Demand	Anodyne	ADRB1	78	43
NC(=O)C1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236792	ED	On-Demand	Anodyne	ADRB3	62	43
NC(=O)C1CC(NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872236792	ED	On-Demand	Anodyne	ABCB1	18	41
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236799	CG	On-Demand	Anodyne	ADRB3	18	47
O[C@@H](CN[C@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236799	CG	On-Demand	Anodyne	AOC3	15	47
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236800	CG	On-Demand	Anodyne	ADRB3	18	47
O[C@@H](CN[C@@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236800	CG	On-Demand	Anodyne	AOC3	15	47
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236801	CG	On-Demand	Anodyne	ADRB3	18	47
O[C@H](CN[C@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236801	CG	On-Demand	Anodyne	AOC3	15	47
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236802	CG	On-Demand	Anodyne	ADRB3	18	47
O[C@H](CN[C@@H](CF)c1ccc(F)cc1)c1ccccc1	ZINC000872236802	CG	On-Demand	Anodyne	AOC3	15	47
COCC1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236808	DD	On-Demand	Anodyne	ADRB2	35	43
COCC1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236808	DD	On-Demand	Anodyne	ADRB1	50	45
COCC1CC(NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236808	DD	On-Demand	Anodyne	ADRB3	31	43
COCC1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236809	DD	On-Demand	Anodyne	ADRB2	35	43
COCC1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236809	DD	On-Demand	Anodyne	ADRB1	50	45
COCC1CC(NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000872236809	DD	On-Demand	Anodyne	ADRB3	31	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236857	FD	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236857	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236857	FD	On-Demand	Anodyne	ADRB3	46	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236857	FD	On-Demand	Anodyne	ABCB1	20	45
CN1Cc2ccccc2[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872236858	DG	On-Demand	Anodyne	ADRB3	40	38
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872236859	DG	On-Demand	Anodyne	ADRB3	40	38
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872236860	DG	On-Demand	Anodyne	ADRB3	40	38
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872236861	DG	On-Demand	Anodyne	ADRB3	40	38
Cc1ccc(CN2CCO[C@H](CN[C@@H]3CCCC[C@H]3O)C2)cc1	ZINC000872236880	DE	On-Demand	Anodyne	DRD4	17	46
Cc1ccc(CN2CCO[C@H](CNCC3(O)CCCC3)C2)cc1	ZINC000872236882	DE	On-Demand	Anodyne	DRD4	15	45
COC[C@@H](O)CNC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000872236887	DC	On-Demand	Anodyne	DRD4	15	43
Cc1cccc(CN2CCO[C@@H](CNCC3(O)CCC3)C2)c1	ZINC000872236895	DD	On-Demand	Anodyne	DRD4	15	41
Cc1cccc(CN2CCO[C@H](CNCC3(O)CCC3)C2)c1	ZINC000872236896	DD	On-Demand	Anodyne	DRD4	15	41
Cc1ccc(CN2CCO[C@H](CNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000872236910	GE	On-Demand	Bother	KCNJ1	21	43
Cc1ccc(CN2CCO[C@H](CNC[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000872236911	GE	On-Demand	Bother	KCNJ1	21	43
Cc1cccc(CN2CCO[C@@H](CNCCC(N)=O)C2)c1	ZINC000872236922	CC	On-Demand	Anodyne	DRD4	30	42
Cc1cccc(CN2CCO[C@H](CNCCC(N)=O)C2)c1	ZINC000872236923	CC	On-Demand	Anodyne	DRD4	30	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236944	FE	On-Demand	Anodyne	ADRB2	36	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236944	FE	On-Demand	Anodyne	ADRB1	67	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236944	FE	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236944	FE	On-Demand	Anodyne	ABCB1	23	55
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236945	FE	On-Demand	Anodyne	ADRB2	36	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236945	FE	On-Demand	Anodyne	ADRB1	67	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236945	FE	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236945	FE	On-Demand	Anodyne	ABCB1	23	55
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236946	FE	On-Demand	Anodyne	ADRB2	36	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236946	FE	On-Demand	Anodyne	ADRB1	67	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236946	FE	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236946	FE	On-Demand	Anodyne	ABCB1	23	55
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236947	FE	On-Demand	Anodyne	ADRB2	36	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236947	FE	On-Demand	Anodyne	ADRB1	67	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236947	FE	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236947	FE	On-Demand	Anodyne	ABCB1	23	55
O[C@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccc(F)cc1	ZINC000872236952	GF	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccc(F)cc1	ZINC000872236953	GF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236958	GF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236958	GF	On-Demand	Anodyne	ADRB1	76	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236958	GF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236958	GF	On-Demand	Anodyne	ABCB1	43	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236959	GF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236959	GF	On-Demand	Anodyne	ADRB1	76	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236959	GF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2c3ccccc3CN2C)cc1	ZINC000872236959	GF	On-Demand	Anodyne	ABCB1	43	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236960	GF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236960	GF	On-Demand	Anodyne	ADRB1	76	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236960	GF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236960	GF	On-Demand	Anodyne	ABCB1	43	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236961	GF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236961	GF	On-Demand	Anodyne	ADRB1	76	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236961	GF	On-Demand	Anodyne	ADRB3	54	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2c3ccccc3CN2C)cc1	ZINC000872236961	GF	On-Demand	Anodyne	ABCB1	43	44
Cc1cccc(CN2CCO[C@@H](CNCCS(=O)(=O)c3ccccc3)C2)c1	ZINC000872236969	GE	On-Demand	Anodyne	DRD4	19	43
Cc1cccc(CN2CCO[C@H](CNCCS(=O)(=O)c3ccccc3)C2)c1	ZINC000872236970	GE	On-Demand	Anodyne	DRD4	19	43
Cc1ccc(CN2CCO[C@H](CNCCS(C)(=O)=O)C2)cc1	ZINC000872236982	EC	On-Demand	Anodyne	DRD4	20	44
O[C@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccccc1	ZINC000872236993	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccccc1	ZINC000872236993	FF	On-Demand	Anodyne	ADRB1	54	39
O[C@@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccccc1	ZINC000872236994	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](CNCc1nc(C(F)(F)F)n2c1CCCC2)COc1ccccc1	ZINC000872236994	FF	On-Demand	Anodyne	ADRB1	54	39
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237002	EE	On-Demand	Mild	ADRB2	19	54
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237002	EE	On-Demand	Mild	ADRB1	65	48
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237002	EE	On-Demand	Mild	CASR	42	43
CN1Cc2ccccc2[C@@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237002	EE	On-Demand	Mild	CYP2D6	19	44
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237003	EE	On-Demand	Mild	ADRB2	19	54
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237003	EE	On-Demand	Mild	ADRB1	65	48
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237003	EE	On-Demand	Mild	CASR	42	43
CN1Cc2ccccc2[C@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237003	EE	On-Demand	Mild	CYP2D6	19	44
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237004	EE	On-Demand	Mild	ADRB2	19	54
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237004	EE	On-Demand	Mild	ADRB1	65	48
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237004	EE	On-Demand	Mild	CASR	42	43
CN1Cc2ccccc2[C@@H]1CNC[C@@H](O)COc1ccccc1C#N	ZINC000872237004	EE	On-Demand	Mild	CYP2D6	19	44
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237005	EE	On-Demand	Mild	ADRB2	19	54
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237005	EE	On-Demand	Mild	ADRB1	65	48
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237005	EE	On-Demand	Mild	CASR	42	43
CN1Cc2ccccc2[C@H]1CNC[C@H](O)COc1ccccc1C#N	ZINC000872237005	EE	On-Demand	Mild	CYP2D6	19	44
NC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237061	ED	On-Demand	Anodyne	ADRB2	31	41
NC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237061	ED	On-Demand	Anodyne	ADRB1	50	39
NC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237061	ED	On-Demand	Anodyne	GRIN1	25	40
NC(=O)C1CC(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237061	ED	On-Demand	Anodyne	CCR3	16	48
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237062	ED	On-Demand	Anodyne	ADRB2	31	41
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237062	ED	On-Demand	Anodyne	ADRB1	50	39
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237062	ED	On-Demand	Anodyne	GRIN1	25	40
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000872237062	ED	On-Demand	Anodyne	CCR3	16	48
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCOCC2)C1	ZINC000872237063	DD	On-Demand	Anodyne	SLC12A5	53	34
N#CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237079	DE	On-Demand	Mild	ADRB1	32	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237080	DE	On-Demand	Mild	ADRB1	32	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237081	DE	On-Demand	Mild	ADRB1	32	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237082	DE	On-Demand	Mild	ADRB1	32	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872237083	CE	On-Demand	Anodyne	ADRB2	40	48
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872237083	CE	On-Demand	Anodyne	ADRB1	53	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1	ZINC000872237083	CE	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872237084	CE	On-Demand	Anodyne	ADRB2	40	48
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872237084	CE	On-Demand	Anodyne	ADRB1	53	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1	ZINC000872237084	CE	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872237085	CE	On-Demand	Anodyne	ADRB2	40	48
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872237085	CE	On-Demand	Anodyne	ADRB1	53	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1	ZINC000872237085	CE	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872237086	CE	On-Demand	Anodyne	ADRB2	40	48
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872237086	CE	On-Demand	Anodyne	ADRB1	53	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1	ZINC000872237086	CE	On-Demand	Anodyne	ADRB3	33	40
CC(C)(O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237087	CD	On-Demand	Anodyne	FKBP1A	27	48
CC(C)(O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237087	CD	On-Demand	Anodyne	AMY2	42	29
CC(C)(O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237087	CD	On-Demand	Anodyne	CAPNS1	41	30
CC(C)(O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237087	CD	On-Demand	Anodyne	SLC12A5	46	34
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000872237112	CF	On-Demand	Anodyne	C3AR1	37	40
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000872237113	CF	On-Demand	Anodyne	C3AR1	37	40
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000872237114	CF	On-Demand	Anodyne	C3AR1	37	40
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000872237115	CF	On-Demand	Anodyne	C3AR1	37	40
NC(=O)C1CC(NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000872237127	ED	On-Demand	Anodyne	HDAC10	15	54
COc1ccc(OC)c([C@H](O)CNC2CC(C(N)=O)C2)c1	ZINC000872237141	CC	On-Demand	Anodyne	MTNR1A	29	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	AVPR2	40	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	AVPR1A	22	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	PRNP	60	40
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	EPHX2	17	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	MLYCD	19	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872237158	HG	On-Demand	Anodyne	L3MBTL3	70	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1cccc2[nH]ccc12	ZINC000872237167	DF	On-Demand	Anodyne	ADRB2	16	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1cccc2[nH]ccc12	ZINC000872237167	DF	On-Demand	Anodyne	ADRB1	22	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1cccc2[nH]ccc12	ZINC000872237167	DF	On-Demand	Anodyne	HTR1A	15	68
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1cccc2[nH]ccc12	ZINC000872237167	DF	On-Demand	Anodyne	SLC6A4	18	43
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1cccc2[nH]ccc12	ZINC000872237168	DF	On-Demand	Anodyne	ADRB2	16	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1cccc2[nH]ccc12	ZINC000872237168	DF	On-Demand	Anodyne	ADRB1	22	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1cccc2[nH]ccc12	ZINC000872237168	DF	On-Demand	Anodyne	HTR1A	15	68
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1cccc2[nH]ccc12	ZINC000872237168	DF	On-Demand	Anodyne	SLC6A4	18	43
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1cccc2[nH]ccc12	ZINC000872237169	DF	On-Demand	Anodyne	ADRB2	16	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1cccc2[nH]ccc12	ZINC000872237169	DF	On-Demand	Anodyne	ADRB1	22	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1cccc2[nH]ccc12	ZINC000872237169	DF	On-Demand	Anodyne	HTR1A	15	68
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1cccc2[nH]ccc12	ZINC000872237169	DF	On-Demand	Anodyne	SLC6A4	18	43
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1cccc2[nH]ccc12	ZINC000872237170	DF	On-Demand	Anodyne	ADRB2	16	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1cccc2[nH]ccc12	ZINC000872237170	DF	On-Demand	Anodyne	ADRB1	22	67
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1cccc2[nH]ccc12	ZINC000872237170	DF	On-Demand	Anodyne	HTR1A	15	68
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1cccc2[nH]ccc12	ZINC000872237170	DF	On-Demand	Anodyne	SLC6A4	18	43
C#CCNC(=O)CCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237173	DD	On-Demand	Mild	CAPNS1	42	31
C#CCNC(=O)CCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237173	DD	On-Demand	Mild	CAPN1	38	41
C#CCNC(=O)CCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237173	DD	On-Demand	Mild	CAPN2	63	41
NC(=O)C1CC(NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000872237193	CD	On-Demand	Anodyne	ADRB3	23	43
NC(=O)C1CC(NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000872237194	CD	On-Demand	Anodyne	ADRB3	23	43
NC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237199	ED	On-Demand	Anodyne	ADRB2	23	42
NC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237199	ED	On-Demand	Anodyne	ADRB1	23	42
NC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237199	ED	On-Demand	Anodyne	PTGFR	48	40
NC(=O)C1CC(NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237199	ED	On-Demand	Anodyne	PDS	54	43
NC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237200	ED	On-Demand	Anodyne	ADRB2	23	42
NC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237200	ED	On-Demand	Anodyne	ADRB1	23	42
NC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237200	ED	On-Demand	Anodyne	PTGFR	48	40
NC(=O)C1CC(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872237200	ED	On-Demand	Anodyne	PDS	54	43
CCOC(=O)C1CCC(O)(CN[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000872237205	FG	On-Demand	Anodyne	FKBP1A	20	40
CCOC(=O)C1CCC(O)(CN[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000872237205	FG	On-Demand	Anodyne	TIMP3	35	41
CCOC(=O)C1CCC(O)(CN[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000872237206	FG	On-Demand	Anodyne	FKBP1A	20	40
CCOC(=O)C1CCC(O)(CN[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000872237206	FG	On-Demand	Anodyne	TIMP3	35	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237210	ED	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237210	ED	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237210	ED	On-Demand	Anodyne	ADRB3	25	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237211	ED	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237211	ED	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237211	ED	On-Demand	Anodyne	ADRB3	25	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237212	ED	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237212	ED	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237212	ED	On-Demand	Anodyne	ADRB3	25	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237213	ED	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237213	ED	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237213	ED	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)Cc1ccccc1	ZINC000872237214	DG	On-Demand	Anodyne	C3AR1	37	41
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)Cc1ccccc1	ZINC000872237215	DG	On-Demand	Anodyne	C3AR1	37	41
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)Cc1ccccc1	ZINC000872237216	DG	On-Demand	Anodyne	C3AR1	37	41
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)Cc1ccccc1	ZINC000872237217	DG	On-Demand	Anodyne	C3AR1	37	41
N#Cc1ccccc1OC[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237236	FG	On-Demand	Mild	ADRB2	17	54
N#Cc1ccccc1OC[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237236	FG	On-Demand	Mild	ADRB1	71	41
N#Cc1ccccc1OC[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237236	FG	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237236	FG	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237237	FG	On-Demand	Mild	ADRB2	17	54
N#Cc1ccccc1OC[C@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237237	FG	On-Demand	Mild	ADRB1	71	41
N#Cc1ccccc1OC[C@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237237	FG	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237237	FG	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237238	FG	On-Demand	Mild	ADRB2	17	54
N#Cc1ccccc1OC[C@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237238	FG	On-Demand	Mild	ADRB1	71	41
N#Cc1ccccc1OC[C@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237238	FG	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237238	FG	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237239	FG	On-Demand	Mild	ADRB2	17	54
N#Cc1ccccc1OC[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237239	FG	On-Demand	Mild	ADRB1	71	41
N#Cc1ccccc1OC[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237239	FG	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237239	FG	On-Demand	Mild	CYP2D6	17	43
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCCC2)C1	ZINC000872237265	DE	On-Demand	Anodyne	FKBP1A	21	47
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCCC2)C1	ZINC000872237265	DE	On-Demand	Anodyne	CTSK	15	43
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCCC2)C1	ZINC000872237265	DE	On-Demand	Anodyne	SLC12A5	71	38
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237266	GG	On-Demand	Anodyne	ADRB2	51	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237266	GG	On-Demand	Anodyne	ADRB1	84	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237266	GG	On-Demand	Anodyne	ADRB3	77	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237266	GG	On-Demand	Anodyne	CHRNA7	27	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237267	GG	On-Demand	Anodyne	ADRB2	51	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237267	GG	On-Demand	Anodyne	ADRB1	84	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237267	GG	On-Demand	Anodyne	ADRB3	77	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237267	GG	On-Demand	Anodyne	CHRNA7	27	40
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237268	GG	On-Demand	Anodyne	ADRB2	51	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237268	GG	On-Demand	Anodyne	ADRB1	84	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237268	GG	On-Demand	Anodyne	ADRB3	77	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237268	GG	On-Demand	Anodyne	CHRNA7	27	40
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237269	GG	On-Demand	Anodyne	ADRB2	51	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237269	GG	On-Demand	Anodyne	ADRB1	84	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237269	GG	On-Demand	Anodyne	ADRB3	77	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237269	GG	On-Demand	Anodyne	CHRNA7	27	40
NC(=O)NC(=O)CCN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237270	DD	On-Demand	Anodyne	C3AR1	46	45
NC(=O)NC(=O)CCN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237271	DD	On-Demand	Anodyne	C3AR1	46	45
Cc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)c(C)c1	ZINC000872237272	CC	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)c(C)c1	ZINC000872237273	CC	On-Demand	Anodyne	ADRB2	25	45
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237274	CD	On-Demand	Mild	ADRB1	26	40
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237275	CD	On-Demand	Mild	ADRB1	26	40
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237276	CD	On-Demand	Mild	ADRB1	26	40
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237277	CD	On-Demand	Mild	ADRB1	26	40
CC(C)(C#N)C[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237310	EE	On-Demand	Mild	CTSK	19	41
CC(C)(C#N)C[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237310	EE	On-Demand	Mild	CTSL	19	40
CC(C)(C#N)C[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237311	EE	On-Demand	Mild	CTSK	19	41
CC(C)(C#N)C[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237311	EE	On-Demand	Mild	CTSL	19	40
COC[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237316	CD	On-Demand	Anodyne	CTSK	24	40
COC[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237316	CD	On-Demand	Anodyne	CAPNS1	55	31
COC[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237316	CD	On-Demand	Anodyne	ABCB1	15	44
COC[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237316	CD	On-Demand	Anodyne	CAPN1	42	34
COC[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237316	CD	On-Demand	Anodyne	CAPN2	59	33
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237352	EE	On-Demand	Anodyne	ADRB2	32	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237352	EE	On-Demand	Anodyne	ADRB1	56	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237352	EE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237353	EE	On-Demand	Anodyne	ADRB2	32	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237353	EE	On-Demand	Anodyne	ADRB1	56	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237353	EE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237354	EE	On-Demand	Anodyne	ADRB2	32	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237354	EE	On-Demand	Anodyne	ADRB1	56	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237354	EE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237355	EE	On-Demand	Anodyne	ADRB2	32	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237355	EE	On-Demand	Anodyne	ADRB1	56	57
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237355	EE	On-Demand	Anodyne	ADRB3	34	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237356	DE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237356	DE	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237357	DE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237357	DE	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237358	DE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237358	DE	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237359	DE	On-Demand	Anodyne	ADRB2	26	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237359	DE	On-Demand	Anodyne	ADRB1	32	40
NC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237360	ED	On-Demand	Anodyne	ADRB2	27	43
NC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237360	ED	On-Demand	Anodyne	ADRB1	56	33
NC(=O)C1CC(NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237360	ED	On-Demand	Anodyne	ABCB1	25	47
NC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237361	ED	On-Demand	Anodyne	ADRB2	27	43
NC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237361	ED	On-Demand	Anodyne	ADRB1	56	33
NC(=O)C1CC(NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872237361	ED	On-Demand	Anodyne	ABCB1	25	47
NC(=O)C1CC(NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000872237362	ED	On-Demand	Anodyne	ADRB3	20	41
NC(=O)C1CC(NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000872237363	ED	On-Demand	Anodyne	ADRB3	20	41
C[C@@](O)(CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C(F)(F)F	ZINC000872237370	EE	On-Demand	Anodyne	FKBP1A	17	45
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237372	FG	On-Demand	Bother	ADRB3	32	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237372	FG	On-Demand	Bother	C3AR1	38	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237373	FG	On-Demand	Bother	ADRB3	32	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237373	FG	On-Demand	Bother	C3AR1	38	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237374	FG	On-Demand	Bother	ADRB3	32	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237374	FG	On-Demand	Bother	C3AR1	38	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237375	FG	On-Demand	Bother	ADRB3	32	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872237375	FG	On-Demand	Bother	C3AR1	38	44
COc1ccc2c(C)c(CCC(=O)Nc3ccc(C(=O)N4CCCC4)cc3)c(=O)oc2c1	ZINC000872237380	IH	On-Demand	Anodyne	MAOB	32	43
COc1ccc2c(C)c(CCC(=O)Nc3ccc(C(=O)N4CCCC4)cc3)c(=O)oc2c1	ZINC000872237380	IH	On-Demand	Anodyne	NQO1	17	42
NC(=O)C1CC(NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872237383	CD	On-Demand	Anodyne	FCER2	27	40
NC(=O)C1CC(NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872237383	CD	On-Demand	Anodyne	TRY2_BOVIN	62	34
NC(=O)C1CC(NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872237384	CD	On-Demand	Anodyne	FCER2	27	40
NC(=O)C1CC(NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000872237384	CD	On-Demand	Anodyne	TRY2_BOVIN	62	34
CC(C)(O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237385	CF	On-Demand	Anodyne	C3AR1	41	42
CC(C)(O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237386	CF	On-Demand	Anodyne	C3AR1	41	42
NC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237413	DC	On-Demand	Anodyne	DRD4	21	40
NC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237413	DC	On-Demand	Anodyne	SIGMAR1	56	42
NC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237413	DC	On-Demand	Anodyne	NPFFR2	41	44
NC(=O)C1CC(NC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237413	DC	On-Demand	Anodyne	NPFFR1	55	47
NC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237414	DC	On-Demand	Anodyne	DRD4	21	40
NC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237414	DC	On-Demand	Anodyne	SIGMAR1	56	42
NC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237414	DC	On-Demand	Anodyne	NPFFR2	41	44
NC(=O)C1CC(NC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872237414	DC	On-Demand	Anodyne	NPFFR1	55	47
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)c1ccccc1	ZINC000872237447	BE	On-Demand	Anodyne	MGAM	15	51
O[C@@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)c1ccccc1	ZINC000872237448	BE	On-Demand	Anodyne	MGAM	15	51
O[C@@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)c1ccccc1	ZINC000872237449	BE	On-Demand	Anodyne	MGAM	15	51
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)c1ccccc1	ZINC000872237450	BE	On-Demand	Anodyne	MGAM	15	51
O[C@@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1ccccc1	ZINC000872237451	BE	On-Demand	Anodyne	MGAM	15	51
O[C@@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)c1ccccc1	ZINC000872237452	BE	On-Demand	Anodyne	MGAM	15	51
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)c1ccccc1	ZINC000872237453	BE	On-Demand	Anodyne	MGAM	15	51
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1ccccc1	ZINC000872237454	BE	On-Demand	Anodyne	MGAM	15	51
CSc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237457	DD	On-Demand	Anodyne	ADRB2	40	41
CSc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237457	DD	On-Demand	Anodyne	ADRB1	54	44
CSc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237457	DD	On-Demand	Anodyne	ADRB3	38	42
CSc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237458	DD	On-Demand	Anodyne	ADRB2	40	41
CSc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237458	DD	On-Demand	Anodyne	ADRB1	54	44
CSc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237458	DD	On-Demand	Anodyne	ADRB3	38	42
CON(C)C(=O)CCN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237467	DE	On-Demand	Anodyne	C3AR1	41	41
CON(C)C(=O)CCN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237468	DE	On-Demand	Anodyne	C3AR1	41	41
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	ACE	46	42
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	PTGFR	33	42
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	MME	26	42
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	ANPEP	49	37
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	ABCB1	15	42
NC(=O)C1CC(NC[C@H](O)CCc2ccccc2)C1	ZINC000872237469	CC	On-Demand	Anodyne	LAP3	45	37
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	ACE	46	42
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	PTGFR	33	42
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	MME	26	42
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	ANPEP	49	37
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	ABCB1	15	42
NC(=O)C1CC(NC[C@@H](O)CCc2ccccc2)C1	ZINC000872237470	CC	On-Demand	Anodyne	LAP3	45	37
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)c1cccc(Cl)c1	ZINC000872237481	CG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)c1cccc(Cl)c1	ZINC000872237481	CG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1cccc(Cl)c1	ZINC000872237482	CG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1cccc(Cl)c1	ZINC000872237482	CG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)c1cccc(Cl)c1	ZINC000872237483	CG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)c1cccc(Cl)c1	ZINC000872237483	CG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)c1cccc(Cl)c1	ZINC000872237484	CG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)c1cccc(Cl)c1	ZINC000872237484	CG	On-Demand	Anodyne	ADRB3	40	42
N#CCC[C@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237527	DF	On-Demand	Mild	CTSB	25	43
N#CCC[C@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237527	DF	On-Demand	Mild	CTSK	23	43
N#CCC[C@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237527	DF	On-Demand	Mild	CTSL	34	43
N#CCC[C@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237527	DF	On-Demand	Mild	CAPNS1	54	31
N#CCC[C@@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237528	DF	On-Demand	Mild	CTSB	25	43
N#CCC[C@@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237528	DF	On-Demand	Mild	CTSK	23	43
N#CCC[C@@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237528	DF	On-Demand	Mild	CTSL	34	43
N#CCC[C@@H](C#N)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237528	DF	On-Demand	Mild	CAPNS1	54	31
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237529	DE	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237530	DE	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237531	DE	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237532	DE	On-Demand	Anodyne	ADRB2	21	44
O=S(=O)(CCN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237541	FG	On-Demand	Anodyne	TBXAS1	24	42
O=S(=O)(CCN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237542	FG	On-Demand	Anodyne	TBXAS1	24	42
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237543	DH	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237543	DH	On-Demand	Anodyne	ADRB3	54	44
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237543	DH	On-Demand	Anodyne	C3AR1	41	45
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237544	DH	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237544	DH	On-Demand	Anodyne	ADRB3	54	44
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237544	DH	On-Demand	Anodyne	C3AR1	41	45
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237545	DH	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237545	DH	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237545	DH	On-Demand	Anodyne	C3AR1	41	45
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237546	DH	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237546	DH	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000872237546	DH	On-Demand	Anodyne	C3AR1	41	45
C[C@@H](CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)S(C)(=O)=O	ZINC000872237550	ED	On-Demand	Anodyne	CAPNS1	62	32
C[C@@H](CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)S(C)(=O)=O	ZINC000872237550	ED	On-Demand	Anodyne	CAPN1	65	36
C[C@@H](CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)S(C)(=O)=O	ZINC000872237550	ED	On-Demand	Anodyne	CAPN2	90	34
C[C@@H](CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)S(C)(=O)=O	ZINC000872237550	ED	On-Demand	Anodyne	NPR	58	34
N#CCCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237566	CE	On-Demand	Mild	CTSK	19	44
N#CCCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237566	CE	On-Demand	Mild	CTSL	19	44
N#CCCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237566	CE	On-Demand	Mild	PREP	15	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237571	GG	On-Demand	Anodyne	REN	50	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237572	GG	On-Demand	Anodyne	REN	50	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237573	GG	On-Demand	Anodyne	REN	50	41
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237574	GG	On-Demand	Anodyne	REN	50	41
O=C1c2ccccc2C(=O)N1C[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237623	GE	On-Demand	Anodyne	C3AR1	40	40
O=C1c2ccccc2C(=O)N1C[C@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237624	GE	On-Demand	Anodyne	C3AR1	40	40
O=C1c2ccccc2C(=O)N1C[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237625	GE	On-Demand	Anodyne	C3AR1	40	40
O=C1c2ccccc2C(=O)N1C[C@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237626	GE	On-Demand	Anodyne	C3AR1	40	40
O[C@@H]1CCCC[C@H]1N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237635	CG	On-Demand	Anodyne	C3AR1	41	43
O[C@@H]1CCCC[C@H]1N[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237636	CG	On-Demand	Anodyne	C3AR1	41	43
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	LTA4H	24	43
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	HDAC10	21	44
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	HDAC2	15	44
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	HDAC3	17	44
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	HDAC6	17	44
NC(=O)C1CC(NCCC(=O)Nc2ccccc2)C1	ZINC000872237637	CC	On-Demand	Anodyne	HDAC11	15	44
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCS(=O)(=O)CC2)C1	ZINC000872237639	FD	On-Demand	Anodyne	SLC12A5	52	34
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)Cc1ccc(F)cc1	ZINC000872237640	EH	On-Demand	Anodyne	C3AR1	31	43
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)Cc1ccc(F)cc1	ZINC000872237641	EH	On-Demand	Anodyne	C3AR1	31	43
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)Cc1ccc(F)cc1	ZINC000872237642	EH	On-Demand	Anodyne	C3AR1	31	43
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)Cc1ccc(F)cc1	ZINC000872237643	EH	On-Demand	Anodyne	C3AR1	31	43
NC(=O)C1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872237648	DD	On-Demand	Anodyne	ADRB3	24	43
NC(=O)C1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872237649	DD	On-Demand	Anodyne	ADRB3	24	43
NC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237650	DD	On-Demand	Anodyne	ADRB2	44	54
NC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237650	DD	On-Demand	Anodyne	ADRB1	54	40
NC(=O)C1CC(NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237650	DD	On-Demand	Anodyne	ADRB3	42	40
NC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237651	DD	On-Demand	Anodyne	ADRB2	44	54
NC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237651	DD	On-Demand	Anodyne	ADRB1	54	40
NC(=O)C1CC(NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872237651	DD	On-Demand	Anodyne	ADRB3	42	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1Cl	ZINC000872237652	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1Cl	ZINC000872237652	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1Cl	ZINC000872237653	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1Cl	ZINC000872237653	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1Cl	ZINC000872237654	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1Cl	ZINC000872237654	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1Cl	ZINC000872237655	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1Cl	ZINC000872237655	DF	On-Demand	Anodyne	ADRB1	24	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237656	GF	On-Demand	Anodyne	ADRB1	17	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237656	GF	On-Demand	Anodyne	ADRB3	78	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237657	GF	On-Demand	Anodyne	ADRB1	17	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237657	GF	On-Demand	Anodyne	ADRB3	78	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237658	GF	On-Demand	Anodyne	ADRB1	17	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237658	GF	On-Demand	Anodyne	ADRB3	78	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237659	GF	On-Demand	Anodyne	ADRB1	17	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872237659	GF	On-Demand	Anodyne	ADRB3	78	43
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1cccnc1	ZINC000872237672	EG	On-Demand	Anodyne	C3AR1	41	42
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1cccnc1	ZINC000872237672	EG	On-Demand	Anodyne	NAMPT	43	44
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1cccnc1	ZINC000872237673	EG	On-Demand	Anodyne	C3AR1	41	42
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1cccnc1	ZINC000872237673	EG	On-Demand	Anodyne	NAMPT	43	44
NC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872237676	BC	On-Demand	Anodyne	MME	75	41
NC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872237676	BC	On-Demand	Anodyne	ANPEP	52	36
NC(=O)C1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000872237676	BC	On-Demand	Anodyne	CPA1	45	42
NC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872237677	BC	On-Demand	Anodyne	MME	75	41
NC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872237677	BC	On-Demand	Anodyne	ANPEP	52	36
NC(=O)C1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000872237677	BC	On-Demand	Anodyne	CPA1	45	42
NC(=O)C1CC(NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000872237686	CD	On-Demand	Anodyne	F13A1	22	47
C[C@@](O)(C[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237700	EE	On-Demand	Anodyne	FKBP1A	17	41
C[C@@](O)(C[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237700	EE	On-Demand	Anodyne	AMY2	45	30
C[C@@](O)(C[C@@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237700	EE	On-Demand	Anodyne	CAPN2	50	33
C[C@@](O)(C[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237701	EE	On-Demand	Anodyne	FKBP1A	17	41
C[C@@](O)(C[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237701	EE	On-Demand	Anodyne	AMY2	45	30
C[C@@](O)(C[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)C1CC1	ZINC000872237701	EE	On-Demand	Anodyne	CAPN2	50	33
NC(=O)C1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237703	FE	On-Demand	Anodyne	ADRB2	53	45
NC(=O)C1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237703	FE	On-Demand	Anodyne	ADRB1	78	45
NC(=O)C1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237703	FE	On-Demand	Anodyne	ADRB3	64	45
NC(=O)C1CC(NC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237703	FE	On-Demand	Anodyne	ABCB1	21	41
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237704	FE	On-Demand	Anodyne	ADRB2	53	45
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237704	FE	On-Demand	Anodyne	ADRB1	78	45
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237704	FE	On-Demand	Anodyne	ADRB3	64	45
NC(=O)C1CC(NC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872237704	FE	On-Demand	Anodyne	ABCB1	21	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237706	EF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237706	EF	On-Demand	Anodyne	ADRB1	63	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872237706	EF	On-Demand	Anodyne	ADRB3	42	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237707	EF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237707	EF	On-Demand	Anodyne	ADRB1	63	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872237707	EF	On-Demand	Anodyne	ADRB3	42	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237708	EF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237708	EF	On-Demand	Anodyne	ADRB1	63	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872237708	EF	On-Demand	Anodyne	ADRB3	42	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237709	EF	On-Demand	Anodyne	ADRB2	34	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237709	EF	On-Demand	Anodyne	ADRB1	63	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872237709	EF	On-Demand	Anodyne	ADRB3	42	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000872237719	JH	On-Demand	Anodyne	AVPR2	51	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000872237719	JH	On-Demand	Anodyne	AVPR1A	24	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000872237719	JH	On-Demand	Anodyne	PRNP	52	37
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000872237719	JH	On-Demand	Anodyne	BTK	41	37
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000872237719	JH	On-Demand	Anodyne	L3MBTL3	69	40
C[C@@H](CN[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1)S(C)(=O)=O	ZINC000872237727	EF	On-Demand	Anodyne	GRIA4	15	43
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872237736	EE	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872237736	EE	On-Demand	Anodyne	ADRB1	22	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872237737	EE	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872237737	EE	On-Demand	Anodyne	ADRB1	22	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872237738	EE	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872237738	EE	On-Demand	Anodyne	ADRB1	22	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872237739	EE	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872237739	EE	On-Demand	Anodyne	ADRB1	22	41
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237757	DD	On-Demand	Mild	ADRB2	28	65
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237757	DD	On-Demand	Mild	ADRB1	70	46
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237757	DD	On-Demand	Mild	CASR	43	45
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237757	DD	On-Demand	Mild	CYP2D6	19	45
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237759	DD	On-Demand	Mild	ADRB2	28	65
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237759	DD	On-Demand	Mild	ADRB1	70	46
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237759	DD	On-Demand	Mild	CASR	43	45
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccnn1C	ZINC000872237759	DD	On-Demand	Mild	CYP2D6	19	45
NC(=O)CCN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237770	CD	On-Demand	Anodyne	TBXAS1	22	41
NC(=O)CCN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872237770	CD	On-Demand	Anodyne	C3AR1	45	44
NC(=O)CCN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237771	CD	On-Demand	Anodyne	TBXAS1	22	41
NC(=O)CCN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872237771	CD	On-Demand	Anodyne	C3AR1	45	44
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000872237774	EG	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000872237775	EG	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000872237776	EG	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000872237777	EG	On-Demand	Mild	ADRB3	19	42
C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccnn1C	ZINC000872237778	FE	On-Demand	Anodyne	ADRB2	28	47
C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccnn1C	ZINC000872237778	FE	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccnn1C	ZINC000872237779	FE	On-Demand	Anodyne	ADRB2	28	47
C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccnn1C	ZINC000872237779	FE	On-Demand	Anodyne	ADRB1	29	47
CCOc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237813	DC	On-Demand	Anodyne	ADRB2	49	48
CCOc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237813	DC	On-Demand	Anodyne	ADRB1	62	45
CCOc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237813	DC	On-Demand	Anodyne	ADRB3	43	43
CCOc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237815	DC	On-Demand	Anodyne	ADRB2	49	48
CCOc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237815	DC	On-Demand	Anodyne	ADRB1	62	45
CCOc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872237815	DC	On-Demand	Anodyne	ADRB3	43	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237820	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237820	GG	On-Demand	Anodyne	ADRB1	65	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237820	GG	On-Demand	Anodyne	GRIN1	19	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237820	GG	On-Demand	Anodyne	ADRB3	41	41
NC(=O)C1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872237827	ED	On-Demand	Anodyne	ADRB2	22	41
NC(=O)C1CC(NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872237827	ED	On-Demand	Anodyne	ADRB1	21	41
NC(=O)C1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872237828	ED	On-Demand	Anodyne	ADRB2	22	41
NC(=O)C1CC(NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000872237828	ED	On-Demand	Anodyne	ADRB1	21	41
CCOC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237831	DD	On-Demand	Anodyne	CAPNS1	42	32
CCOC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237831	DD	On-Demand	Anodyne	CAPN1	42	33
CCOC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237831	DD	On-Demand	Anodyne	CAPN2	61	33
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237835	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237835	GG	On-Demand	Anodyne	ADRB1	65	42
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237835	GG	On-Demand	Anodyne	GRIN1	19	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237835	GG	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccccc1F	ZINC000872237839	CE	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccccc1F	ZINC000872237841	CE	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccccc1F	ZINC000872237844	CE	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccccc1F	ZINC000872237847	CE	On-Demand	Anodyne	ADRB2	20	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872237852	EF	On-Demand	Mild	ADRB1	30	52
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872237855	EF	On-Demand	Mild	ADRB1	30	52
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872237857	EF	On-Demand	Mild	ADRB1	30	52
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872237859	EF	On-Demand	Mild	ADRB1	30	52
Cc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237875	EF	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237877	EF	On-Demand	Anodyne	ADRB2	26	44
N#Cc1ccc([C@@H](O)CN[C@@H]2C[C@@H](C(=O)OCc3ccccc3)C2)cc1	ZINC000872237900	FF	On-Demand	Mild	CTRB_BOVIN	48	33
N#Cc1ccc([C@H](O)CN[C@@H]2C[C@@H](C(=O)OCc3ccccc3)C2)cc1	ZINC000872237901	FF	On-Demand	Mild	CTRB_BOVIN	48	33
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)CN2CCCC2)C1	ZINC000872237902	ED	On-Demand	Anodyne	FKBP1A	33	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)CN2CCCC2)C1	ZINC000872237902	ED	On-Demand	Anodyne	ABCB1	53	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)CN2CCCC2)C1	ZINC000872237902	ED	On-Demand	Anodyne	SLC12A5	59	38
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)CN2CCCC2)C1	ZINC000872237903	ED	On-Demand	Anodyne	FKBP1A	33	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)CN2CCCC2)C1	ZINC000872237903	ED	On-Demand	Anodyne	ABCB1	53	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)CN2CCCC2)C1	ZINC000872237903	ED	On-Demand	Anodyne	SLC12A5	59	38
NC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872237914	CD	On-Demand	Anodyne	ADRB1	40	49
NC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872237914	CD	On-Demand	Anodyne	ADRB3	61	54
NC(=O)C1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872237914	CD	On-Demand	Anodyne	CYP3A4	46	35
NC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872237915	CD	On-Demand	Anodyne	ADRB1	40	49
NC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872237915	CD	On-Demand	Anodyne	ADRB3	61	54
NC(=O)C1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872237915	CD	On-Demand	Anodyne	CYP3A4	46	35
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	CTSB	45	36
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	CTSK	28	40
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	CAPNS1	57	32
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	CAPN1	61	37
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	CAPN2	104	37
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	NPR	52	36
CC[C@H](O)CN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872237930	CD	On-Demand	Anodyne	SLC12A5	42	33
CC(=O)c1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237988	FF	On-Demand	Anodyne	ADRB1	50	35
CC(=O)c1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872237989	FF	On-Demand	Anodyne	ADRB1	50	35
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237994	ED	On-Demand	Mild	ADRB2	27	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237994	ED	On-Demand	Mild	ADRB1	34	44
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237994	ED	On-Demand	Mild	ADRB3	24	41
N#Cc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237995	ED	On-Demand	Mild	ADRB2	27	41
N#Cc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237995	ED	On-Demand	Mild	ADRB1	34	44
N#Cc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237995	ED	On-Demand	Mild	ADRB3	24	41
N#Cc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237996	ED	On-Demand	Mild	ADRB2	27	41
N#Cc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237996	ED	On-Demand	Mild	ADRB1	34	44
N#Cc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237996	ED	On-Demand	Mild	ADRB3	24	41
N#Cc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237997	ED	On-Demand	Mild	ADRB2	27	41
N#Cc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237997	ED	On-Demand	Mild	ADRB1	34	44
N#Cc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872237997	ED	On-Demand	Mild	ADRB3	24	41
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238006	EF	On-Demand	Anodyne	ADRB2	26	44
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238006	EF	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238006	EF	On-Demand	Anodyne	GRIN1	24	40
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238008	EF	On-Demand	Anodyne	ADRB2	26	44
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238008	EF	On-Demand	Anodyne	ADRB1	25	42
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccnn1C	ZINC000872238008	EF	On-Demand	Anodyne	GRIN1	24	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(F)cc1)C2	ZINC000872238025	CE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000872238026	CE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(F)cc1)C2	ZINC000872238027	CE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000872238028	CE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@H](NCCC(=O)Nc1ccccc1)C2	ZINC000872238031	DF	On-Demand	Mild	PTPRF	41	32
N#Cc1ccc2c(c1)C[C@@H](NCCC(=O)Nc1ccccc1)C2	ZINC000872238032	DF	On-Demand	Mild	PTPRF	41	32
CC(=O)c1cccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)c1	ZINC000872238044	FF	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)c1	ZINC000872238044	FF	On-Demand	Anodyne	ABCB1	16	41
CC(=O)c1cccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)c1	ZINC000872238045	FF	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)c1	ZINC000872238045	FF	On-Demand	Anodyne	ABCB1	16	41
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1cccc(F)c1	ZINC000872238070	EH	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1cccc(F)c1	ZINC000872238071	EH	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1cccc(F)c1	ZINC000872238072	EH	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1cccc(F)c1	ZINC000872238073	EH	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccc(F)c(F)c1	ZINC000872238074	EH	On-Demand	Anodyne	C3AR1	38	42
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccc(F)c(F)c1	ZINC000872238075	EH	On-Demand	Anodyne	C3AR1	38	42
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccc(F)c(F)c1	ZINC000872238076	EH	On-Demand	Anodyne	C3AR1	38	42
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccc(F)c(F)c1	ZINC000872238077	EH	On-Demand	Anodyne	C3AR1	38	42
NC(=O)C1CC(NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000872238123	ED	On-Demand	Anodyne	EGFR	26	40
COCCc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238125	DC	On-Demand	Anodyne	ADRB2	52	58
COCCc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238125	DC	On-Demand	Anodyne	ADRB1	79	58
COCCc1ccc(OC[C@@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238125	DC	On-Demand	Anodyne	ADRB3	58	43
COCCc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238126	DC	On-Demand	Anodyne	ADRB2	52	58
COCCc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238126	DC	On-Demand	Anodyne	ADRB1	79	58
COCCc1ccc(OC[C@H](O)CNC2CC(C(N)=O)C2)cc1	ZINC000872238126	DC	On-Demand	Anodyne	ADRB3	58	43
N#Cc1cccc(S(=O)(=O)CCN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872238137	GG	On-Demand	Mild	ITGA4	51	32
N#Cc1cccc(S(=O)(=O)CCN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872238138	GG	On-Demand	Mild	ITGA4	51	32
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCC2)C1	ZINC000872238139	CE	On-Demand	Anodyne	FKBP1A	21	44
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCC2)C1	ZINC000872238139	CE	On-Demand	Anodyne	CTSK	15	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NCC2(O)CCC2)C1	ZINC000872238139	CE	On-Demand	Anodyne	SLC12A5	71	38
COCCc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238148	FE	On-Demand	Mild	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238148	FE	On-Demand	Mild	ADRB1	53	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238149	FE	On-Demand	Mild	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238149	FE	On-Demand	Mild	ADRB1	53	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238150	FE	On-Demand	Mild	ADRB2	34	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238150	FE	On-Demand	Mild	ADRB1	53	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238151	FE	On-Demand	Mild	ADRB2	34	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238151	FE	On-Demand	Mild	ADRB1	53	53
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000872238170	EE	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000872238170	EE	On-Demand	Mild	ADRB1	52	36
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000872238171	EE	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000872238171	EE	On-Demand	Mild	ADRB1	52	36
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000872238172	EE	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000872238172	EE	On-Demand	Mild	ADRB1	52	36
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000872238173	EE	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000872238173	EE	On-Demand	Mild	ADRB1	52	36
N#Cc1ccc([C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238174	DE	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc([C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238175	DE	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc([C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238176	DE	On-Demand	Mild	ADRB3	19	42
N#Cc1ccc([C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238177	DE	On-Demand	Mild	ADRB3	19	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc3cc(F)ccc23)CC1	ZINC000872238196	GG	On-Demand	Anodyne	GPR119	50	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc3cc(F)ccc23)CC1	ZINC000872238197	GG	On-Demand	Anodyne	GPR119	50	51
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccnn1C	ZINC000872238216	FE	On-Demand	Anodyne	GPR119	50	45
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccnn1C	ZINC000872238218	FE	On-Demand	Anodyne	GPR119	50	45
C[C@H](NC[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccnn1C	ZINC000872238228	EF	On-Demand	Anodyne	ADRB2	21	43
C[C@@H](NC[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccnn1C	ZINC000872238231	EF	On-Demand	Anodyne	ADRB2	21	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238232	FE	On-Demand	Anodyne	ADRB2	36	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238232	FE	On-Demand	Anodyne	ADRB1	70	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238232	FE	On-Demand	Anodyne	GRIN1	23	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238232	FE	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238233	FE	On-Demand	Anodyne	ADRB2	36	49
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238233	FE	On-Demand	Anodyne	ADRB1	70	49
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238233	FE	On-Demand	Anodyne	GRIN1	23	41
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872238233	FE	On-Demand	Anodyne	ADRB3	42	48
C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238240	EF	On-Demand	Anodyne	ADRB2	31	47
C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238240	EF	On-Demand	Anodyne	ADRB1	25	42
C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238240	EF	On-Demand	Anodyne	ABCB1	37	40
C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238241	EF	On-Demand	Anodyne	ADRB2	31	47
C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238241	EF	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccnn1C	ZINC000872238241	EF	On-Demand	Anodyne	ABCB1	37	40
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)CN1CCCC1	ZINC000872238283	DE	On-Demand	Anodyne	C3AR1	39	40
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)CN1CCCC1	ZINC000872238284	DE	On-Demand	Anodyne	C3AR1	39	40
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)CN1CCCC1	ZINC000872238285	DE	On-Demand	Anodyne	C3AR1	39	40
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)CN1CCCC1	ZINC000872238286	DE	On-Demand	Anodyne	C3AR1	39	40
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccc(F)cc1	ZINC000872238317	EH	On-Demand	Anodyne	C3AR1	37	47
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccc(F)cc1	ZINC000872238318	EH	On-Demand	Anodyne	C3AR1	37	47
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)c1ccc(F)cc1	ZINC000872238319	EH	On-Demand	Anodyne	C3AR1	37	47
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)c1ccc(F)cc1	ZINC000872238320	EH	On-Demand	Anodyne	C3AR1	37	47
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872238321	CE	On-Demand	Anodyne	ADRB2	27	51
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872238321	CE	On-Demand	Anodyne	ADRB1	34	40
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872238322	CE	On-Demand	Anodyne	ADRB2	27	51
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872238322	CE	On-Demand	Anodyne	ADRB1	34	40
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872238323	CE	On-Demand	Anodyne	ADRB2	27	51
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872238323	CE	On-Demand	Anodyne	ADRB1	34	40
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872238324	CE	On-Demand	Anodyne	ADRB2	27	51
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872238324	CE	On-Demand	Anodyne	ADRB1	34	40
NC(=O)CCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872238325	CC	On-Demand	Anodyne	FKBP1A	19	40
NC(=O)CCN[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000872238325	CC	On-Demand	Anodyne	KDM1A	16	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccc(F)cc1	ZINC000872238326	CE	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)COc1ccc(F)cc1	ZINC000872238326	CE	On-Demand	Anodyne	ADRB1	34	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccc(F)cc1	ZINC000872238327	CE	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)COc1ccc(F)cc1	ZINC000872238327	CE	On-Demand	Anodyne	ADRB1	34	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccc(F)cc1	ZINC000872238328	CE	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)COc1ccc(F)cc1	ZINC000872238328	CE	On-Demand	Anodyne	ADRB1	34	40
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccc(F)cc1	ZINC000872238329	CE	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)COc1ccc(F)cc1	ZINC000872238329	CE	On-Demand	Anodyne	ADRB1	34	40
N#CCc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238368	GG	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238368	GG	On-Demand	Mild	ADRB3	29	40
N#CCc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238369	GG	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238369	GG	On-Demand	Mild	ADRB3	29	40
N#CCc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238370	GG	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238370	GG	On-Demand	Mild	ADRB3	29	40
N#CCc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238371	GG	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238371	GG	On-Demand	Mild	ADRB3	29	40
C[C@@H](NCCS(=O)(=O)c1cccc(C#N)c1)c1ccnn1C	ZINC000872238394	DD	On-Demand	Mild	ITGA4	40	31
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238406	ED	On-Demand	Anodyne	ADRB2	37	51
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238406	ED	On-Demand	Anodyne	ADRB1	51	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238406	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238407	ED	On-Demand	Anodyne	ADRB2	37	51
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238407	ED	On-Demand	Anodyne	ADRB1	51	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238407	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238408	ED	On-Demand	Anodyne	ADRB2	37	51
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238408	ED	On-Demand	Anodyne	ADRB1	51	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238408	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238409	ED	On-Demand	Anodyne	ADRB2	37	51
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238409	ED	On-Demand	Anodyne	ADRB1	51	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238409	ED	On-Demand	Anodyne	ADRB3	32	42
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccnn1C	ZINC000872238412	DD	On-Demand	Anodyne	ADRB2	25	67
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccnn1C	ZINC000872238412	DD	On-Demand	Anodyne	ADRB1	26	67
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccnn1C	ZINC000872238415	DD	On-Demand	Anodyne	ADRB2	25	67
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccnn1C	ZINC000872238415	DD	On-Demand	Anodyne	ADRB1	26	67
N#Cc1ccc2c(c1)C[C@H](NCCC(=O)Nc1cccc(F)c1)C2	ZINC000872238430	DF	On-Demand	Mild	CCR3	15	41
N#Cc1ccc2c(c1)C[C@@H](NCCC(=O)Nc1cccc(F)c1)C2	ZINC000872238431	DF	On-Demand	Mild	CCR3	15	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238446	FE	On-Demand	Mild	ADRB1	46	34
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238446	FE	On-Demand	Mild	ADRB3	29	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238447	FE	On-Demand	Mild	ADRB1	46	34
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238447	FE	On-Demand	Mild	ADRB3	29	42
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238461	FG	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238461	FG	On-Demand	Bother	C3AR1	39	52
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238462	FG	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238462	FG	On-Demand	Bother	C3AR1	39	52
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238463	FG	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238463	FG	On-Demand	Bother	C3AR1	39	52
O=[N+]([O-])c1ccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238464	FG	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238464	FG	On-Demand	Bother	C3AR1	39	52
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000872238468	DE	On-Demand	Anodyne	ADRB2	20	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000872238469	DE	On-Demand	Anodyne	ADRB2	20	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000872238470	DE	On-Demand	Anodyne	ADRB2	20	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000872238471	DE	On-Demand	Anodyne	ADRB2	20	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238481	FE	On-Demand	Mild	ADRB1	46	34
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238481	FE	On-Demand	Mild	ADRB3	29	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238482	FE	On-Demand	Mild	ADRB1	46	34
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238482	FE	On-Demand	Mild	ADRB3	29	42
NC(=O)C1CC(NC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000872238531	DC	On-Demand	Anodyne	NOD2	41	36
NC(=O)C1CC(NC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000872238532	DC	On-Demand	Anodyne	NOD2	41	36
N#CCc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238540	EE	On-Demand	Mild	ADRB1	34	45
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238547	EE	On-Demand	Mild	ADRB1	34	45
COC[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872238548	CD	On-Demand	Anodyne	C3AR1	37	40
N#CCc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238549	EE	On-Demand	Mild	ADRB1	34	45
N#CCc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238550	EE	On-Demand	Mild	ADRB1	34	45
COC[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872238553	CD	On-Demand	Anodyne	C3AR1	37	40
CC(C)(C)[C@@H](O)CN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872238557	CG	On-Demand	Anodyne	C3AR1	40	41
CC(C)(C)[C@@H](O)CN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872238560	CG	On-Demand	Anodyne	C3AR1	40	41
C[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccnn1C	ZINC000872238603	EF	On-Demand	Anodyne	ADRB2	29	46
C[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccnn1C	ZINC000872238603	EF	On-Demand	Anodyne	ADRB1	30	43
C[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccnn1C	ZINC000872238608	EF	On-Demand	Anodyne	ADRB2	29	46
C[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccnn1C	ZINC000872238608	EF	On-Demand	Anodyne	ADRB1	30	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1cccc(Br)c1)C2	ZINC000872238613	FG	On-Demand	Mild	ADRB3	19	41
C#CCNC(=O)CCN[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872238614	CD	On-Demand	Mild	C3AR1	40	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1cccc(Br)c1)C2	ZINC000872238615	FG	On-Demand	Mild	ADRB3	19	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc(Br)c1)C2	ZINC000872238616	FG	On-Demand	Mild	ADRB3	19	41
C#CCNC(=O)CCN[C@H](Cc1cccnc1)C1CCCC1	ZINC000872238617	CD	On-Demand	Mild	C3AR1	40	40
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872238618	EF	On-Demand	Anodyne	SLC6A3	19	43
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872238618	EF	On-Demand	Anodyne	ADRB3	42	37
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872238618	EF	On-Demand	Anodyne	CTSB	35	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872238618	EF	On-Demand	Anodyne	CAPN2	64	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000872238618	EF	On-Demand	Anodyne	Q8WSF8_APLCA	41	39
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872238619	EF	On-Demand	Anodyne	SLC6A3	19	43
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872238619	EF	On-Demand	Anodyne	ADRB3	42	37
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872238619	EF	On-Demand	Anodyne	CTSB	35	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872238619	EF	On-Demand	Anodyne	CAPN2	64	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000872238619	EF	On-Demand	Anodyne	Q8WSF8_APLCA	41	39
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc(Br)c1)C2	ZINC000872238621	FG	On-Demand	Mild	ADRB3	19	41
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	ADRB3	21	40
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	TBXAS1	24	40
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	CHRNA7	40	42
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	TIMP3	31	43
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	C3AR1	44	43
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	ACHP_LYMST	23	42
O=C(CCN[C@@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238626	EH	On-Demand	Anodyne	NAMPT	48	46
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	ADRB3	21	40
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	TBXAS1	24	40
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	CHRNA7	40	42
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	TIMP3	31	43
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	C3AR1	44	43
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	ACHP_LYMST	23	42
O=C(CCN[C@H](Cc1cccnc1)C1CCCC1)Nc1ccccc1	ZINC000872238629	EH	On-Demand	Anodyne	NAMPT	48	46
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872238639	CD	On-Demand	Mild	ADRB2	19	55
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872238639	CD	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872238639	CD	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000872238639	CD	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872238640	CD	On-Demand	Mild	ADRB2	19	55
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872238640	CD	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872238640	CD	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000872238640	CD	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872238641	CD	On-Demand	Mild	ADRB2	19	55
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872238641	CD	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872238641	CD	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000872238641	CD	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872238642	CD	On-Demand	Mild	ADRB2	19	55
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872238642	CD	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872238642	CD	On-Demand	Mild	CASR	41	44
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000872238642	CD	On-Demand	Mild	CYP2D6	19	45
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCCC[C@H]2O)C1	ZINC000872238669	DE	On-Demand	Anodyne	FKBP1A	36	44
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCCC[C@H]2O)C1	ZINC000872238669	DE	On-Demand	Anodyne	CTSK	22	40
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCCC[C@H]2O)C1	ZINC000872238669	DE	On-Demand	Anodyne	PREP	29	41
O=C(OCc1ccccc1)[C@@H]1C[C@@H](N[C@@H]2CCCC[C@H]2O)C1	ZINC000872238669	DE	On-Demand	Anodyne	SLC12A5	50	38
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872238670	EE	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872238670	EE	On-Demand	Anodyne	ADRB1	67	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000872238670	EE	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872238671	EE	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872238671	EE	On-Demand	Anodyne	ADRB1	67	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000872238671	EE	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872238672	EE	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872238672	EE	On-Demand	Anodyne	ADRB1	67	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000872238672	EE	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872238673	EE	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872238673	EE	On-Demand	Anodyne	ADRB1	67	56
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000872238673	EE	On-Demand	Anodyne	ADRB3	42	48
NC(=O)C1CC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000872238688	DD	On-Demand	Anodyne	ADRB3	15	53
NC(=O)C1CC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000872238689	DD	On-Demand	Anodyne	ADRB3	15	53
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000872238702	DE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000872238703	DE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000872238704	DE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000872238705	DE	On-Demand	Mild	ADRB3	18	41
N#Cc1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238714	FG	On-Demand	Mild	ADRB1	42	41
N#Cc1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238715	FG	On-Demand	Mild	ADRB1	42	41
N#Cc1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238716	FG	On-Demand	Mild	ADRB1	42	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872238717	FG	On-Demand	Mild	ADRB1	42	41
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238718	EG	On-Demand	Anodyne	ADRB2	49	49
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238718	EG	On-Demand	Anodyne	ADRB1	69	47
O[C@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238718	EG	On-Demand	Anodyne	ADRB3	51	47
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238719	EG	On-Demand	Anodyne	ADRB2	49	49
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238719	EG	On-Demand	Anodyne	ADRB1	69	47
O[C@@H](CN[C@@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238719	EG	On-Demand	Anodyne	ADRB3	51	47
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238720	EG	On-Demand	Anodyne	ADRB2	49	49
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238720	EG	On-Demand	Anodyne	ADRB1	69	47
O[C@@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238720	EG	On-Demand	Anodyne	ADRB3	51	47
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238721	EG	On-Demand	Anodyne	ADRB2	49	49
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238721	EG	On-Demand	Anodyne	ADRB1	69	47
O[C@H](CN[C@H](Cc1cccnc1)C1CCCC1)COc1ccccc1	ZINC000872238721	EG	On-Demand	Anodyne	ADRB3	51	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238722	DD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238722	DD	On-Demand	Anodyne	ADRB1	40	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238722	DD	On-Demand	Anodyne	ADRB3	21	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238722	DD	On-Demand	Anodyne	ABCB1	16	52
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238723	DD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238723	DD	On-Demand	Anodyne	ADRB1	40	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238723	DD	On-Demand	Anodyne	ADRB3	21	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238723	DD	On-Demand	Anodyne	ABCB1	16	52
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238724	DD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238724	DD	On-Demand	Anodyne	ADRB1	40	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238724	DD	On-Demand	Anodyne	ADRB3	21	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238724	DD	On-Demand	Anodyne	ABCB1	16	52
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238725	DD	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238725	DD	On-Demand	Anodyne	ADRB1	40	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238725	DD	On-Demand	Anodyne	ADRB3	21	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238725	DD	On-Demand	Anodyne	ABCB1	16	52
COC[C@@H](O)CNc1cccc(Oc2cccc(C)c2)c1	ZINC000872238727	CG	On-Demand	Anodyne	ADRB2	17	50
COC[C@@H](O)CNc1cccc(Oc2cccc(C)c2)c1	ZINC000872238727	CG	On-Demand	Anodyne	ADRB1	16	50
C=CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)c(OC)c1	ZINC000872238747	EE	On-Demand	Mild	ADRB2	16	44
C=CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)c(OC)c1	ZINC000872238748	EE	On-Demand	Mild	ADRB2	16	44
C=CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)c(OC)c1	ZINC000872238749	EE	On-Demand	Mild	ADRB2	16	44
C=CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)c(OC)c1	ZINC000872238750	EE	On-Demand	Mild	ADRB2	16	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238759	FD	On-Demand	Mild	ADRB2	30	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238759	FD	On-Demand	Mild	ADRB1	53	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238759	FD	On-Demand	Mild	ADRB3	38	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238760	FD	On-Demand	Mild	ADRB2	30	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238760	FD	On-Demand	Mild	ADRB1	53	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238760	FD	On-Demand	Mild	ADRB3	38	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238761	FD	On-Demand	Mild	ADRB2	30	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238761	FD	On-Demand	Mild	ADRB1	53	39
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238761	FD	On-Demand	Mild	ADRB3	38	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238762	FD	On-Demand	Mild	ADRB2	30	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238762	FD	On-Demand	Mild	ADRB1	53	39
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238762	FD	On-Demand	Mild	ADRB3	38	42
C[C@@H](NCCC(=O)Nc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238795	DF	On-Demand	Anodyne	HTR2A	21	43
C[C@@H](NCCC(=O)Nc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238795	DF	On-Demand	Anodyne	IMDH_CRYPV	31	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238850	FD	On-Demand	Mild	ADRB3	21	51
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238850	FD	On-Demand	Mild	CTSF	52	36
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238851	FD	On-Demand	Mild	ADRB3	21	51
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238851	FD	On-Demand	Mild	CTSF	52	36
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238852	FD	On-Demand	Mild	ADRB3	21	51
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238852	FD	On-Demand	Mild	CTSF	52	36
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238853	FD	On-Demand	Mild	ADRB3	21	51
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238853	FD	On-Demand	Mild	CTSF	52	36
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238885	FE	On-Demand	Mild	ADRB2	36	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238885	FE	On-Demand	Mild	ADRB1	74	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238885	FE	On-Demand	Mild	ADRB3	51	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238886	FE	On-Demand	Mild	ADRB2	36	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238886	FE	On-Demand	Mild	ADRB1	74	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238886	FE	On-Demand	Mild	ADRB3	51	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238887	FE	On-Demand	Mild	ADRB2	36	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238887	FE	On-Demand	Mild	ADRB1	74	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238887	FE	On-Demand	Mild	ADRB3	51	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238888	FE	On-Demand	Mild	ADRB2	36	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238888	FE	On-Demand	Mild	ADRB1	74	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238888	FE	On-Demand	Mild	ADRB3	51	45
C[C@@H](NCCC(=O)Nc1cccc(C#N)c1)c1ccnn1C	ZINC000872238889	CD	On-Demand	Mild	CCR3	16	41
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000872238899	DG	On-Demand	Mild	ADRB3	21	50
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000872238900	DG	On-Demand	Mild	ADRB3	21	50
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238901	DE	On-Demand	Anodyne	ADRB2	33	47
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238901	DE	On-Demand	Anodyne	ADRB1	33	44
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238901	DE	On-Demand	Anodyne	ADRB3	18	42
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238902	DE	On-Demand	Anodyne	ADRB2	33	47
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238902	DE	On-Demand	Anodyne	ADRB1	33	44
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccnn1C	ZINC000872238902	DE	On-Demand	Anodyne	ADRB3	18	42
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)c(C)c1	ZINC000872238909	DE	On-Demand	Anodyne	ADRB2	21	52
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)c(C)c1	ZINC000872238910	DE	On-Demand	Anodyne	ADRB2	21	52
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)c(C)c1	ZINC000872238911	DE	On-Demand	Anodyne	ADRB2	21	52
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)c(C)c1	ZINC000872238912	DE	On-Demand	Anodyne	ADRB2	21	52
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238935	GF	On-Demand	Mild	ADRB1	61	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238935	GF	On-Demand	Mild	ADRB3	46	39
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238937	GF	On-Demand	Mild	ADRB1	61	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238937	GF	On-Demand	Mild	ADRB3	46	39
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238939	GF	On-Demand	Mild	ADRB1	61	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238939	GF	On-Demand	Mild	ADRB3	46	39
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238940	GF	On-Demand	Mild	ADRB1	61	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872238940	GF	On-Demand	Mild	ADRB3	46	39
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238950	ED	On-Demand	Anodyne	ADRB2	44	64
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238950	ED	On-Demand	Anodyne	ADRB1	69	64
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238950	ED	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238954	ED	On-Demand	Anodyne	ADRB2	44	64
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238954	ED	On-Demand	Anodyne	ADRB1	69	64
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872238954	ED	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238956	ED	On-Demand	Anodyne	ADRB2	44	64
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238956	ED	On-Demand	Anodyne	ADRB1	69	64
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872238956	ED	On-Demand	Anodyne	ADRB3	42	48
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872238962	FF	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872238962	FF	On-Demand	Anodyne	ADRB1	36	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872238963	FF	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872238963	FF	On-Demand	Anodyne	ADRB1	36	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872238964	FF	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872238964	FF	On-Demand	Anodyne	ADRB1	36	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872238965	FF	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872238965	FF	On-Demand	Anodyne	ADRB1	36	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872238970	DD	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872238970	DD	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872238971	DD	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(F)cc1	ZINC000872238971	DD	On-Demand	Anodyne	ADRB1	31	40
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238992	GF	On-Demand	Mild	ADRB2	39	43
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238992	GF	On-Demand	Mild	ADRB1	68	43
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238992	GF	On-Demand	Mild	ADRB3	43	43
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238993	GF	On-Demand	Mild	ADRB2	39	43
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238993	GF	On-Demand	Mild	ADRB1	68	43
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872238993	GF	On-Demand	Mild	ADRB3	43	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238998	FE	On-Demand	Mild	ADRB2	23	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238998	FE	On-Demand	Mild	ADRB1	43	39
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238998	FE	On-Demand	Mild	ADRB3	29	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238998	FE	On-Demand	Mild	ABCB1	17	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238999	FE	On-Demand	Mild	ADRB2	23	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238999	FE	On-Demand	Mild	ADRB1	43	39
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238999	FE	On-Demand	Mild	ADRB3	29	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872238999	FE	On-Demand	Mild	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239000	FE	On-Demand	Mild	ADRB2	23	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239000	FE	On-Demand	Mild	ADRB1	43	39
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239000	FE	On-Demand	Mild	ADRB3	29	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239000	FE	On-Demand	Mild	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239001	FE	On-Demand	Mild	ADRB2	23	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239001	FE	On-Demand	Mild	ADRB1	43	39
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239001	FE	On-Demand	Mild	ADRB3	29	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)c1	ZINC000872239001	FE	On-Demand	Mild	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)c1	ZINC000872239014	FG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)c1	ZINC000872239014	FG	On-Demand	Anodyne	ADRB1	22	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)c1	ZINC000872239015	FG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)c1	ZINC000872239015	FG	On-Demand	Anodyne	ADRB1	22	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)c1	ZINC000872239016	FG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)c1	ZINC000872239016	FG	On-Demand	Anodyne	ADRB1	22	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)c1	ZINC000872239017	FG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)c1	ZINC000872239017	FG	On-Demand	Anodyne	ADRB1	22	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239029	ED	On-Demand	Anodyne	ADRB2	44	64
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239029	ED	On-Demand	Anodyne	ADRB1	69	64
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239029	ED	On-Demand	Anodyne	ADRB3	42	48
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1ccnn1C	ZINC000872239031	EF	On-Demand	Anodyne	ADRB2	16	43
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1ccnn1C	ZINC000872239033	EF	On-Demand	Anodyne	ADRB2	16	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872239038	FD	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872239038	FD	On-Demand	Anodyne	ADRB1	23	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872239039	FD	On-Demand	Anodyne	ADRB2	20	41
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872239039	FD	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872239062	EE	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872239062	EE	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872239064	EE	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1Cl	ZINC000872239064	EE	On-Demand	Anodyne	ADRB1	19	40
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Br)s1	ZINC000872239065	FE	On-Demand	Mild	ADRB2	20	54
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Br)s1	ZINC000872239065	FE	On-Demand	Mild	ADRB1	76	58
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Br)s1	ZINC000872239065	FE	On-Demand	Mild	CASR	41	43
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Br)s1	ZINC000872239065	FE	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Br)s1	ZINC000872239066	FE	On-Demand	Mild	ADRB2	20	54
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Br)s1	ZINC000872239066	FE	On-Demand	Mild	ADRB1	76	58
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Br)s1	ZINC000872239066	FE	On-Demand	Mild	CASR	41	43
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Br)s1	ZINC000872239066	FE	On-Demand	Mild	CYP2D6	19	44
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)c1	ZINC000872239070	FF	On-Demand	Anodyne	ADRB2	18	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OCCCO3)c1	ZINC000872239073	FF	On-Demand	Anodyne	ADRB2	18	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872239086	DG	On-Demand	Mild	ADRB1	32	50
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872239086	DG	On-Demand	Mild	ADRB3	49	52
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872239087	DG	On-Demand	Mild	ADRB1	32	50
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872239087	DG	On-Demand	Mild	ADRB3	49	52
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872239088	DG	On-Demand	Mild	ADRB1	32	50
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872239088	DG	On-Demand	Mild	ADRB3	49	52
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872239089	DG	On-Demand	Mild	ADRB1	32	50
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872239089	DG	On-Demand	Mild	ADRB3	49	52
C[C@@H](NCCC(=O)Nc1cccc(Br)c1)c1ccnn1C	ZINC000872239092	FF	On-Demand	Anodyne	EGFR	30	41
C[C@@H](NCCC(=O)NC(=O)NCc1ccccc1)c1cc2cnccc2o1	ZINC000872239101	FF	On-Demand	Anodyne	NAMPT	45	39
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239109	EF	On-Demand	Anodyne	ADRB2	43	63
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239109	EF	On-Demand	Anodyne	ADRB1	38	43
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239109	EF	On-Demand	Anodyne	ADRB3	25	40
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239111	EF	On-Demand	Anodyne	ADRB2	43	63
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239111	EF	On-Demand	Anodyne	ADRB1	38	43
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccnn1C	ZINC000872239111	EF	On-Demand	Anodyne	ADRB3	25	40
N#Cc1ccc2c(c1)C[C@H](NCCC(=O)Nc1cccc(Cl)c1)C2	ZINC000872239116	EG	On-Demand	Mild	MCHR1	36	42
N#Cc1ccc2c(c1)C[C@@H](NCCC(=O)Nc1cccc(Cl)c1)C2	ZINC000872239117	EG	On-Demand	Mild	MCHR1	36	42
CSc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239130	DE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239130	DE	On-Demand	Anodyne	ADRB1	26	43
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239132	DE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239132	DE	On-Demand	Anodyne	ADRB1	26	43
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239134	DE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239134	DE	On-Demand	Anodyne	ADRB1	26	43
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239136	DE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239136	DE	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNc1cccc2c1OCCCO2)COc1ccc(F)cc1	ZINC000872239145	EF	On-Demand	Anodyne	ADRB1	47	39
O[C@H](CNc1cccc2c1OCCCO2)COc1ccc(F)cc1	ZINC000872239147	EF	On-Demand	Anodyne	ADRB1	47	39
O[C@H](CNc1cccc2c1OCCCO2)COc1ccccc1Cl	ZINC000872239159	EG	On-Demand	Anodyne	ADRB2	21	43
O[C@@H](CNc1cccc2c1OCCCO2)COc1ccccc1Cl	ZINC000872239161	EG	On-Demand	Anodyne	ADRB2	21	43
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239167	EF	On-Demand	Anodyne	ADRB2	28	50
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239167	EF	On-Demand	Anodyne	ADRB1	25	50
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239167	EF	On-Demand	Anodyne	ADRB3	15	50
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239169	EF	On-Demand	Anodyne	ADRB2	28	50
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239169	EF	On-Demand	Anodyne	ADRB1	25	50
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2ccccc12	ZINC000872239169	EF	On-Demand	Anodyne	ADRB3	15	50
C#CCNC(=O)CCNc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872239175	ED	On-Demand	Mild	NPY2R	87	39
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239214	GE	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239214	GE	On-Demand	Bother	ADRB1	33	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239214	GE	On-Demand	Bother	ADRB3	25	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239216	GE	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239216	GE	On-Demand	Bother	ADRB1	33	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872239216	GE	On-Demand	Bother	ADRB3	25	47
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000872239258	GG	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000872239259	GG	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000872239260	GG	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000872239261	GG	On-Demand	Mild	ADRB3	18	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239268	DD	On-Demand	Anodyne	ADRB2	29	49
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239268	DD	On-Demand	Anodyne	ADRB1	33	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239268	DD	On-Demand	Anodyne	ABCB1	26	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239269	DD	On-Demand	Anodyne	ADRB2	29	49
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239269	DD	On-Demand	Anodyne	ADRB1	33	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)c1	ZINC000872239269	DD	On-Demand	Anodyne	ABCB1	26	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239270	DD	On-Demand	Anodyne	ADRB2	29	49
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239270	DD	On-Demand	Anodyne	ADRB1	33	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239270	DD	On-Demand	Anodyne	ABCB1	26	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239271	DD	On-Demand	Anodyne	ADRB2	29	49
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239271	DD	On-Demand	Anodyne	ADRB1	33	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)c1	ZINC000872239271	DD	On-Demand	Anodyne	ABCB1	26	46
O[C@@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239278	GF	On-Demand	Anodyne	ADRB2	15	56
O[C@@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239278	GF	On-Demand	Anodyne	ADRB1	46	56
O[C@@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239278	GF	On-Demand	Anodyne	SLC6A4	15	42
O[C@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239281	GF	On-Demand	Anodyne	ADRB2	15	56
O[C@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239281	GF	On-Demand	Anodyne	ADRB1	46	56
O[C@H](CNCc1ncc(Br)s1)COc1cccc2[nH]ccc12	ZINC000872239281	GF	On-Demand	Anodyne	SLC6A4	15	42
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239282	DD	On-Demand	Anodyne	ADRB2	35	48
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239282	DD	On-Demand	Anodyne	ADRB1	35	48
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239282	DD	On-Demand	Anodyne	ADRB3	17	43
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239287	DD	On-Demand	Anodyne	ADRB2	35	48
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239287	DD	On-Demand	Anodyne	ADRB1	35	48
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239287	DD	On-Demand	Anodyne	ADRB3	17	43
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239288	DD	On-Demand	Anodyne	ADRB2	35	48
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239288	DD	On-Demand	Anodyne	ADRB1	35	48
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872239288	DD	On-Demand	Anodyne	ADRB3	17	43
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239289	DD	On-Demand	Anodyne	ADRB2	35	48
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239289	DD	On-Demand	Anodyne	ADRB1	35	48
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872239289	DD	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)c(C)c1	ZINC000872239295	EH	On-Demand	Anodyne	ADRB2	16	47
Cc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)c(C)c1	ZINC000872239296	EH	On-Demand	Anodyne	ADRB2	16	47
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)c(C)c1	ZINC000872239297	EH	On-Demand	Anodyne	ADRB2	16	47
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)c(C)c1	ZINC000872239298	EH	On-Demand	Anodyne	ADRB2	16	47
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872239300	HF	On-Demand	Anodyne	HDAC1	17	43
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872239300	HF	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872239300	HF	On-Demand	Anodyne	F13A1	44	40
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872239300	HF	On-Demand	Anodyne	L3MBTL3	51	35
Cc1nc(O)nc(O)c1CCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872239318	FE	On-Demand	Anodyne	L3MBTL3	44	35
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccccc1)C2	ZINC000872239333	CE	On-Demand	Mild	ADRB3	23	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccccc1)C2	ZINC000872239339	CE	On-Demand	Mild	ADRB3	23	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccccc1)C2	ZINC000872239341	CE	On-Demand	Mild	ADRB3	23	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccccc1)C2	ZINC000872239343	CE	On-Demand	Mild	ADRB3	23	40
Cc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)c(C)c1	ZINC000872239346	FG	On-Demand	Anodyne	ADRB2	16	44
Cc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)c(C)c1	ZINC000872239348	FG	On-Demand	Anodyne	ADRB2	16	44
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1F	ZINC000872239389	DD	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1F	ZINC000872239389	DD	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1F	ZINC000872239390	DD	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1F	ZINC000872239390	DD	On-Demand	Anodyne	ADRB1	26	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872239407	EE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872239407	EE	On-Demand	Mild	ADRB1	43	34
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872239408	EE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872239408	EE	On-Demand	Mild	ADRB1	43	34
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872239409	EE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872239409	EE	On-Demand	Mild	ADRB1	43	34
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872239410	EE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872239410	EE	On-Demand	Mild	ADRB1	43	34
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239458	EE	On-Demand	Anodyne	ADRB2	15	66
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239458	EE	On-Demand	Anodyne	ADRB1	23	66
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239458	EE	On-Demand	Anodyne	HTR1A	16	66
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239458	EE	On-Demand	Anodyne	SLC6A4	19	43
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239461	EE	On-Demand	Anodyne	ADRB2	15	66
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239461	EE	On-Demand	Anodyne	ADRB1	23	66
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239461	EE	On-Demand	Anodyne	HTR1A	16	66
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc2[nH]ccc12	ZINC000872239461	EE	On-Demand	Anodyne	SLC6A4	19	43
CCOC[C@H](O)CNc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872239494	ED	On-Demand	Anodyne	NPY2R	75	38
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872239511	FF	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872239511	FF	On-Demand	Anodyne	ADRB1	49	39
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872239512	FF	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872239512	FF	On-Demand	Anodyne	ADRB1	49	39
N#Cc1ccc2c(c1)C[C@@H](NC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872239534	EE	On-Demand	Mild	SIGMAR1	39	40
N#Cc1ccc2c(c1)C[C@H](NC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872239537	EE	On-Demand	Mild	SIGMAR1	39	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872239539	EE	On-Demand	Mild	SIGMAR1	39	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872239541	EE	On-Demand	Mild	SIGMAR1	39	40
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccnn1C	ZINC000872239556	DE	On-Demand	Anodyne	ADRB2	34	49
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccnn1C	ZINC000872239556	DE	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccnn1C	ZINC000872239558	DE	On-Demand	Anodyne	ADRB2	34	49
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccnn1C	ZINC000872239558	DE	On-Demand	Anodyne	ADRB1	26	44
CC[C@H](O)CNc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872239579	CE	On-Demand	Anodyne	NPY2R	95	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239587	FG	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239587	FG	On-Demand	Anodyne	ADRB1	29	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239589	FG	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239589	FG	On-Demand	Anodyne	ADRB1	29	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239591	FG	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239591	FG	On-Demand	Anodyne	ADRB1	29	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239592	FG	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239592	FG	On-Demand	Anodyne	ADRB1	29	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239603	ED	On-Demand	Anodyne	ADRB2	28	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239603	ED	On-Demand	Anodyne	ADRB1	43	39
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239603	ED	On-Demand	Anodyne	ADRB3	26	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239604	ED	On-Demand	Anodyne	ADRB2	28	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239604	ED	On-Demand	Anodyne	ADRB1	43	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239604	ED	On-Demand	Anodyne	ADRB3	26	40
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239617	FG	On-Demand	Anodyne	ADRB2	29	44
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239617	FG	On-Demand	Anodyne	ADRB1	28	43
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239619	FG	On-Demand	Anodyne	ADRB2	29	44
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239619	FG	On-Demand	Anodyne	ADRB1	28	43
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239620	FG	On-Demand	Anodyne	ADRB2	29	44
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872239620	FG	On-Demand	Anodyne	ADRB1	28	43
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239621	FG	On-Demand	Anodyne	ADRB2	29	44
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872239621	FG	On-Demand	Anodyne	ADRB1	28	43
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239629	GF	On-Demand	Anodyne	ADRB2	44	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239629	GF	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239629	GF	On-Demand	Anodyne	ADRB3	44	41
CSc1ccc(OC[C@@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872239631	GE	On-Demand	Anodyne	ADRB1	44	38
CSc1ccc(OC[C@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872239632	GE	On-Demand	Anodyne	ADRB1	44	38
N#Cc1ccccc1OC[C@@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239662	FE	On-Demand	Mild	ADRB1	64	46
N#Cc1ccccc1OC[C@@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239662	FE	On-Demand	Mild	CASR	46	47
N#Cc1ccccc1OC[C@@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239662	FE	On-Demand	Mild	CYP2D6	21	47
N#Cc1ccccc1OC[C@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239663	FE	On-Demand	Mild	ADRB1	64	46
N#Cc1ccccc1OC[C@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239663	FE	On-Demand	Mild	CASR	46	47
N#Cc1ccccc1OC[C@H](O)CNCc1cc2c(nc1O)CCCC2	ZINC000872239663	FE	On-Demand	Mild	CYP2D6	21	47
O[C@H](CNCC[C@@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239668	DF	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CNCC[C@@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239668	DF	On-Demand	Anodyne	DPP7	19	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239669	DF	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNCC[C@@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239669	DF	On-Demand	Anodyne	DPP7	19	42
O[C@H](CNCC[C@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239670	DF	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CNCC[C@H](O)C1CCCC1)Cc1cccc(Cl)c1	ZINC000872239670	DF	On-Demand	Anodyne	DPP7	19	42
O[C@@H](CCNC[C@H](O)Cc1cccc(Cl)c1)C1CCCC1	ZINC000872239671	DF	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CCNC[C@H](O)Cc1cccc(Cl)c1)C1CCCC1	ZINC000872239671	DF	On-Demand	Anodyne	DPP7	19	42
Oc1nc2c(cc1CNC[C@H](O)COc1ccc(F)cc1)CCCC2	ZINC000872239672	EE	On-Demand	Anodyne	ADRB1	56	39
Oc1nc2c(cc1CNC[C@@H](O)COc1ccc(F)cc1)CCCC2	ZINC000872239673	EE	On-Demand	Anodyne	ADRB1	56	39
CC(=O)c1cccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)c1	ZINC000872239674	FE	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1cccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)c1	ZINC000872239674	FE	On-Demand	Anodyne	ADRB1	47	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)c1	ZINC000872239675	FE	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)c1	ZINC000872239675	FE	On-Demand	Anodyne	ADRB1	47	36
Oc1nc2c(cc1CNC[C@H](O)COc1ccccc1)CCCC2	ZINC000872239682	EE	On-Demand	Anodyne	ADRB2	49	45
Oc1nc2c(cc1CNC[C@H](O)COc1ccccc1)CCCC2	ZINC000872239682	EE	On-Demand	Anodyne	ADRB1	70	42
Oc1nc2c(cc1CNC[C@H](O)COc1ccccc1)CCCC2	ZINC000872239682	EE	On-Demand	Anodyne	ADRB3	48	42
Oc1nc2c(cc1CNC[C@@H](O)COc1ccccc1)CCCC2	ZINC000872239683	EE	On-Demand	Anodyne	ADRB2	49	45
Oc1nc2c(cc1CNC[C@@H](O)COc1ccccc1)CCCC2	ZINC000872239683	EE	On-Demand	Anodyne	ADRB1	70	42
Oc1nc2c(cc1CNC[C@@H](O)COc1ccccc1)CCCC2	ZINC000872239683	EE	On-Demand	Anodyne	ADRB3	48	42
O[C@@H](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000872239712	EE	On-Demand	Anodyne	SIGMAR1	40	44
O[C@H](CCNC[C@@]1(O)CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000872239713	EE	On-Demand	Anodyne	SIGMAR1	40	44
O[C@@H](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000872239714	EE	On-Demand	Anodyne	SIGMAR1	40	44
O[C@H](CCNC[C@]1(O)CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000872239715	EE	On-Demand	Anodyne	SIGMAR1	40	44
O[C@@H](CCNC[C@@H](O)COCc1ccccc1)C1CCCC1	ZINC000872239728	DE	On-Demand	Anodyne	ADRB2	26	48
O[C@@H](CCNC[C@@H](O)COCc1ccccc1)C1CCCC1	ZINC000872239728	DE	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CCNC[C@@H](O)COCc1ccccc1)C1CCCC1	ZINC000872239728	DE	On-Demand	Anodyne	ADRB3	22	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239751	FE	On-Demand	Anodyne	ADRB2	32	40
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239751	FE	On-Demand	Anodyne	ADRB1	52	40
COC(=O)c1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239751	FE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239752	FE	On-Demand	Anodyne	ADRB2	32	40
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239752	FE	On-Demand	Anodyne	ADRB1	52	40
COC(=O)c1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239752	FE	On-Demand	Anodyne	ADRB3	28	40
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239757	FE	On-Demand	Anodyne	ADRB2	32	47
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239757	FE	On-Demand	Anodyne	ADRB1	30	44
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239757	FE	On-Demand	Anodyne	ADRB3	15	42
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239758	FE	On-Demand	Anodyne	ADRB2	32	47
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239758	FE	On-Demand	Anodyne	ADRB1	30	44
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccnn1C	ZINC000872239758	FE	On-Demand	Anodyne	ADRB3	15	42
N#CCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239765	FF	On-Demand	Mild	ADRB1	40	36
N#CCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872239766	FF	On-Demand	Mild	ADRB1	40	36
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239780	GF	On-Demand	Anodyne	ADRB2	44	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239780	GF	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872239780	GF	On-Demand	Anodyne	ADRB3	44	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239789	ED	On-Demand	Mild	ADRB1	25	42
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239790	ED	On-Demand	Mild	ADRB1	25	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000872239806	FE	On-Demand	Mild	ADRB2	21	40
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000872239808	FE	On-Demand	Mild	ADRB2	21	40
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1Cc2ccc(C#N)cc2C1	ZINC000872239810	FE	On-Demand	Mild	ADRB2	21	40
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1Cc2ccc(C#N)cc2C1	ZINC000872239812	FE	On-Demand	Mild	ADRB2	21	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc(F)c(F)c1)C2	ZINC000872239824	DF	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc(F)c(F)c1)C2	ZINC000872239827	DF	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(F)c(F)c1)C2	ZINC000872239829	DF	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(F)c(F)c1)C2	ZINC000872239831	DF	On-Demand	Mild	ADRB3	18	42
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	KIT	15	40
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	HDAC10	17	49
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	FLT1	15	45
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	KDR	18	42
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	HDAC6	15	49
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	SLC1A1	19	41
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	SLC1A3	18	41
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	SLC1A2	33	41
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000872239851	EG	On-Demand	Anodyne	DDR1	20	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239858	FE	On-Demand	Anodyne	ADRB2	32	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239858	FE	On-Demand	Anodyne	ADRB1	59	44
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239858	FE	On-Demand	Anodyne	ADRB3	41	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239860	FE	On-Demand	Anodyne	ADRB2	32	42
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239860	FE	On-Demand	Anodyne	ADRB1	59	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872239860	FE	On-Demand	Anodyne	ADRB3	41	40
O[C@@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239876	DF	On-Demand	Anodyne	ADRB2	39	47
O[C@@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239876	DF	On-Demand	Anodyne	ADRB1	52	40
O[C@@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239876	DF	On-Demand	Anodyne	ADRB3	32	40
O[C@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239878	DF	On-Demand	Anodyne	ADRB2	39	47
O[C@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239878	DF	On-Demand	Anodyne	ADRB1	52	40
O[C@H](CNc1cccc2c1OCCCO2)COc1ccccc1	ZINC000872239878	DF	On-Demand	Anodyne	ADRB3	32	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239880	CF	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239880	CF	On-Demand	Anodyne	ADRB3	41	43
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239880	CF	On-Demand	Anodyne	CYP3A4	48	37
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239881	CF	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239881	CF	On-Demand	Anodyne	ADRB3	41	43
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)c1cccc(Cl)c1	ZINC000872239881	CF	On-Demand	Anodyne	CYP3A4	48	37
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239892	EF	On-Demand	Mild	ADRB2	19	58
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239892	EF	On-Demand	Mild	ADRB1	64	41
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239892	EF	On-Demand	Mild	CASR	45	47
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239892	EF	On-Demand	Mild	CYP2D6	21	47
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239894	EF	On-Demand	Mild	ADRB2	19	58
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239894	EF	On-Demand	Mild	ADRB1	64	41
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239894	EF	On-Demand	Mild	CASR	45	47
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2cnccc2o1	ZINC000872239894	EF	On-Demand	Mild	CYP2D6	21	47
O[C@@H](CNc1cccc2c1OCCCO2)c1cccc(Cl)c1	ZINC000872239920	DH	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CNc1cccc2c1OCCCO2)c1cccc(Cl)c1	ZINC000872239920	DH	On-Demand	Anodyne	CYP3A4	49	37
O[C@H](CNc1cccc2c1OCCCO2)c1cccc(Cl)c1	ZINC000872239921	DH	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CNc1cccc2c1OCCCO2)c1cccc(Cl)c1	ZINC000872239921	DH	On-Demand	Anodyne	CYP3A4	49	37
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc2cnccc2o1	ZINC000872239927	GG	On-Demand	Anodyne	GPR119	50	42
O[C@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239929	DE	On-Demand	Anodyne	ADRB2	26	48
O[C@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239929	DE	On-Demand	Anodyne	ADRB1	42	42
O[C@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239929	DE	On-Demand	Anodyne	ADRB3	22	42
O[C@@H](CNCC[C@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239930	DE	On-Demand	Anodyne	ADRB2	26	48
O[C@@H](CNCC[C@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239930	DE	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CNCC[C@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239930	DE	On-Demand	Anodyne	ADRB3	22	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239931	DE	On-Demand	Anodyne	ADRB2	26	48
O[C@@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239931	DE	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1	ZINC000872239931	DE	On-Demand	Anodyne	ADRB3	22	42
O[C@@H](CCNC[C@H](O)CCc1ccccc1)C1CCCC1	ZINC000872239971	CF	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CCNC[C@H](O)CCc1ccccc1)C1CCCC1	ZINC000872239971	CF	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CCNC[C@H](O)CCc1ccccc1)C1CCCC1	ZINC000872239971	CF	On-Demand	Anodyne	SLC18A2	45	38
O[C@@H](CCNC[C@H](O)CCc1ccccc1)C1CCCC1	ZINC000872239971	CF	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CCNC[C@H](O)CCc1ccccc1)C1CCCC1	ZINC000872239971	CF	On-Demand	Anodyne	ABCB1	15	42
O[C@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239972	CF	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239972	CF	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239972	CF	On-Demand	Anodyne	SLC18A2	45	38
O[C@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239972	CF	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239972	CF	On-Demand	Anodyne	ABCB1	15	42
O[C@@H](CCc1ccccc1)CNCC[C@H](O)C1CCCC1	ZINC000872239973	CF	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CCc1ccccc1)CNCC[C@H](O)C1CCCC1	ZINC000872239973	CF	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CCc1ccccc1)CNCC[C@H](O)C1CCCC1	ZINC000872239973	CF	On-Demand	Anodyne	SLC18A2	45	38
O[C@@H](CCc1ccccc1)CNCC[C@H](O)C1CCCC1	ZINC000872239973	CF	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CCc1ccccc1)CNCC[C@H](O)C1CCCC1	ZINC000872239973	CF	On-Demand	Anodyne	ABCB1	15	42
O[C@@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239974	CF	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239974	CF	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239974	CF	On-Demand	Anodyne	SLC18A2	45	38
O[C@@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239974	CF	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CCc1ccccc1)CNCC[C@@H](O)C1CCCC1	ZINC000872239974	CF	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872239990	FE	On-Demand	Anodyne	ADRB1	61	39
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872239991	FE	On-Demand	Anodyne	ADRB1	61	39
O[C@@H](CCNC[C@@H](O)COCc1ccccc1Cl)C1CCCC1	ZINC000872240000	EF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1Cl	ZINC000872240001	EF	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1Cl	ZINC000872240002	EF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNCC[C@H](O)C1CCCC1)COCc1ccccc1Cl	ZINC000872240003	EF	On-Demand	Anodyne	ADRB1	19	40
O=C1CCc2cc(OC[C@H](O)CNCC[C@H](O)C3CCCC3)ccc2N1	ZINC000872240013	FD	On-Demand	Anodyne	ADRB1	53	38
O=C1CCc2cc(OC[C@H](O)CNCC[C@H](O)C3CCCC3)ccc2N1	ZINC000872240013	FD	On-Demand	Anodyne	ADRB3	33	41
O=C1CCc2cc(OC[C@@H](O)CNCC[C@H](O)C3CCCC3)ccc2N1	ZINC000872240014	FD	On-Demand	Anodyne	ADRB1	53	38
O=C1CCc2cc(OC[C@@H](O)CNCC[C@H](O)C3CCCC3)ccc2N1	ZINC000872240014	FD	On-Demand	Anodyne	ADRB3	33	41
O=C1CCc2cc(OC[C@@H](O)CNCC[C@@H](O)C3CCCC3)ccc2N1	ZINC000872240015	FD	On-Demand	Anodyne	ADRB1	53	38
O=C1CCc2cc(OC[C@@H](O)CNCC[C@@H](O)C3CCCC3)ccc2N1	ZINC000872240015	FD	On-Demand	Anodyne	ADRB3	33	41
O=C1CCc2cc(OC[C@H](O)CNCC[C@@H](O)C3CCCC3)ccc2N1	ZINC000872240016	FD	On-Demand	Anodyne	ADRB1	53	38
O=C1CCc2cc(OC[C@H](O)CNCC[C@@H](O)C3CCCC3)ccc2N1	ZINC000872240016	FD	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240033	DD	On-Demand	Mild	ADRB2	33	45
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240033	DD	On-Demand	Mild	ADRB1	40	45
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240033	DD	On-Demand	Mild	ADRB3	24	43
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240034	DD	On-Demand	Mild	ADRB2	33	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240034	DD	On-Demand	Mild	ADRB1	40	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccnn1C	ZINC000872240034	DD	On-Demand	Mild	ADRB3	24	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240039	EE	On-Demand	Anodyne	ADRB2	45	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240039	EE	On-Demand	Anodyne	ADRB1	65	53
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240039	EE	On-Demand	Anodyne	ADRB3	45	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240039	EE	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240040	EE	On-Demand	Anodyne	ADRB2	45	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240040	EE	On-Demand	Anodyne	ADRB1	65	53
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240040	EE	On-Demand	Anodyne	ADRB3	45	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240040	EE	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240041	EE	On-Demand	Anodyne	ADRB2	45	47
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240041	EE	On-Demand	Anodyne	ADRB1	65	53
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240041	EE	On-Demand	Anodyne	ADRB3	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240041	EE	On-Demand	Anodyne	ABCB1	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240042	EE	On-Demand	Anodyne	ADRB2	45	47
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240042	EE	On-Demand	Anodyne	ADRB1	65	53
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240042	EE	On-Demand	Anodyne	ADRB3	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240042	EE	On-Demand	Anodyne	ABCB1	36	41
C[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccnn1C	ZINC000872240047	EF	On-Demand	Anodyne	ADRB2	21	40
C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccnn1C	ZINC000872240049	EF	On-Demand	Anodyne	ADRB2	21	40
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240060	CD	On-Demand	Anodyne	ADRB2	36	60
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240060	CD	On-Demand	Anodyne	ADRB1	36	45
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240060	CD	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240061	CD	On-Demand	Anodyne	ADRB2	36	60
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240061	CD	On-Demand	Anodyne	ADRB1	36	45
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240061	CD	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240062	CD	On-Demand	Anodyne	ADRB2	36	60
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240062	CD	On-Demand	Anodyne	ADRB1	36	45
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccnn2C)cc1	ZINC000872240062	CD	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240063	CD	On-Demand	Anodyne	ADRB2	36	60
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240063	CD	On-Demand	Anodyne	ADRB1	36	45
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccnn2C)cc1	ZINC000872240063	CD	On-Demand	Anodyne	ADRB3	17	43
COc1cccc(OC)c1OC[C@H](O)CNCc1noc2cc(F)ccc12	ZINC000872240077	GF	On-Demand	Anodyne	ADRB2	17	40
COc1cccc(OC)c1OC[C@@H](O)CNCc1noc2cc(F)ccc12	ZINC000872240078	GF	On-Demand	Anodyne	ADRB2	17	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240081	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240082	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240083	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240084	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240093	GF	On-Demand	Mild	GPR119	39	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240094	GF	On-Demand	Mild	GPR119	39	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240095	GF	On-Demand	Mild	GPR119	39	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000872240096	GF	On-Demand	Mild	GPR119	39	42
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc2cnccc2o1	ZINC000872240101	GG	On-Demand	Anodyne	GPR119	50	42
CCOc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240113	GF	On-Demand	Anodyne	ADRB2	48	42
CCOc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240113	GF	On-Demand	Anodyne	ADRB1	69	42
CCOc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240113	GF	On-Demand	Anodyne	ADRB3	43	42
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240115	GF	On-Demand	Anodyne	ADRB2	48	42
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240115	GF	On-Demand	Anodyne	ADRB1	69	42
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872240115	GF	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240123	EG	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240123	EG	On-Demand	Anodyne	ADRB1	45	40
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240124	EG	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240124	EG	On-Demand	Anodyne	ADRB1	45	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240127	DE	On-Demand	Mild	ADRB2	39	46
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240127	DE	On-Demand	Mild	ADRB1	52	46
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240127	DE	On-Demand	Mild	ADRB3	41	46
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240129	DE	On-Demand	Mild	ADRB2	39	46
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240129	DE	On-Demand	Mild	ADRB1	52	46
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240129	DE	On-Demand	Mild	ADRB3	41	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240131	DE	On-Demand	Mild	ADRB2	39	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240131	DE	On-Demand	Mild	ADRB1	52	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1)C2	ZINC000872240131	DE	On-Demand	Mild	ADRB3	41	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240133	DE	On-Demand	Mild	ADRB2	39	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240133	DE	On-Demand	Mild	ADRB1	52	46
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1)C2	ZINC000872240133	DE	On-Demand	Mild	ADRB3	41	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240135	GG	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240135	GG	On-Demand	Anodyne	ADRB1	40	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240137	GG	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240137	GG	On-Demand	Anodyne	ADRB1	40	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240139	GG	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240139	GG	On-Demand	Anodyne	ADRB1	40	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240142	GG	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000872240142	GG	On-Demand	Anodyne	ADRB1	40	42
N#CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240143	FF	On-Demand	Mild	ADRB1	41	38
N#CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240145	FF	On-Demand	Mild	ADRB1	41	38
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1cc2cnccc2o1	ZINC000872240168	EF	On-Demand	Mild	ADRB2	22	42
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1cc2cnccc2o1	ZINC000872240170	EF	On-Demand	Mild	ADRB2	22	42
O[C@@H](CNc1cccc2c1OCCCO2)COc1cccc2[nH]ccc12	ZINC000872240178	FG	On-Demand	Anodyne	ADRB1	19	58
O[C@H](CNc1cccc2c1OCCCO2)COc1cccc2[nH]ccc12	ZINC000872240179	FG	On-Demand	Anodyne	ADRB1	19	58
O=C(CCN[C@@H]1C[C@H]1C1CCOCC1)Nc1cccnc1	ZINC000872240187	CD	On-Demand	Anodyne	CHRNA7	16	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ncc(Br)s1	ZINC000872240199	GE	On-Demand	Bother	ADRB1	54	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ncc(Br)s1	ZINC000872240200	GE	On-Demand	Bother	ADRB1	54	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240204	EE	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240204	EE	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240205	EE	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240205	EE	On-Demand	Anodyne	ADRB1	32	40
Cc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240214	EG	On-Demand	Anodyne	ADRB2	32	54
Cc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240214	EG	On-Demand	Anodyne	ADRB1	31	45
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240215	EG	On-Demand	Anodyne	ADRB2	32	54
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240215	EG	On-Demand	Anodyne	ADRB1	31	45
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240216	EG	On-Demand	Anodyne	ADRB2	32	54
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240216	EG	On-Demand	Anodyne	ADRB1	31	45
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240217	EG	On-Demand	Anodyne	ADRB2	32	54
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240217	EG	On-Demand	Anodyne	ADRB1	31	45
COCCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240230	GE	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240230	GE	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240230	GE	On-Demand	Anodyne	ADRB3	42	46
COCCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240231	GE	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240231	GE	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240231	GE	On-Demand	Anodyne	ADRB3	42	46
NC(=O)c1cc(CNC[C@H](O)c2ccccc2)n2c1CCCC2	ZINC000872240232	DD	On-Demand	Anodyne	ADRB3	45	38
NC(=O)c1cc(CNC[C@@H](O)c2ccccc2)n2c1CCCC2	ZINC000872240233	DD	On-Demand	Anodyne	ADRB3	45	38
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240269	CF	On-Demand	Anodyne	ADRB1	57	48
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240269	CF	On-Demand	Anodyne	ADRB3	68	48
O[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000872240270	CF	On-Demand	Anodyne	ADRB1	57	48
O[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000872240270	CF	On-Demand	Anodyne	ADRB3	68	48
O[C@H](CNCC[C@@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240271	CF	On-Demand	Anodyne	ADRB1	57	48
O[C@H](CNCC[C@@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240271	CF	On-Demand	Anodyne	ADRB3	68	48
O[C@H](CNCC[C@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240272	CF	On-Demand	Anodyne	ADRB1	57	48
O[C@H](CNCC[C@H](O)C1CCCC1)c1cccc(Cl)c1	ZINC000872240272	CF	On-Demand	Anodyne	ADRB3	68	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCC[C@@H]2O)CC1	ZINC000872240283	ED	On-Demand	Anodyne	GPR119	43	44
O=[N+]([O-])c1cccc([C@@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240298	DE	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240299	DE	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240300	DE	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240301	DE	On-Demand	Bother	ADRB3	41	37
C[C@H](NC[C@H](O)COc1ccccc1F)c1ccnn1C	ZINC000872240347	CD	On-Demand	Anodyne	ADRB2	32	49
C[C@H](NC[C@H](O)COc1ccccc1F)c1ccnn1C	ZINC000872240347	CD	On-Demand	Anodyne	ADRB1	41	38
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccnn1C	ZINC000872240348	CD	On-Demand	Anodyne	ADRB2	32	49
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccnn1C	ZINC000872240348	CD	On-Demand	Anodyne	ADRB1	41	38
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000872240377	EG	On-Demand	Mild	ADRB3	18	53
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000872240378	EG	On-Demand	Mild	ADRB3	18	53
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000872240379	EG	On-Demand	Mild	ADRB3	18	53
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000872240380	EG	On-Demand	Mild	ADRB3	18	53
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240391	ED	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240391	ED	On-Demand	Mild	ADRB1	65	45
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240391	ED	On-Demand	Mild	CASR	43	45
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240391	ED	On-Demand	Mild	CYP2D6	18	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240392	ED	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240392	ED	On-Demand	Mild	ADRB1	65	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240392	ED	On-Demand	Mild	CASR	43	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1C#N)C2	ZINC000872240392	ED	On-Demand	Mild	CYP2D6	18	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240393	ED	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240393	ED	On-Demand	Mild	ADRB1	65	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240393	ED	On-Demand	Mild	CASR	43	45
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240393	ED	On-Demand	Mild	CYP2D6	18	45
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240394	ED	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240394	ED	On-Demand	Mild	ADRB1	65	45
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240394	ED	On-Demand	Mild	CASR	43	45
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1C#N)C2	ZINC000872240394	ED	On-Demand	Mild	CYP2D6	18	45
N#Cc1ccc2c(c1)C[C@@H](NCCS(=O)(=O)c1ccc(F)cc1)C2	ZINC000872240395	EE	On-Demand	Mild	PNMT	21	41
N#Cc1ccc2c(c1)C[C@H](NCCS(=O)(=O)c1ccc(F)cc1)C2	ZINC000872240396	EE	On-Demand	Mild	PNMT	21	41
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000872240397	DE	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000872240398	DE	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000872240399	DE	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000872240400	DE	On-Demand	Mild	ADRB3	18	40
N#Cc1ccccc1OC[C@@H](O)CNc1cccc2c1OCCCO2	ZINC000872240445	EF	On-Demand	Mild	ADRB2	18	54
N#Cc1ccccc1OC[C@@H](O)CNc1cccc2c1OCCCO2	ZINC000872240445	EF	On-Demand	Mild	ADRB1	67	46
N#Cc1ccccc1OC[C@@H](O)CNc1cccc2c1OCCCO2	ZINC000872240445	EF	On-Demand	Mild	CASR	44	46
N#Cc1ccccc1OC[C@@H](O)CNc1cccc2c1OCCCO2	ZINC000872240445	EF	On-Demand	Mild	CYP2D6	21	46
N#Cc1ccccc1OC[C@H](O)CNc1cccc2c1OCCCO2	ZINC000872240446	EF	On-Demand	Mild	ADRB2	18	54
N#Cc1ccccc1OC[C@H](O)CNc1cccc2c1OCCCO2	ZINC000872240446	EF	On-Demand	Mild	ADRB1	67	46
N#Cc1ccccc1OC[C@H](O)CNc1cccc2c1OCCCO2	ZINC000872240446	EF	On-Demand	Mild	CASR	44	46
N#Cc1ccccc1OC[C@H](O)CNc1cccc2c1OCCCO2	ZINC000872240446	EF	On-Demand	Mild	CYP2D6	21	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240448	ED	On-Demand	Anodyne	ADRB2	32	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240448	ED	On-Demand	Anodyne	ADRB1	66	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240448	ED	On-Demand	Anodyne	ADRB3	44	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240450	ED	On-Demand	Anodyne	ADRB2	32	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240450	ED	On-Demand	Anodyne	ADRB1	66	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240450	ED	On-Demand	Anodyne	ADRB3	44	46
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872240470	FE	On-Demand	Anodyne	NPY2R	86	40
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000872240471	FE	On-Demand	Anodyne	NPY2R	86	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240473	EF	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240473	EF	On-Demand	Mild	ADRB1	49	32
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240473	EF	On-Demand	Mild	CASR	30	40
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240474	EF	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240474	EF	On-Demand	Mild	ADRB1	49	32
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872240474	EF	On-Demand	Mild	CASR	30	40
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240475	EF	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240475	EF	On-Demand	Mild	ADRB1	49	32
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240475	EF	On-Demand	Mild	CASR	30	40
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240476	EF	On-Demand	Mild	ADRB2	21	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240476	EF	On-Demand	Mild	ADRB1	49	32
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000872240476	EF	On-Demand	Mild	CASR	30	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240491	FF	On-Demand	Anodyne	ADRB2	39	57
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240491	FF	On-Demand	Anodyne	ADRB1	59	57
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240491	FF	On-Demand	Anodyne	ADRB3	39	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240492	FF	On-Demand	Anodyne	ADRB2	39	57
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240492	FF	On-Demand	Anodyne	ADRB1	59	57
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240492	FF	On-Demand	Anodyne	ADRB3	39	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240493	FF	On-Demand	Anodyne	ADRB2	39	57
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240493	FF	On-Demand	Anodyne	ADRB1	59	57
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240493	FF	On-Demand	Anodyne	ADRB3	39	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240494	FF	On-Demand	Anodyne	ADRB2	39	57
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240494	FF	On-Demand	Anodyne	ADRB1	59	57
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240494	FF	On-Demand	Anodyne	ADRB3	39	43
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000872240499	EF	On-Demand	Mild	ADRB1	30	41
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000872240500	EF	On-Demand	Mild	ADRB1	30	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000872240501	EF	On-Demand	Mild	ADRB1	30	41
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000872240502	EF	On-Demand	Mild	ADRB1	30	41
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000872240504	FF	On-Demand	Anodyne	PDS	43	37
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000872240505	FF	On-Demand	Anodyne	PDS	43	37
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Br)cc1	ZINC000872240514	FF	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Br)cc1	ZINC000872240515	FF	On-Demand	Anodyne	ADRB1	27	40
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1cc2cnccc2o1	ZINC000872240524	FF	On-Demand	Mild	ADRB2	25	41
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1cc2cnccc2o1	ZINC000872240524	FF	On-Demand	Mild	ADRB1	27	41
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1cc2cnccc2o1	ZINC000872240526	FF	On-Demand	Mild	ADRB2	25	41
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1cc2cnccc2o1	ZINC000872240526	FF	On-Demand	Mild	ADRB1	27	41
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240589	DE	On-Demand	Anodyne	ADRB2	43	44
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240589	DE	On-Demand	Anodyne	ADRB1	66	44
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240589	DE	On-Demand	Anodyne	ADRB3	30	42
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240589	DE	On-Demand	Anodyne	ABCB1	21	45
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240590	DE	On-Demand	Anodyne	ADRB2	43	44
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240590	DE	On-Demand	Anodyne	ADRB1	66	44
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240590	DE	On-Demand	Anodyne	ADRB3	30	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240590	DE	On-Demand	Anodyne	ABCB1	21	45
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240591	DE	On-Demand	Anodyne	ADRB2	43	44
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240591	DE	On-Demand	Anodyne	ADRB1	66	44
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240591	DE	On-Demand	Anodyne	ADRB3	30	42
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1F	ZINC000872240591	DE	On-Demand	Anodyne	ABCB1	21	45
O[C@@H](CCNC[C@@H](O)COc1ccccc1F)C1CCCC1	ZINC000872240592	DE	On-Demand	Anodyne	ADRB2	43	44
O[C@@H](CCNC[C@@H](O)COc1ccccc1F)C1CCCC1	ZINC000872240592	DE	On-Demand	Anodyne	ADRB1	66	44
O[C@@H](CCNC[C@@H](O)COc1ccccc1F)C1CCCC1	ZINC000872240592	DE	On-Demand	Anodyne	ADRB3	30	42
O[C@@H](CCNC[C@@H](O)COc1ccccc1F)C1CCCC1	ZINC000872240592	DE	On-Demand	Anodyne	ABCB1	21	45
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240593	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240593	EE	On-Demand	Anodyne	ADRB1	93	46
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240593	EE	On-Demand	Anodyne	ADRB3	61	43
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240593	EE	On-Demand	Anodyne	ABCB1	28	54
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240594	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240594	EE	On-Demand	Anodyne	ADRB1	93	46
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240594	EE	On-Demand	Anodyne	ADRB3	61	43
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240594	EE	On-Demand	Anodyne	ABCB1	28	54
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240595	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240595	EE	On-Demand	Anodyne	ADRB1	93	46
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240595	EE	On-Demand	Anodyne	ADRB3	61	43
CC(=O)c1cccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872240595	EE	On-Demand	Anodyne	ABCB1	28	54
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240596	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240596	EE	On-Demand	Anodyne	ADRB1	93	46
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240596	EE	On-Demand	Anodyne	ADRB3	61	43
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872240596	EE	On-Demand	Anodyne	ABCB1	28	54
CSc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240618	FF	On-Demand	Mild	ADRB1	26	40
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	LTA4H	21	42
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	HDAC10	28	40
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	HDAC2	19	40
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	HDAC3	20	40
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	HDAC6	20	40
O=C(CCNCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240620	CF	On-Demand	Anodyne	HDAC11	32	40
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	LTA4H	21	42
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	HDAC10	28	40
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	HDAC2	19	40
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	HDAC3	20	40
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	HDAC6	20	40
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000872240621	CF	On-Demand	Anodyne	HDAC11	32	40
CSc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240625	FF	On-Demand	Mild	ADRB1	26	40
CSc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240627	FF	On-Demand	Mild	ADRB1	26	40
CSc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240630	FF	On-Demand	Mild	ADRB1	26	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	CTSD	78	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	PGC	67	41
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	CMA1	30	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	CTRA_BOVIN	19	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	PAPA1_CARPA	38	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	CTSL	18	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	PGA	48	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	BACE2	56	37
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	TACR3	18	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	REN	93	50
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	REN1	38	48
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	CAPN1	18	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	BACE1	64	45
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccnn1C	ZINC000872240634	GF	On-Demand	Anodyne	FPR1	57	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	CA2	16	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	AVPR2	38	40
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	AVPR1A	17	40
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	CA1	15	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	PRNP	47	35
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	CA9	15	42
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	L3MBTL3	57	42
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872240643	HE	On-Demand	Mild	NOD2	41	34
COCCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240688	FF	On-Demand	Anodyne	ADRB2	34	50
COCCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240688	FF	On-Demand	Anodyne	ADRB1	57	50
COCCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240688	FF	On-Demand	Anodyne	GRIN1	15	43
COCCc1ccc(OC[C@@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240688	FF	On-Demand	Anodyne	ADRB3	37	42
COCCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240689	FF	On-Demand	Anodyne	ADRB2	34	50
COCCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240689	FF	On-Demand	Anodyne	ADRB1	57	50
COCCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240689	FF	On-Demand	Anodyne	GRIN1	15	43
COCCc1ccc(OC[C@H](O)CNCc2noc3cc(F)ccc23)cc1	ZINC000872240689	FF	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240690	DE	On-Demand	Mild	ADRB2	31	47
Cc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240690	DE	On-Demand	Mild	ADRB1	30	41
Cc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240691	DE	On-Demand	Mild	ADRB2	31	47
Cc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240691	DE	On-Demand	Mild	ADRB1	30	41
Cc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240692	DE	On-Demand	Mild	ADRB2	31	47
Cc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240692	DE	On-Demand	Mild	ADRB1	30	41
Cc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240693	DE	On-Demand	Mild	ADRB2	31	47
Cc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240693	DE	On-Demand	Mild	ADRB1	30	41
N#Cc1ccc2c(c1)C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000872240700	EG	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000872240701	EG	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000872240702	EG	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000872240703	EG	On-Demand	Mild	ADRB3	18	42
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1cc2cnccc2o1	ZINC000872240777	FG	On-Demand	Anodyne	ADRB2	18	60
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1cc2cnccc2o1	ZINC000872240777	FG	On-Demand	Anodyne	ADRB1	26	60
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1cc2cnccc2o1	ZINC000872240778	FG	On-Demand	Anodyne	ADRB2	18	60
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1cc2cnccc2o1	ZINC000872240778	FG	On-Demand	Anodyne	ADRB1	26	60
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1cc2cnccc2o1	ZINC000872240780	EH	On-Demand	Anodyne	ADRB2	29	44
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1cc2cnccc2o1	ZINC000872240780	EH	On-Demand	Anodyne	ADRB1	28	40
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1cc2cnccc2o1	ZINC000872240782	EH	On-Demand	Anodyne	ADRB2	29	44
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1cc2cnccc2o1	ZINC000872240782	EH	On-Demand	Anodyne	ADRB1	28	40
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1cc2cnccc2o1	ZINC000872240785	EH	On-Demand	Anodyne	ADRB2	24	44
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1cc2cnccc2o1	ZINC000872240787	EH	On-Demand	Anodyne	ADRB2	24	44
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240804	DD	On-Demand	Mild	ADRB1	23	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872240805	DD	On-Demand	Mild	ADRB1	23	41
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Cl)cc1	ZINC000872240806	EE	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc(Cl)cc1	ZINC000872240807	EE	On-Demand	Anodyne	ADRB1	28	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240820	CD	On-Demand	Anodyne	ADRB2	38	45
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240820	CD	On-Demand	Anodyne	ADRB1	51	40
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240820	CD	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240821	CD	On-Demand	Anodyne	ADRB2	38	45
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240821	CD	On-Demand	Anodyne	ADRB1	51	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccccc1	ZINC000872240821	CD	On-Demand	Anodyne	ADRB3	37	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240829	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240829	GG	On-Demand	Anodyne	ADRB1	57	48
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240829	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240830	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240830	GG	On-Demand	Anodyne	ADRB1	57	48
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240830	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240831	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240831	GG	On-Demand	Anodyne	ADRB1	57	48
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872240831	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240832	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240832	GG	On-Demand	Anodyne	ADRB1	57	48
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872240832	GG	On-Demand	Anodyne	ADRB3	40	41
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccnn1C	ZINC000872240837	DD	On-Demand	Mild	ADRB2	26	45
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccnn1C	ZINC000872240837	DD	On-Demand	Mild	ADRB1	26	43
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccnn1C	ZINC000872240841	DD	On-Demand	Mild	ADRB2	26	45
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccnn1C	ZINC000872240841	DD	On-Demand	Mild	ADRB1	26	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240842	GG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240842	GG	On-Demand	Anodyne	ADRB1	59	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240842	GG	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240842	GG	On-Demand	Anodyne	VCP	25	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240844	GG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240844	GG	On-Demand	Anodyne	ADRB1	59	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240844	GG	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240844	GG	On-Demand	Anodyne	VCP	25	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240846	GG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240846	GG	On-Demand	Anodyne	ADRB1	59	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240846	GG	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240846	GG	On-Demand	Anodyne	VCP	25	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240848	GG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240848	GG	On-Demand	Anodyne	ADRB1	59	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240848	GG	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000872240848	GG	On-Demand	Anodyne	VCP	25	40
O=C(CCN[C@@H]1C[C@H]1C1CCOCC1)Nc1cccc(C(F)(F)F)c1	ZINC000872240872	FG	On-Demand	Anodyne	EPHX2	17	43
C[C@H](NC[C@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240883	FG	On-Demand	Anodyne	ADRB2	49	52
C[C@H](NC[C@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240883	FG	On-Demand	Anodyne	ADRB1	54	44
C[C@H](NC[C@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240883	FG	On-Demand	Anodyne	ADRB3	38	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(SC(F)F)cc1	ZINC000872240886	GI	On-Demand	Anodyne	AVPR2	43	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(SC(F)F)cc1	ZINC000872240886	GI	On-Demand	Anodyne	AVPR1A	23	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(SC(F)F)cc1	ZINC000872240886	GI	On-Demand	Anodyne	PRNP	57	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(SC(F)F)cc1	ZINC000872240886	GI	On-Demand	Anodyne	MLYCD	19	44
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(SC(F)F)cc1	ZINC000872240886	GI	On-Demand	Anodyne	L3MBTL3	72	41
C[C@@H](NC[C@@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240887	FG	On-Demand	Anodyne	ADRB2	49	52
C[C@@H](NC[C@@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240887	FG	On-Demand	Anodyne	ADRB1	54	44
C[C@@H](NC[C@@H](O)COc1ccc(-c2ccccc2)cc1)c1ccnn1C	ZINC000872240887	FG	On-Demand	Anodyne	ADRB3	38	44
CCOc1ccc(OC[C@@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240896	FE	On-Demand	Mild	ADRB1	30	41
CCOc1ccc(OC[C@@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240897	FE	On-Demand	Mild	ADRB1	30	41
CCOc1ccc(OC[C@H](O)CN[C@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240898	FE	On-Demand	Mild	ADRB1	30	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2Cc3ccc(C#N)cc3C2)cc1	ZINC000872240899	FE	On-Demand	Mild	ADRB1	30	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240908	GG	On-Demand	Anodyne	ADRB2	42	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240908	GG	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240908	GG	On-Demand	Anodyne	ADRB3	47	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240909	GG	On-Demand	Anodyne	ADRB2	42	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240909	GG	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872240909	GG	On-Demand	Anodyne	ADRB3	47	41
NC(=O)c1cc(CNC[C@@H](O)Cc2cccc(Cl)c2)n2c1CCCC2	ZINC000872240916	FE	On-Demand	Anodyne	PTGER4	15	40
NC(=O)c1cc(CNC[C@@H](O)Cc2cccc(Cl)c2)n2c1CCCC2	ZINC000872240916	FE	On-Demand	Anodyne	DPP7	30	43
NC(=O)c1cc(CNC[C@H](O)Cc2cccc(Cl)c2)n2c1CCCC2	ZINC000872240917	FE	On-Demand	Anodyne	PTGER4	15	40
NC(=O)c1cc(CNC[C@H](O)Cc2cccc(Cl)c2)n2c1CCCC2	ZINC000872240917	FE	On-Demand	Anodyne	DPP7	30	43
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240946	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240946	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240946	CE	On-Demand	Anodyne	ADRB3	50	42
O[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000872240947	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000872240947	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000872240947	CE	On-Demand	Anodyne	ADRB3	50	42
O[C@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240948	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240948	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNCC[C@@H](O)C1CCCC1)c1ccccc1	ZINC000872240948	CE	On-Demand	Anodyne	ADRB3	50	42
O[C@H](CNCC[C@H](O)C1CCCC1)c1ccccc1	ZINC000872240949	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@H](CNCC[C@H](O)C1CCCC1)c1ccccc1	ZINC000872240949	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNCC[C@H](O)C1CCCC1)c1ccccc1	ZINC000872240949	CE	On-Demand	Anodyne	ADRB3	50	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240962	CD	On-Demand	Anodyne	ADRB2	76	55
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240962	CD	On-Demand	Anodyne	ADRB1	104	55
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240962	CD	On-Demand	Anodyne	ADRB3	71	55
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240962	CD	On-Demand	Anodyne	CASR	20	43
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240962	CD	On-Demand	Anodyne	ABCB1	19	53
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240963	CD	On-Demand	Anodyne	ADRB2	76	55
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240963	CD	On-Demand	Anodyne	ADRB1	104	55
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240963	CD	On-Demand	Anodyne	ADRB3	71	55
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240963	CD	On-Demand	Anodyne	CASR	20	43
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1	ZINC000872240963	CD	On-Demand	Anodyne	ABCB1	19	53
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1	ZINC000872240964	CD	On-Demand	Anodyne	ADRB2	76	55
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1	ZINC000872240964	CD	On-Demand	Anodyne	ADRB1	104	55
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1	ZINC000872240964	CD	On-Demand	Anodyne	ADRB3	71	55
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1	ZINC000872240964	CD	On-Demand	Anodyne	CASR	20	43
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1	ZINC000872240964	CD	On-Demand	Anodyne	ABCB1	19	53
O[C@@H](CCNC[C@@H](O)COc1ccccc1)C1CCCC1	ZINC000872240965	CD	On-Demand	Anodyne	ADRB2	76	55
O[C@@H](CCNC[C@@H](O)COc1ccccc1)C1CCCC1	ZINC000872240965	CD	On-Demand	Anodyne	ADRB1	104	55
O[C@@H](CCNC[C@@H](O)COc1ccccc1)C1CCCC1	ZINC000872240965	CD	On-Demand	Anodyne	ADRB3	71	55
O[C@@H](CCNC[C@@H](O)COc1ccccc1)C1CCCC1	ZINC000872240965	CD	On-Demand	Anodyne	CASR	20	43
O[C@@H](CCNC[C@@H](O)COc1ccccc1)C1CCCC1	ZINC000872240965	CD	On-Demand	Anodyne	ABCB1	19	53
NC(=O)c1cc(CNC[C@@H](O)Cc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872240970	GF	On-Demand	Anodyne	TRY2_BOVIN	55	35
NC(=O)c1cc(CNC[C@@H](O)Cc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872240970	GF	On-Demand	Anodyne	DPP7	17	43
NC(=O)c1cc(CNC[C@H](O)Cc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872240971	GF	On-Demand	Anodyne	TRY2_BOVIN	55	35
NC(=O)c1cc(CNC[C@H](O)Cc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872240971	GF	On-Demand	Anodyne	DPP7	17	43
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240976	EF	On-Demand	Anodyne	ADRB2	53	46
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240976	EF	On-Demand	Anodyne	ADRB1	82	53
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240976	EF	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240977	EF	On-Demand	Anodyne	ADRB2	53	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240977	EF	On-Demand	Anodyne	ADRB1	82	53
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240977	EF	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240978	EF	On-Demand	Anodyne	ADRB2	53	46
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240978	EF	On-Demand	Anodyne	ADRB1	82	53
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(Cl)cc1	ZINC000872240978	EF	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCCC1	ZINC000872240979	EF	On-Demand	Anodyne	ADRB2	53	46
O[C@@H](CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCCC1	ZINC000872240979	EF	On-Demand	Anodyne	ADRB1	82	53
O[C@@H](CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCCC1	ZINC000872240979	EF	On-Demand	Anodyne	ADRB3	54	46
Cc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240980	EF	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240980	EF	On-Demand	Anodyne	ADRB1	55	41
Cc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240980	EF	On-Demand	Anodyne	ADRB3	35	41
Cc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240981	EF	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240981	EF	On-Demand	Anodyne	ADRB1	55	41
Cc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872240981	EF	On-Demand	Anodyne	ADRB3	35	41
CSc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241015	GG	On-Demand	Anodyne	ADRB2	40	39
CSc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241015	GG	On-Demand	Anodyne	ADRB1	59	39
CSc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241016	GG	On-Demand	Anodyne	ADRB2	40	39
CSc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241016	GG	On-Demand	Anodyne	ADRB1	59	39
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241021	FF	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241021	FF	On-Demand	Anodyne	ADRB1	61	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241021	FF	On-Demand	Anodyne	ADRB3	38	41
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241022	FF	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241022	FF	On-Demand	Anodyne	ADRB1	61	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241022	FF	On-Demand	Anodyne	ADRB3	38	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241044	FF	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241044	FF	On-Demand	Anodyne	ADRB1	73	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241044	FF	On-Demand	Anodyne	ADRB3	44	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241045	FF	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241045	FF	On-Demand	Anodyne	ADRB1	73	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCCO3)cc1	ZINC000872241045	FF	On-Demand	Anodyne	ADRB3	44	47
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241059	DE	On-Demand	Anodyne	ADRB2	26	48
Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241059	DE	On-Demand	Anodyne	ADRB1	32	40
Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241060	DE	On-Demand	Anodyne	ADRB2	26	48
Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241060	DE	On-Demand	Anodyne	ADRB1	32	40
C[C@H](NC[C@H](O)COc1ccccc1F)c1cc2cnccc2o1	ZINC000872241062	EG	On-Demand	Anodyne	ADRB2	24	44
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1cc2cnccc2o1	ZINC000872241064	EG	On-Demand	Anodyne	ADRB2	24	44
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872241083	FH	On-Demand	Anodyne	ADRB2	21	42
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872241084	FH	On-Demand	Anodyne	ADRB2	21	42
CSc1ccc(OC[C@H](O)CN[C@H](C)c2cc3cnccc3o2)cc1	ZINC000872241085	FH	On-Demand	Anodyne	ADRB2	21	42
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000872241086	FH	On-Demand	Anodyne	ADRB2	21	42
NC(=O)c1cc(CNC[C@H](O)c2cccc(Cl)c2)n2c1CCCC2	ZINC000872241112	EE	On-Demand	Anodyne	ADRB1	31	45
NC(=O)c1cc(CNC[C@H](O)c2cccc(Cl)c2)n2c1CCCC2	ZINC000872241112	EE	On-Demand	Anodyne	ADRB3	49	45
NC(=O)c1cc(CNC[C@@H](O)c2cccc(Cl)c2)n2c1CCCC2	ZINC000872241113	EE	On-Demand	Anodyne	ADRB1	31	45
NC(=O)c1cc(CNC[C@@H](O)c2cccc(Cl)c2)n2c1CCCC2	ZINC000872241113	EE	On-Demand	Anodyne	ADRB3	49	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241141	FD	On-Demand	Anodyne	ADRB2	62	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241141	FD	On-Demand	Anodyne	ADRB1	104	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241141	FD	On-Demand	Anodyne	GRIN1	18	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241141	FD	On-Demand	Anodyne	ADRB3	68	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241142	FD	On-Demand	Anodyne	ADRB2	62	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241142	FD	On-Demand	Anodyne	ADRB1	104	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241142	FD	On-Demand	Anodyne	GRIN1	18	42
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241142	FD	On-Demand	Anodyne	ADRB3	68	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241143	FD	On-Demand	Anodyne	ADRB2	62	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241143	FD	On-Demand	Anodyne	ADRB1	104	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241143	FD	On-Demand	Anodyne	GRIN1	18	42
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241143	FD	On-Demand	Anodyne	ADRB3	68	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241144	FD	On-Demand	Anodyne	ADRB2	62	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241144	FD	On-Demand	Anodyne	ADRB1	104	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241144	FD	On-Demand	Anodyne	GRIN1	18	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241144	FD	On-Demand	Anodyne	ADRB3	68	59
O[C@@H](CCNC[C@@H](O)COCc1ccccc1F)C1CCCC1	ZINC000872241180	EE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1F	ZINC000872241182	EE	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC[C@@H](O)C1CCCC1)COCc1ccccc1F	ZINC000872241183	EE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC[C@H](O)C1CCCC1)COCc1ccccc1F	ZINC000872241185	EE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241197	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241197	CE	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CCNC[C@H](O)c1cccc(F)c1)C1CCCC1	ZINC000872241199	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CCNC[C@H](O)c1cccc(F)c1)C1CCCC1	ZINC000872241199	CE	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCC[C@@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241201	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNCC[C@@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241201	CE	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCC[C@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241203	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNCC[C@H](O)C1CCCC1)c1cccc(F)c1	ZINC000872241203	CE	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872241228	EE	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872241228	EE	On-Demand	Anodyne	ADRB3	17	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872241230	EE	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000872241230	EE	On-Demand	Anodyne	ADRB3	17	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241236	GF	On-Demand	Anodyne	ADRB2	42	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241236	GF	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241236	GF	On-Demand	Anodyne	ADRB3	47	43
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241247	FE	On-Demand	Mild	ADRB2	35	40
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241247	FE	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241247	FE	On-Demand	Mild	ADRB3	34	40
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241248	FE	On-Demand	Mild	ADRB2	35	40
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241248	FE	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Br)s2)cc1	ZINC000872241248	FE	On-Demand	Mild	ADRB3	34	40
O[C@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc2ccccc2c1	ZINC000872241251	EF	On-Demand	Anodyne	ADRB2	25	50
O[C@@H](CN[C@@H]1C[C@H]1C1CCOCC1)COc1ccc2ccccc2c1	ZINC000872241252	EF	On-Demand	Anodyne	ADRB2	25	50
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241271	EE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872241272	EE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241273	GF	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241273	GF	On-Demand	Anodyne	ADRB1	61	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241273	GF	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241274	GF	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241274	GF	On-Demand	Anodyne	ADRB1	61	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Br)s2)c1	ZINC000872241274	GF	On-Demand	Anodyne	ABCB1	16	46
CN(C)c1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000872241284	EG	On-Demand	Anodyne	ADRB2	16	57
CN(C)c1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000872241284	EG	On-Demand	Anodyne	ADRB1	27	57
CN(C)c1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000872241285	EG	On-Demand	Anodyne	ADRB2	16	57
CN(C)c1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000872241285	EG	On-Demand	Anodyne	ADRB1	27	57
CN(C)c1ccc(NCCC(=O)Nc2cccnc2)cc1F	ZINC000872241293	DF	On-Demand	Anodyne	NAMPT	16	42
CN(C)c1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1F	ZINC000872241308	EF	On-Demand	Mild	ADRB1	49	38
CN(C)c1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1F	ZINC000872241308	EF	On-Demand	Mild	GRIN1	23	40
CN(C)c1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1F	ZINC000872241309	EF	On-Demand	Mild	ADRB1	49	38
CN(C)c1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1F	ZINC000872241309	EF	On-Demand	Mild	GRIN1	23	40
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	ADRB2	44	48
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	ADRB1	62	43
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	GRIN1	21	41
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	ADRB3	36	43
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	CDK4	20	44
CN(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000872241371	DF	On-Demand	Anodyne	PDS	41	32
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	ADRB2	44	48
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	ADRB1	62	43
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	GRIN1	21	41
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	ADRB3	36	43
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	CDK4	20	44
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000872241372	DF	On-Demand	Anodyne	PDS	41	32
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241376	GF	On-Demand	Anodyne	ADRB2	42	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241376	GF	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241376	GF	On-Demand	Anodyne	ADRB3	47	43
COc1ccc(OC)c([C@H](O)CNCC[C@H](O)C2CCCC2)c1	ZINC000872241393	DE	On-Demand	Anodyne	ADRB2	16	44
COc1ccc(OC)c([C@H](O)CNCC[C@@H](O)C2CCCC2)c1	ZINC000872241394	DE	On-Demand	Anodyne	ADRB2	16	44
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241435	DE	On-Demand	Anodyne	ADRB2	61	46
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241435	DE	On-Demand	Anodyne	ADRB1	88	53
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241435	DE	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241436	DE	On-Demand	Anodyne	ADRB2	61	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241436	DE	On-Demand	Anodyne	ADRB1	88	53
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241436	DE	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241437	DE	On-Demand	Anodyne	ADRB2	61	46
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241437	DE	On-Demand	Anodyne	ADRB1	88	53
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccc(F)cc1	ZINC000872241437	DE	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CCNC[C@@H](O)COc1ccc(F)cc1)C1CCCC1	ZINC000872241438	DE	On-Demand	Anodyne	ADRB2	61	46
O[C@@H](CCNC[C@@H](O)COc1ccc(F)cc1)C1CCCC1	ZINC000872241438	DE	On-Demand	Anodyne	ADRB1	88	53
O[C@@H](CCNC[C@@H](O)COc1ccc(F)cc1)C1CCCC1	ZINC000872241438	DE	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241439	EF	On-Demand	Anodyne	ADRB2	43	54
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241439	EF	On-Demand	Anodyne	ADRB1	67	46
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241439	EF	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241439	EF	On-Demand	Anodyne	ABCB1	23	45
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241440	EF	On-Demand	Anodyne	ADRB2	43	54
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241440	EF	On-Demand	Anodyne	ADRB1	67	46
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241440	EF	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241440	EF	On-Demand	Anodyne	ABCB1	23	45
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241441	EF	On-Demand	Anodyne	ADRB2	43	54
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241441	EF	On-Demand	Anodyne	ADRB1	67	46
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241441	EF	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1ccccc1Cl	ZINC000872241441	EF	On-Demand	Anodyne	ABCB1	23	45
O[C@@H](CCNC[C@@H](O)COc1ccccc1Cl)C1CCCC1	ZINC000872241442	EF	On-Demand	Anodyne	ADRB2	43	54
O[C@@H](CCNC[C@@H](O)COc1ccccc1Cl)C1CCCC1	ZINC000872241442	EF	On-Demand	Anodyne	ADRB1	67	46
O[C@@H](CCNC[C@@H](O)COc1ccccc1Cl)C1CCCC1	ZINC000872241442	EF	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CCNC[C@@H](O)COc1ccccc1Cl)C1CCCC1	ZINC000872241442	EF	On-Demand	Anodyne	ABCB1	23	45
O[C@H](CN[C@@H]1CCCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872241468	CE	On-Demand	Anodyne	MGAM	21	42
O[C@H](CN[C@@H]1CCCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872241468	CE	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CN[C@@H]1CCCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872241468	CE	On-Demand	Anodyne	ADRB3	52	48
O[C@H](CN[C@@H]1CCCC[C@@H]1O)c1cccc(Cl)c1	ZINC000872241468	CE	On-Demand	Anodyne	CYP3A4	43	36
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872241469	CE	On-Demand	Anodyne	MGAM	21	42
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872241469	CE	On-Demand	Anodyne	ADRB1	43	44
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872241469	CE	On-Demand	Anodyne	ADRB3	52	48
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872241469	CE	On-Demand	Anodyne	CYP3A4	43	36
Oc1nc(CNC[C@@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241479	FD	On-Demand	Anodyne	ADRB2	20	40
Oc1nc(CNC[C@@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241479	FD	On-Demand	Anodyne	ADRB1	36	40
Oc1nc(CNC[C@@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241479	FD	On-Demand	Anodyne	ADRB3	24	40
Oc1nc(CNC[C@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241480	FD	On-Demand	Anodyne	ADRB2	20	40
Oc1nc(CNC[C@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241480	FD	On-Demand	Anodyne	ADRB1	36	40
Oc1nc(CNC[C@H](O)COc2ccc(Cl)cc2)nc2c1COCC2	ZINC000872241480	FD	On-Demand	Anodyne	ADRB3	24	40
O=C(CCNCc1nc(O)c2c(n1)CCOC2)Nc1cccc(F)c1	ZINC000872241560	ED	On-Demand	Anodyne	WNT3A	50	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@@H](O)C2CCCC2)CC1	ZINC000872241582	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@@H](O)C2CCCC2)CC1	ZINC000872241583	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@H](O)C2CCCC2)CC1	ZINC000872241584	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@H](O)C2CCCC2)CC1	ZINC000872241585	FF	On-Demand	Anodyne	GPR119	31	42
O[C@@H](CNCC[C@@H](O)C1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000872241723	EG	On-Demand	Anodyne	ADRB3	16	40
O[C@@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C1CCCC1	ZINC000872241724	EG	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCC[C@@H](O)C1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000872241725	EG	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCC[C@H](O)C1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000872241726	EG	On-Demand	Anodyne	ADRB3	16	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241743	ED	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241743	ED	On-Demand	Anodyne	ADRB3	47	38
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241744	ED	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241744	ED	On-Demand	Anodyne	ADRB3	47	38
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241745	ED	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241745	ED	On-Demand	Anodyne	ADRB3	47	38
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241746	ED	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241746	ED	On-Demand	Anodyne	ADRB3	47	38
N#Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241762	DD	On-Demand	Mild	ADRB2	49	43
N#Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241762	DD	On-Demand	Mild	ADRB1	79	43
N#Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241762	DD	On-Demand	Mild	ADRB3	47	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241763	DD	On-Demand	Mild	ADRB2	49	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241763	DD	On-Demand	Mild	ADRB1	79	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241763	DD	On-Demand	Mild	ADRB3	47	43
N#Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241764	DD	On-Demand	Mild	ADRB2	49	43
N#Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241764	DD	On-Demand	Mild	ADRB1	79	43
N#Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241764	DD	On-Demand	Mild	ADRB3	47	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241765	DD	On-Demand	Mild	ADRB2	49	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241765	DD	On-Demand	Mild	ADRB1	79	43
N#Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241765	DD	On-Demand	Mild	ADRB3	47	43
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241784	EE	On-Demand	Anodyne	ADRB2	30	73
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241784	EE	On-Demand	Anodyne	ADRB1	63	61
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241784	EE	On-Demand	Anodyne	HTR1A	18	73
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241784	EE	On-Demand	Anodyne	SLC6A4	20	45
O[C@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241784	EE	On-Demand	Anodyne	ADRB3	21	61
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241785	EE	On-Demand	Anodyne	ADRB2	30	73
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241785	EE	On-Demand	Anodyne	ADRB1	63	61
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241785	EE	On-Demand	Anodyne	HTR1A	18	73
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241785	EE	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNCC[C@@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241785	EE	On-Demand	Anodyne	ADRB3	21	61
O[C@@H](CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCCC1	ZINC000872241786	EE	On-Demand	Anodyne	ADRB2	30	73
O[C@@H](CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCCC1	ZINC000872241786	EE	On-Demand	Anodyne	ADRB1	63	61
O[C@@H](CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCCC1	ZINC000872241786	EE	On-Demand	Anodyne	HTR1A	18	73
O[C@@H](CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCCC1	ZINC000872241786	EE	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCCC1	ZINC000872241786	EE	On-Demand	Anodyne	ADRB3	21	61
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241787	EE	On-Demand	Anodyne	ADRB2	30	73
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241787	EE	On-Demand	Anodyne	ADRB1	63	61
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241787	EE	On-Demand	Anodyne	HTR1A	18	73
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241787	EE	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNCC[C@H](O)C1CCCC1)COc1cccc2[nH]ccc12	ZINC000872241787	EE	On-Demand	Anodyne	ADRB3	21	61
NC(=O)c1cc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)n2c1CCCC2	ZINC000872241829	GD	On-Demand	Anodyne	NPFFR2	38	41
NC(=O)c1cc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)n2c1CCCC2	ZINC000872241829	GD	On-Demand	Anodyne	NPFFR1	50	42
NC(=O)c1cc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)n2c1CCCC2	ZINC000872241830	GD	On-Demand	Anodyne	NPFFR2	38	41
NC(=O)c1cc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)n2c1CCCC2	ZINC000872241830	GD	On-Demand	Anodyne	NPFFR1	50	42
Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241856	DE	On-Demand	Anodyne	ADRB2	63	54
Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241856	DE	On-Demand	Anodyne	ADRB1	84	53
Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241856	DE	On-Demand	Anodyne	ADRB3	56	46
Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241857	DE	On-Demand	Anodyne	ADRB2	63	54
Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241857	DE	On-Demand	Anodyne	ADRB1	84	53
Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241857	DE	On-Demand	Anodyne	ADRB3	56	46
Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241858	DE	On-Demand	Anodyne	ADRB2	63	54
Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241858	DE	On-Demand	Anodyne	ADRB1	84	53
Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241858	DE	On-Demand	Anodyne	ADRB3	56	46
Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241859	DE	On-Demand	Anodyne	ADRB2	63	54
Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241859	DE	On-Demand	Anodyne	ADRB1	84	53
Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241859	DE	On-Demand	Anodyne	ADRB3	56	46
N#CCc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241861	FE	On-Demand	Mild	ADRB1	47	39
N#CCc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241862	FE	On-Demand	Mild	ADRB1	47	39
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241889	EE	On-Demand	Anodyne	ADRB2	58	45
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241889	EE	On-Demand	Anodyne	ADRB1	92	47
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241889	EE	On-Demand	Anodyne	ADRB3	60	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241889	EE	On-Demand	Anodyne	ABCB1	21	67
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241890	EE	On-Demand	Anodyne	ADRB2	58	45
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241890	EE	On-Demand	Anodyne	ADRB1	92	47
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241890	EE	On-Demand	Anodyne	ADRB3	60	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241890	EE	On-Demand	Anodyne	ABCB1	21	67
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241891	EE	On-Demand	Anodyne	ADRB2	58	45
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241891	EE	On-Demand	Anodyne	ADRB1	92	47
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241891	EE	On-Demand	Anodyne	ADRB3	60	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241891	EE	On-Demand	Anodyne	ABCB1	21	67
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241892	EE	On-Demand	Anodyne	ADRB2	58	45
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241892	EE	On-Demand	Anodyne	ADRB1	92	47
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241892	EE	On-Demand	Anodyne	ADRB3	60	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241892	EE	On-Demand	Anodyne	ABCB1	21	67
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	ADRB2	36	58
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	ADRB1	86	55
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	ADRB3	21	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	CASR	46	48
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	CYP2D6	22	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241907	DD	On-Demand	Mild	ABCB1	15	43
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	ADRB2	36	58
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	ADRB1	86	55
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	ADRB3	21	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	CASR	46	48
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	CYP2D6	22	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@@H](O)C1CCCC1	ZINC000872241908	DD	On-Demand	Mild	ABCB1	15	43
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	ADRB2	36	58
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	ADRB1	86	55
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	ADRB3	21	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	CASR	46	48
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	CYP2D6	22	49
N#Cc1ccccc1OC[C@@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241909	DD	On-Demand	Mild	ABCB1	15	43
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	ADRB2	36	58
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	ADRB1	86	55
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	ADRB3	21	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	CASR	46	48
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	CYP2D6	22	49
N#Cc1ccccc1OC[C@H](O)CNCC[C@H](O)C1CCCC1	ZINC000872241910	DD	On-Demand	Mild	ABCB1	15	43
Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c(C)c1	ZINC000872241923	DF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)c(C)c1	ZINC000872241923	DF	On-Demand	Anodyne	ADRB1	40	39
Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c(C)c1	ZINC000872241924	DF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)c(C)c1	ZINC000872241924	DF	On-Demand	Anodyne	ADRB1	40	39
Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c(C)c1	ZINC000872241925	DF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)c(C)c1	ZINC000872241925	DF	On-Demand	Anodyne	ADRB1	40	39
Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c(C)c1	ZINC000872241926	DF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)c(C)c1	ZINC000872241926	DF	On-Demand	Anodyne	ADRB1	40	39
N#CCc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241934	EE	On-Demand	Mild	ADRB2	51	46
N#CCc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241934	EE	On-Demand	Mild	ADRB1	84	46
N#CCc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241934	EE	On-Demand	Mild	ADRB3	54	46
N#CCc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241935	EE	On-Demand	Mild	ADRB2	51	46
N#CCc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241935	EE	On-Demand	Mild	ADRB1	84	46
N#CCc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241935	EE	On-Demand	Mild	ADRB3	54	46
N#CCc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241936	EE	On-Demand	Mild	ADRB2	51	46
N#CCc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241936	EE	On-Demand	Mild	ADRB1	84	46
N#CCc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241936	EE	On-Demand	Mild	ADRB3	54	46
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241937	EE	On-Demand	Mild	ADRB2	51	46
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241937	EE	On-Demand	Mild	ADRB1	84	46
N#CCc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241937	EE	On-Demand	Mild	ADRB3	54	46
CSc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241944	EF	On-Demand	Anodyne	ADRB2	54	43
CSc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241944	EF	On-Demand	Anodyne	ADRB1	76	43
CSc1ccc(OC[C@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241944	EF	On-Demand	Anodyne	ADRB3	50	43
CSc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241945	EF	On-Demand	Anodyne	ADRB2	54	43
CSc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241945	EF	On-Demand	Anodyne	ADRB1	76	43
CSc1ccc(OC[C@@H](O)CNCC[C@@H](O)C2CCCC2)cc1	ZINC000872241945	EF	On-Demand	Anodyne	ADRB3	50	43
CSc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241946	EF	On-Demand	Anodyne	ADRB2	54	43
CSc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241946	EF	On-Demand	Anodyne	ADRB1	76	43
CSc1ccc(OC[C@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241946	EF	On-Demand	Anodyne	ADRB3	50	43
CSc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241947	EF	On-Demand	Anodyne	ADRB2	54	43
CSc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241947	EF	On-Demand	Anodyne	ADRB1	76	43
CSc1ccc(OC[C@@H](O)CNCC[C@H](O)C2CCCC2)cc1	ZINC000872241947	EF	On-Demand	Anodyne	ADRB3	50	43
O=C(CCNCC[C@H](O)C1CCCC1)Nc1cccnc1	ZINC000872241953	CD	On-Demand	Anodyne	NAMPT	19	46
O=C(CCNCC[C@@H](O)C1CCCC1)Nc1cccnc1	ZINC000872241954	CD	On-Demand	Anodyne	NAMPT	19	46
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000872241955	BD	On-Demand	Anodyne	ADRB1	25	45
O[C@H]1CCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000872241955	BD	On-Demand	Anodyne	ADRB3	85	45
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCCC[C@@H]2O)c1	ZINC000872241979	CD	On-Demand	Bother	CACNA1D	45	34
N#Cc1ccc(OC[C@@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241990	FE	On-Demand	Mild	ADRB1	46	38
N#Cc1ccc(OC[C@H](O)CNCc2cc3c(nc2O)CCCC3)cc1	ZINC000872241991	FE	On-Demand	Mild	ADRB1	46	38
O[C@H]1CCCC[C@H]1NC[C@H](O)c1ccc(Br)cc1	ZINC000872242046	DE	On-Demand	Anodyne	MGAM	21	40
Oc1nc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)nc2c1COCC2	ZINC000872242047	GD	On-Demand	Anodyne	PDS	40	35
Oc1nc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)nc2c1COCC2	ZINC000872242048	GD	On-Demand	Anodyne	PDS	40	35
CN(C)c1ccc(NC[C@H](O)c2ccccc2)cc1F	ZINC000872242097	CG	On-Demand	Anodyne	AOC3	20	40
CN(C)c1ccc(NC[C@@H](O)c2ccccc2)cc1F	ZINC000872242098	CG	On-Demand	Anodyne	AOC3	20	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242114	EF	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242114	EF	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242114	EF	On-Demand	Anodyne	PDS	52	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242115	EF	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242115	EF	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)c1	ZINC000872242115	EF	On-Demand	Anodyne	PDS	52	35
CN(C)c1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1F	ZINC000872242142	FF	On-Demand	Anodyne	PKM	37	41
CN(C)c1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1F	ZINC000872242229	FF	On-Demand	Anodyne	PKM	37	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242274	EF	On-Demand	Anodyne	SSTR2	55	34
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242274	EF	On-Demand	Anodyne	CCKAR	68	40
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242274	EF	On-Demand	Anodyne	CTSL	18	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242275	EF	On-Demand	Anodyne	SSTR2	55	34
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242275	EF	On-Demand	Anodyne	CCKAR	68	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc2[nH]ccc12	ZINC000872242275	EF	On-Demand	Anodyne	CTSL	18	41
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242308	EE	On-Demand	Anodyne	ADRB2	30	54
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242308	EE	On-Demand	Anodyne	ADRB1	53	54
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242308	EE	On-Demand	Anodyne	ADRB3	34	40
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242309	EE	On-Demand	Anodyne	ADRB2	30	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242309	EE	On-Demand	Anodyne	ADRB1	53	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2C2CCOCC2)cc1	ZINC000872242309	EE	On-Demand	Anodyne	ADRB3	34	40
Cc1ccc(OC[C@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242320	ED	On-Demand	Anodyne	ADRB2	28	42
Cc1ccc(OC[C@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242320	ED	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242320	ED	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242322	ED	On-Demand	Anodyne	ADRB2	28	42
Cc1ccc(OC[C@@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242322	ED	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@@H](O)CNCc2nc(O)c3c(n2)CCOC3)cc1	ZINC000872242322	ED	On-Demand	Anodyne	ADRB3	25	40
COCC(C)(C)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872242364	CF	On-Demand	Anodyne	ADRB3	29	40
COCC(C)(C)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872242365	CF	On-Demand	Anodyne	ADRB3	29	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242366	CE	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242366	CE	On-Demand	Anodyne	ADRB1	49	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242367	CE	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242367	CE	On-Demand	Anodyne	ADRB1	49	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242368	CE	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242368	CE	On-Demand	Anodyne	ADRB1	49	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242369	CE	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242369	CE	On-Demand	Anodyne	ADRB1	49	40
COCC(C)(C)CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872242387	DG	On-Demand	Anodyne	ADRB2	15	42
COCC(C)(C)CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872242388	DG	On-Demand	Anodyne	ADRB2	15	42
COCC(C)(C)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242393	DD	On-Demand	Mild	ADRB2	44	43
COCC(C)(C)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242393	DD	On-Demand	Mild	ADRB1	69	43
COCC(C)(C)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242393	DD	On-Demand	Mild	ADRB3	36	45
COCC(C)(C)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242393	DD	On-Demand	Mild	CYP2D6	17	40
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242394	DD	On-Demand	Mild	ADRB2	44	43
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242394	DD	On-Demand	Mild	ADRB1	69	43
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242394	DD	On-Demand	Mild	ADRB3	36	45
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242394	DD	On-Demand	Mild	CYP2D6	17	40
C=CC(C)(C)CCCNC[C@H](O)COc1ccccc1C#N	ZINC000872242402	DF	On-Demand	Mild	ADRB2	29	56
C=CC(C)(C)CCCNC[C@H](O)COc1ccccc1C#N	ZINC000872242402	DF	On-Demand	Mild	ADRB1	80	51
C=CC(C)(C)CCCNC[C@H](O)COc1ccccc1C#N	ZINC000872242402	DF	On-Demand	Mild	CASR	49	52
C=CC(C)(C)CCCNC[C@H](O)COc1ccccc1C#N	ZINC000872242402	DF	On-Demand	Mild	CYP2D6	25	54
C=CC(C)(C)CCCNC[C@@H](O)COc1ccccc1C#N	ZINC000872242403	DF	On-Demand	Mild	ADRB2	29	56
C=CC(C)(C)CCCNC[C@@H](O)COc1ccccc1C#N	ZINC000872242403	DF	On-Demand	Mild	ADRB1	80	51
C=CC(C)(C)CCCNC[C@@H](O)COc1ccccc1C#N	ZINC000872242403	DF	On-Demand	Mild	CASR	49	52
C=CC(C)(C)CCCNC[C@@H](O)COc1ccccc1C#N	ZINC000872242403	DF	On-Demand	Mild	CYP2D6	25	54
COCC(C)(C)CCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000872242412	DG	On-Demand	Anodyne	ADRB2	22	40
COCC(C)(C)CCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000872242413	DG	On-Demand	Anodyne	ADRB2	22	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242424	ED	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242424	ED	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242424	ED	On-Demand	Anodyne	ADRB3	48	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242425	ED	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242425	ED	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872242425	ED	On-Demand	Anodyne	ADRB3	48	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242426	ED	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242426	ED	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242426	ED	On-Demand	Anodyne	ADRB3	48	51
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242428	DD	On-Demand	Mild	ADRB2	19	52
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242428	DD	On-Demand	Mild	ADRB1	63	43
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242428	DD	On-Demand	Mild	CASR	40	42
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242428	DD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242429	DD	On-Demand	Mild	ADRB2	19	52
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242429	DD	On-Demand	Mild	ADRB1	63	43
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242429	DD	On-Demand	Mild	CASR	40	42
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1C1CCOCC1	ZINC000872242429	DD	On-Demand	Mild	CYP2D6	17	43
Cn1ncc(I)c1CNC[C@@H](O)COc1ccccc1	ZINC000872242456	GD	On-Demand	Anodyne	ADRB2	51	52
Cn1ncc(I)c1CNC[C@@H](O)COc1ccccc1	ZINC000872242456	GD	On-Demand	Anodyne	ADRB1	61	44
Cn1ncc(I)c1CNC[C@@H](O)COc1ccccc1	ZINC000872242456	GD	On-Demand	Anodyne	ADRB3	46	44
Cn1ncc(I)c1CNC[C@H](O)COc1ccccc1	ZINC000872242457	GD	On-Demand	Anodyne	ADRB2	51	52
Cn1ncc(I)c1CNC[C@H](O)COc1ccccc1	ZINC000872242457	GD	On-Demand	Anodyne	ADRB1	61	44
Cn1ncc(I)c1CNC[C@H](O)COc1ccccc1	ZINC000872242457	GD	On-Demand	Anodyne	ADRB3	46	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCn3nccc32)CC1	ZINC000872242483	FE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCn3nccc32)CC1	ZINC000872242484	FE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCn3nccc32)CC1	ZINC000872242485	FE	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCn3nccc32)CC1	ZINC000872242486	FE	On-Demand	Anodyne	GPR119	45	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872242495	EF	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872242495	EF	On-Demand	Anodyne	ADRB1	53	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872242496	EF	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872242496	EF	On-Demand	Anodyne	ADRB1	53	44
Oc1nc(CNC[C@H](O)COc2ccc3ccccc3c2)nc2c1COCC2	ZINC000872242497	GD	On-Demand	Anodyne	ADRB2	22	45
Oc1nc(CNC[C@@H](O)COc2ccc3ccccc3c2)nc2c1COCC2	ZINC000872242498	GD	On-Demand	Anodyne	ADRB2	22	45
O=C(CCNCc1nc(O)c2c(n1)CCOC2)Nc1cc(F)cc(F)c1	ZINC000872242499	FD	On-Demand	Anodyne	WNT3A	50	34
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242601	ED	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242601	ED	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872242601	ED	On-Demand	Anodyne	ADRB3	48	51
C=CC(C)(C)CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242621	DF	On-Demand	Mild	ADRB2	39	44
C=CC(C)(C)CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242621	DF	On-Demand	Mild	ADRB1	61	44
C=CC(C)(C)CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000872242621	DF	On-Demand	Mild	ADRB3	30	44
C=CC(C)(C)CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242622	DF	On-Demand	Mild	ADRB2	39	44
C=CC(C)(C)CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242622	DF	On-Demand	Mild	ADRB1	61	44
C=CC(C)(C)CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872242622	DF	On-Demand	Mild	ADRB3	30	44
COCC(C)(C)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872242623	EG	On-Demand	Anodyne	ADRB2	57	56
COCC(C)(C)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872242623	EG	On-Demand	Anodyne	ADRB1	68	43
COCC(C)(C)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872242623	EG	On-Demand	Anodyne	ADRB3	43	44
COCC(C)(C)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872242623	EG	On-Demand	Anodyne	CASR	45	41
COCC(C)(C)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872242623	EG	On-Demand	Anodyne	CYP2D6	20	45
COCC(C)(C)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872242624	EG	On-Demand	Anodyne	ADRB2	57	56
COCC(C)(C)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872242624	EG	On-Demand	Anodyne	ADRB1	68	43
COCC(C)(C)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872242624	EG	On-Demand	Anodyne	ADRB3	43	44
COCC(C)(C)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872242624	EG	On-Demand	Anodyne	CASR	45	41
COCC(C)(C)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872242624	EG	On-Demand	Anodyne	CYP2D6	20	45
COCC(C)(C)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872242713	DF	On-Demand	Anodyne	ADRB2	51	46
COCC(C)(C)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872242713	DF	On-Demand	Anodyne	ADRB1	75	46
COCC(C)(C)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872242713	DF	On-Demand	Anodyne	ADRB3	45	47
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872242714	DF	On-Demand	Anodyne	ADRB2	51	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872242714	DF	On-Demand	Anodyne	ADRB1	75	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872242714	DF	On-Demand	Anodyne	ADRB3	45	47
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C	ZINC000872242728	CE	On-Demand	Anodyne	ADRB2	44	62
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C	ZINC000872242728	CE	On-Demand	Anodyne	ADRB1	63	38
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C	ZINC000872242728	CE	On-Demand	Anodyne	ADRB3	21	40
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C	ZINC000872242728	CE	On-Demand	Anodyne	CYP2D6	21	47
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C	ZINC000872242728	CE	On-Demand	Anodyne	ABCB1	27	41
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C	ZINC000872242731	CE	On-Demand	Anodyne	ADRB2	44	62
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C	ZINC000872242731	CE	On-Demand	Anodyne	ADRB1	63	38
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C	ZINC000872242731	CE	On-Demand	Anodyne	ADRB3	21	40
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C	ZINC000872242731	CE	On-Demand	Anodyne	CYP2D6	21	47
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C	ZINC000872242731	CE	On-Demand	Anodyne	ABCB1	27	41
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1F	ZINC000872242777	EF	On-Demand	Bother	ADRB1	53	38
CN(C)c1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1F	ZINC000872242778	EF	On-Demand	Bother	ADRB1	53	38
CN(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1F	ZINC000872242821	EF	On-Demand	Bother	ADRB1	17	44
CN(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1F	ZINC000872242821	EF	On-Demand	Bother	PDS	15	43
CN(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1F	ZINC000872242822	EF	On-Demand	Bother	ADRB1	17	44
CN(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1F	ZINC000872242822	EF	On-Demand	Bother	PDS	15	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cccc2[nH]ccc12	ZINC000872242843	EF	On-Demand	Anodyne	CCKAR	61	36
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cccc2[nH]ccc12	ZINC000872242843	EF	On-Demand	Anodyne	CTSL	18	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cccc2[nH]ccc12	ZINC000872242844	EF	On-Demand	Anodyne	CCKAR	61	36
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cccc2[nH]ccc12	ZINC000872242844	EF	On-Demand	Anodyne	CTSL	18	43
CN(C)c1ccc(NC[C@H](O)COc2ccccc2C#N)cc1F	ZINC000872242859	EF	On-Demand	Mild	ADRB2	17	55
CN(C)c1ccc(NC[C@H](O)COc2ccccc2C#N)cc1F	ZINC000872242859	EF	On-Demand	Mild	ADRB1	72	53
CN(C)c1ccc(NC[C@H](O)COc2ccccc2C#N)cc1F	ZINC000872242859	EF	On-Demand	Mild	CASR	46	48
CN(C)c1ccc(NC[C@H](O)COc2ccccc2C#N)cc1F	ZINC000872242859	EF	On-Demand	Mild	CYP2D6	22	49
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2C#N)cc1F	ZINC000872242860	EF	On-Demand	Mild	ADRB2	17	55
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2C#N)cc1F	ZINC000872242860	EF	On-Demand	Mild	ADRB1	72	53
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2C#N)cc1F	ZINC000872242860	EF	On-Demand	Mild	CASR	46	48
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2C#N)cc1F	ZINC000872242860	EF	On-Demand	Mild	CYP2D6	22	49
COCC(C)(C)CCNC[C@H](O)COc1cccc(C)c1	ZINC000872242967	CE	On-Demand	Anodyne	ADRB2	50	58
COCC(C)(C)CCNC[C@H](O)COc1cccc(C)c1	ZINC000872242967	CE	On-Demand	Anodyne	ADRB1	63	56
COCC(C)(C)CCNC[C@H](O)COc1cccc(C)c1	ZINC000872242967	CE	On-Demand	Anodyne	ADRB3	38	41
COCC(C)(C)CCNC[C@H](O)COc1cccc(C)c1	ZINC000872242967	CE	On-Demand	Anodyne	CASR	21	45
COCC(C)(C)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000872242968	CE	On-Demand	Anodyne	ADRB2	50	58
COCC(C)(C)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000872242968	CE	On-Demand	Anodyne	ADRB1	63	56
COCC(C)(C)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000872242968	CE	On-Demand	Anodyne	ADRB3	38	41
COCC(C)(C)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000872242968	CE	On-Demand	Anodyne	CASR	21	45
NC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242983	GF	On-Demand	Anodyne	ADRB2	25	53
NC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242983	GF	On-Demand	Anodyne	ADRB3	19	44
NC(=O)c1cc(CNC[C@@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242983	GF	On-Demand	Anodyne	ABCB1	42	41
NC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242984	GF	On-Demand	Anodyne	ADRB2	25	53
NC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242984	GF	On-Demand	Anodyne	ADRB3	19	44
NC(=O)c1cc(CNC[C@H](O)COc2cccc3ccccc23)n2c1CCCC2	ZINC000872242984	GF	On-Demand	Anodyne	ABCB1	42	41
CCOc1ccc(OC[C@@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243007	GD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243007	GD	On-Demand	Anodyne	ADRB1	57	40
CCOc1ccc(OC[C@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243008	GD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243008	GD	On-Demand	Anodyne	ADRB1	57	40
CON(C)C(=O)CCNCc1ccc(C)c(Br)c1	ZINC000872243044	DE	On-Demand	Anodyne	LEF	63	35
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000872243070	DF	On-Demand	Anodyne	ADRB2	24	42
CN(C)c1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000872243070	DF	On-Demand	Anodyne	ADRB1	54	38
CN(C)c1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000872243071	DF	On-Demand	Anodyne	ADRB2	24	42
CN(C)c1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000872243071	DF	On-Demand	Anodyne	ADRB1	54	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000872243096	JG	On-Demand	Anodyne	NPY2R	22	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000872243096	JG	On-Demand	Anodyne	GRM4	20	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000872243096	JG	On-Demand	Anodyne	EPHX2	46	49
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000872243096	JG	On-Demand	Anodyne	L3MBTL3	62	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000872243096	JG	On-Demand	Anodyne	NAMPT	23	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243099	FF	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243099	FF	On-Demand	Anodyne	ADRB1	68	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243099	FF	On-Demand	Anodyne	GRIN1	27	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243099	FF	On-Demand	Anodyne	ADRB3	39	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243100	FF	On-Demand	Anodyne	ADRB2	34	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243100	FF	On-Demand	Anodyne	ADRB1	68	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243100	FF	On-Demand	Anodyne	GRIN1	27	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(F)c2)cc1	ZINC000872243100	FF	On-Demand	Anodyne	ADRB3	39	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243150	FG	On-Demand	Anodyne	SSTR2	65	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243150	FG	On-Demand	Anodyne	CCKAR	40	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243150	FG	On-Demand	Anodyne	CCKBR	44	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243150	FG	On-Demand	Anodyne	GPR119	42	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243151	FG	On-Demand	Anodyne	SSTR2	65	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243151	FG	On-Demand	Anodyne	CCKAR	40	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243151	FG	On-Demand	Anodyne	CCKBR	44	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3[nH]ccc23)CC1	ZINC000872243151	FG	On-Demand	Anodyne	GPR119	42	51
COCC(C)(C)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243159	FD	On-Demand	Anodyne	ADRB1	46	41
COCC(C)(C)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243159	FD	On-Demand	Anodyne	ADRB3	27	42
COCC(C)(C)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243160	FD	On-Demand	Anodyne	ADRB1	46	41
COCC(C)(C)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243160	FD	On-Demand	Anodyne	ADRB3	27	42
COCC(C)(C)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000872243164	DF	On-Demand	Anodyne	ADRB2	35	45
COCC(C)(C)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000872243165	DF	On-Demand	Anodyne	ADRB2	35	45
COCC(C)(C)CCNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872243166	DE	On-Demand	Anodyne	NOD2	41	35
COCC(C)(C)CCNC[C@H](O)CN1CCc2ccccc2C1	ZINC000872243167	DE	On-Demand	Anodyne	NOD2	41	35
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2Cl)n2c1CCCC2	ZINC000872243196	GE	On-Demand	Anodyne	ADRB2	19	46
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2Cl)n2c1CCCC2	ZINC000872243196	GE	On-Demand	Anodyne	ABCB1	41	35
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2Cl)n2c1CCCC2	ZINC000872243197	GE	On-Demand	Anodyne	ADRB2	19	46
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2Cl)n2c1CCCC2	ZINC000872243197	GE	On-Demand	Anodyne	ABCB1	41	35
COCC(C)(C)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872243217	DG	On-Demand	Anodyne	ADRB2	23	40
COCC(C)(C)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872243217	DG	On-Demand	Anodyne	CASR	47	45
COCC(C)(C)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872243217	DG	On-Demand	Anodyne	CYP2D6	17	40
COCC(C)(C)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872243218	DG	On-Demand	Anodyne	ADRB2	23	40
COCC(C)(C)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872243218	DG	On-Demand	Anodyne	CASR	47	45
COCC(C)(C)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872243218	DG	On-Demand	Anodyne	CYP2D6	17	40
COCC(C)(C)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000872243219	FF	On-Demand	Anodyne	ADRB2	44	46
COCC(C)(C)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000872243219	FF	On-Demand	Anodyne	ADRB1	55	42
COCC(C)(C)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000872243219	FF	On-Demand	Anodyne	ADRB3	33	42
COCC(C)(C)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000872243219	FF	On-Demand	Anodyne	PDS	50	40
COCC(C)(C)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872243220	FF	On-Demand	Anodyne	ADRB2	44	46
COCC(C)(C)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872243220	FF	On-Demand	Anodyne	ADRB1	55	42
COCC(C)(C)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872243220	FF	On-Demand	Anodyne	ADRB3	33	42
COCC(C)(C)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872243220	FF	On-Demand	Anodyne	PDS	50	40
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2F)n2c1CCCC2	ZINC000872243252	FD	On-Demand	Anodyne	ADRB2	15	40
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2F)n2c1CCCC2	ZINC000872243252	FD	On-Demand	Anodyne	ADRB1	41	36
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2F)n2c1CCCC2	ZINC000872243253	FD	On-Demand	Anodyne	ADRB2	15	40
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2F)n2c1CCCC2	ZINC000872243253	FD	On-Demand	Anodyne	ADRB1	41	36
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	AVPR2	106	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	AVPR1A	58	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	F10	16	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	NPY2R	33	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	PRNP	46	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	EPHX2	15	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	NR2E3	69	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	SMO	39	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	L3MBTL3	85	39
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)nc2ccccc12	ZINC000872243271	GI	On-Demand	Anodyne	HPGD	35	41
CN(C)c1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000872243283	EF	On-Demand	Mild	ADRB1	43	35
CN(C)c1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000872243284	EF	On-Demand	Mild	ADRB1	43	35
Cn1ncc(I)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872243331	GF	On-Demand	Anodyne	ADRB1	26	42
Cn1ncc(I)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872243331	GF	On-Demand	Anodyne	ADRB3	39	42
Cn1ncc(I)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872243332	GF	On-Demand	Anodyne	ADRB1	26	42
Cn1ncc(I)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872243332	GF	On-Demand	Anodyne	ADRB3	39	42
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	ADRB2	43	57
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	ADRB1	60	38
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	ADRB3	24	46
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	CASR	40	41
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	CYP2D6	20	42
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000872243354	DF	On-Demand	Anodyne	ABCB1	16	41
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	ADRB2	43	57
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	ADRB1	60	38
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	ADRB3	24	46
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	CASR	40	41
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	CYP2D6	20	42
COCC(C)(C)CCNC[C@H](O)COc1ccccc1Cl	ZINC000872243355	DF	On-Demand	Anodyne	ABCB1	16	41
Cc1ccc(OC[C@@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243360	FD	On-Demand	Anodyne	ADRB2	35	42
Cc1ccc(OC[C@@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243360	FD	On-Demand	Anodyne	ADRB1	56	42
Cc1ccc(OC[C@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243361	FD	On-Demand	Anodyne	ADRB2	35	42
Cc1ccc(OC[C@H](O)CNCc2cc(C(N)=O)c3n2CCCC3)cc1	ZINC000872243361	FD	On-Demand	Anodyne	ADRB1	56	42
COCC(C)(C)CCNC[C@H](O)COc1ccc(C)cc1C	ZINC000872243387	DF	On-Demand	Anodyne	ADRB2	26	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000872243388	DF	On-Demand	Anodyne	ADRB2	26	46
COCC(C)(C)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000872243412	DF	On-Demand	Anodyne	ADRB2	28	46
COCC(C)(C)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000872243412	DF	On-Demand	Anodyne	ADRB1	54	35
COCC(C)(C)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000872243413	DF	On-Demand	Anodyne	ADRB2	28	46
COCC(C)(C)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000872243413	DF	On-Demand	Anodyne	ADRB1	54	35
COCC(C)(C)CCNC[C@@H](O)CCc1ccccc1	ZINC000872243425	CF	On-Demand	Anodyne	ABCB1	18	43
COCC(C)(C)CCNC[C@H](O)CCc1ccccc1	ZINC000872243426	CF	On-Demand	Anodyne	ABCB1	18	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243437	DE	On-Demand	Anodyne	ADRB1	54	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243438	DE	On-Demand	Anodyne	ADRB1	54	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243439	DE	On-Demand	Anodyne	ADRB1	54	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243440	DE	On-Demand	Anodyne	ADRB1	54	38
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cccnc1SC(F)F	ZINC000872243521	GH	On-Demand	Anodyne	AVPR2	72	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cccnc1SC(F)F	ZINC000872243521	GH	On-Demand	Anodyne	AVPR1A	40	41
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cccnc1SC(F)F	ZINC000872243521	GH	On-Demand	Anodyne	PRNP	40	34
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cccnc1SC(F)F	ZINC000872243521	GH	On-Demand	Anodyne	L3MBTL3	79	35
Oc1nc(CNC[C@H](O)c2cccc(Cl)c2)nc2c1COCC2	ZINC000872243522	ED	On-Demand	Anodyne	ADRB1	24	40
Oc1nc(CNC[C@H](O)c2cccc(Cl)c2)nc2c1COCC2	ZINC000872243522	ED	On-Demand	Anodyne	ADRB3	36	40
Oc1nc(CNC[C@@H](O)c2cccc(Cl)c2)nc2c1COCC2	ZINC000872243523	ED	On-Demand	Anodyne	ADRB1	24	40
Oc1nc(CNC[C@@H](O)c2cccc(Cl)c2)nc2c1COCC2	ZINC000872243523	ED	On-Demand	Anodyne	ADRB3	36	40
Oc1nc(CNC[C@H](O)COc2cccc3ccccc23)nc2c1COCC2	ZINC000872243539	GD	On-Demand	Anodyne	ADRB2	15	49
Oc1nc(CNC[C@@H](O)COc2cccc3ccccc23)nc2c1COCC2	ZINC000872243540	GD	On-Demand	Anodyne	ADRB2	15	49
COCC(C)(C)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872243599	FF	On-Demand	Anodyne	GPR119	25	40
COCC(C)(C)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872243601	FF	On-Demand	Anodyne	GPR119	25	40
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243619	ED	On-Demand	Anodyne	ADRB2	40	41
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243619	ED	On-Demand	Anodyne	ADRB1	68	41
NC(=O)c1cc(CNC[C@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243619	ED	On-Demand	Anodyne	ADRB3	48	41
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243620	ED	On-Demand	Anodyne	ADRB2	40	41
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243620	ED	On-Demand	Anodyne	ADRB1	68	41
NC(=O)c1cc(CNC[C@@H](O)COc2ccccc2)n2c1CCCC2	ZINC000872243620	ED	On-Demand	Anodyne	ADRB3	48	41
COCC(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000872243640	CG	On-Demand	Anodyne	ADRB2	45	41
COCC(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000872243640	CG	On-Demand	Anodyne	ADRB1	57	50
COCC(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000872243640	CG	On-Demand	Anodyne	ADRB3	74	50
COCC(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872243641	CG	On-Demand	Anodyne	ADRB2	45	41
COCC(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872243641	CG	On-Demand	Anodyne	ADRB1	57	50
COCC(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872243641	CG	On-Demand	Anodyne	ADRB3	74	50
COCC(C)(C)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000872243646	CE	On-Demand	Anodyne	ADRB2	54	45
COCC(C)(C)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000872243646	CE	On-Demand	Anodyne	ADRB1	80	45
COCC(C)(C)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000872243646	CE	On-Demand	Anodyne	ADRB3	45	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872243647	CE	On-Demand	Anodyne	ADRB2	54	45
COCC(C)(C)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872243647	CE	On-Demand	Anodyne	ADRB1	80	45
COCC(C)(C)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872243647	CE	On-Demand	Anodyne	ADRB3	45	46
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1F	ZINC000872243662	CE	On-Demand	Anodyne	ADRB2	39	46
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1F	ZINC000872243662	CE	On-Demand	Anodyne	ADRB1	67	42
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1F	ZINC000872243662	CE	On-Demand	Anodyne	ADRB3	22	40
COCC(C)(C)CCNC[C@H](O)COc1ccccc1F	ZINC000872243663	CE	On-Demand	Anodyne	ADRB2	39	46
COCC(C)(C)CCNC[C@H](O)COc1ccccc1F	ZINC000872243663	CE	On-Demand	Anodyne	ADRB1	67	42
COCC(C)(C)CCNC[C@H](O)COc1ccccc1F	ZINC000872243663	CE	On-Demand	Anodyne	ADRB3	22	40
C=CC(C)(C)CCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243677	EF	On-Demand	Mild	ADRB1	32	40
C=CC(C)(C)CCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000872243678	EF	On-Demand	Mild	ADRB1	32	40
COCC(C)(C)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872243679	EG	On-Demand	Anodyne	ADRB3	21	46
COCC(C)(C)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872243680	EG	On-Demand	Anodyne	ADRB3	21	46
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243681	ED	On-Demand	Anodyne	ADRA1D	16	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243681	ED	On-Demand	Anodyne	ADRA1A	15	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243681	ED	On-Demand	Anodyne	ADRA1B	17	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243682	ED	On-Demand	Anodyne	ADRA1D	16	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243682	ED	On-Demand	Anodyne	ADRA1A	15	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C)(C)CO1	ZINC000872243682	ED	On-Demand	Anodyne	ADRA1B	17	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243683	ED	On-Demand	Anodyne	ADRA1D	16	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243683	ED	On-Demand	Anodyne	ADRA1A	15	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243683	ED	On-Demand	Anodyne	ADRA1B	17	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243684	ED	On-Demand	Anodyne	ADRA1D	16	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243684	ED	On-Demand	Anodyne	ADRA1A	15	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C)(C)CO1	ZINC000872243684	ED	On-Demand	Anodyne	ADRA1B	17	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243688	ED	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243688	ED	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243688	ED	On-Demand	Anodyne	ADRB3	38	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243689	ED	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243689	ED	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243689	ED	On-Demand	Anodyne	ADRB3	38	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243728	ED	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243728	ED	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243728	ED	On-Demand	Anodyne	ADRB3	38	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243729	ED	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243729	ED	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243729	ED	On-Demand	Anodyne	ADRB3	38	43
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243740	EE	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243740	EE	On-Demand	Anodyne	ADRB1	68	54
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243740	EE	On-Demand	Anodyne	ADRB3	44	44
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243741	EE	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243741	EE	On-Demand	Anodyne	ADRB1	68	54
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243741	EE	On-Demand	Anodyne	ADRB3	44	44
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243742	EE	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243742	EE	On-Demand	Anodyne	ADRB1	68	54
COCCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872243742	EE	On-Demand	Anodyne	ADRB3	44	44
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243743	EE	On-Demand	Anodyne	ADRB2	39	54
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243743	EE	On-Demand	Anodyne	ADRB1	68	54
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872243743	EE	On-Demand	Anodyne	ADRB3	44	44
NC(=O)c1cc(CNC[C@H](O)COc2ccc(F)cc2)n2c1CCCC2	ZINC000872243744	FD	On-Demand	Anodyne	ADRB1	55	41
NC(=O)c1cc(CNC[C@H](O)COc2ccc(F)cc2)n2c1CCCC2	ZINC000872243744	FD	On-Demand	Anodyne	ADRB3	38	41
NC(=O)c1cc(CNC[C@@H](O)COc2ccc(F)cc2)n2c1CCCC2	ZINC000872243745	FD	On-Demand	Anodyne	ADRB1	55	41
NC(=O)c1cc(CNC[C@@H](O)COc2ccc(F)cc2)n2c1CCCC2	ZINC000872243745	FD	On-Demand	Anodyne	ADRB3	38	41
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C#N	ZINC000872243754	DD	On-Demand	Mild	ADRB2	32	58
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C#N	ZINC000872243754	DD	On-Demand	Mild	ADRB1	82	52
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C#N	ZINC000872243754	DD	On-Demand	Mild	ADRB3	15	57
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C#N	ZINC000872243754	DD	On-Demand	Mild	CASR	51	53
COCC(C)(C)CCNC[C@H](O)COc1ccccc1C#N	ZINC000872243754	DD	On-Demand	Mild	CYP2D6	28	57
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C#N	ZINC000872243755	DD	On-Demand	Mild	ADRB2	32	58
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C#N	ZINC000872243755	DD	On-Demand	Mild	ADRB1	82	52
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C#N	ZINC000872243755	DD	On-Demand	Mild	ADRB3	15	57
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C#N	ZINC000872243755	DD	On-Demand	Mild	CASR	51	53
COCC(C)(C)CCNC[C@@H](O)COc1ccccc1C#N	ZINC000872243755	DD	On-Demand	Mild	CYP2D6	28	57
COCC(C)(C)CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000872243773	DE	On-Demand	Anodyne	ADRB2	17	48
COCC(C)(C)CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000872243774	DE	On-Demand	Anodyne	ADRB2	17	48
COCC(C)(C)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000872243775	CE	On-Demand	Anodyne	ADRB2	53	52
COCC(C)(C)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000872243775	CE	On-Demand	Anodyne	ADRB1	72	46
COCC(C)(C)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000872243775	CE	On-Demand	Anodyne	ADRB3	43	47
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000872243776	CE	On-Demand	Anodyne	ADRB2	53	52
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000872243776	CE	On-Demand	Anodyne	ADRB1	72	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000872243776	CE	On-Demand	Anodyne	ADRB3	43	47
COCC(C)(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243787	CE	On-Demand	Bother	CACNA1C	49	36
COCC(C)(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243787	CE	On-Demand	Bother	ADRB3	43	38
COCC(C)(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243787	CE	On-Demand	Bother	CACNA1D	75	36
COCC(C)(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243788	CE	On-Demand	Bother	CACNA1C	49	36
COCC(C)(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243788	CE	On-Demand	Bother	ADRB3	43	38
COCC(C)(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872243788	CE	On-Demand	Bother	CACNA1D	75	36
COCC(C)(C)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000872243802	DF	On-Demand	Anodyne	ADRB2	36	52
COCC(C)(C)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000872243802	DF	On-Demand	Anodyne	ADRB1	38	40
COCC(C)(C)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000872243803	DF	On-Demand	Anodyne	ADRB2	36	52
COCC(C)(C)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000872243803	DF	On-Demand	Anodyne	ADRB1	38	40
NC(=O)c1cc(CNC[C@H](O)COc2ccc(Cl)cc2)n2c1CCCC2	ZINC000872243809	GE	On-Demand	Anodyne	ADRB1	53	39
NC(=O)c1cc(CNC[C@@H](O)COc2ccc(Cl)cc2)n2c1CCCC2	ZINC000872243810	GE	On-Demand	Anodyne	ADRB1	53	39
COCC(C)(C)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000872243920	EG	On-Demand	Anodyne	ADRB2	25	44
COCC(C)(C)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000872243921	EG	On-Demand	Anodyne	ADRB2	25	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)c(C)c1	ZINC000872243933	DE	On-Demand	Anodyne	ADRB2	15	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)c(C)c1	ZINC000872243934	DE	On-Demand	Anodyne	ADRB2	15	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)c(C)c1	ZINC000872243935	DE	On-Demand	Anodyne	ADRB2	15	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)c(C)c1	ZINC000872243936	DE	On-Demand	Anodyne	ADRB2	15	44
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	ADRB2	46	63
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	ADRB1	63	39
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	ADRB3	27	56
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	CASR	42	40
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	CYP2D6	26	51
COCC(C)(C)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000872243949	EG	On-Demand	Anodyne	ABCB1	17	43
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	ADRB2	46	63
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	ADRB1	63	39
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	ADRB3	27	56
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	CASR	42	40
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	CYP2D6	26	51
COCC(C)(C)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872243950	EG	On-Demand	Anodyne	ABCB1	17	43
COCC(C)(C)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872243957	FF	On-Demand	Anodyne	ADRB2	51	46
COCC(C)(C)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872243957	FF	On-Demand	Anodyne	ADRB1	70	46
COCC(C)(C)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872243957	FF	On-Demand	Anodyne	ADRB3	41	47
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872243958	FF	On-Demand	Anodyne	ADRB2	51	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872243958	FF	On-Demand	Anodyne	ADRB1	70	46
COCC(C)(C)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872243958	FF	On-Demand	Anodyne	ADRB3	41	47
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cc(F)ccc1OCC(F)(F)F	ZINC000872243973	HH	On-Demand	Anodyne	MAOB	15	40
COCC(C)(C)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872243995	DF	On-Demand	Anodyne	ADRB2	26	60
COCC(C)(C)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872243995	DF	On-Demand	Anodyne	ADRB1	53	60
COCC(C)(C)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872243995	DF	On-Demand	Anodyne	ADRB3	15	60
COCC(C)(C)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872243995	DF	On-Demand	Anodyne	CYP2D6	20	47
COCC(C)(C)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872243996	DF	On-Demand	Anodyne	ADRB2	26	60
COCC(C)(C)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872243996	DF	On-Demand	Anodyne	ADRB1	53	60
COCC(C)(C)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872243996	DF	On-Demand	Anodyne	ADRB3	15	60
COCC(C)(C)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872243996	DF	On-Demand	Anodyne	CYP2D6	20	47
NC(=O)c1cc(CNC[C@H](O)COc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872244015	GF	On-Demand	Anodyne	ADRB2	26	45
NC(=O)c1cc(CNC[C@H](O)COc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872244015	GF	On-Demand	Anodyne	ADRB1	43	38
NC(=O)c1cc(CNC[C@@H](O)COc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872244016	GF	On-Demand	Anodyne	ADRB2	26	45
NC(=O)c1cc(CNC[C@@H](O)COc2ccc3ccccc3c2)n2c1CCCC2	ZINC000872244016	GF	On-Demand	Anodyne	ADRB1	43	38
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244020	FF	On-Demand	Anodyne	ADRB2	50	48
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244020	FF	On-Demand	Anodyne	ADRB1	84	48
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244020	FF	On-Demand	Anodyne	GRIN1	29	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244020	FF	On-Demand	Anodyne	ADRB3	59	48
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244020	FF	On-Demand	Anodyne	ABCB1	19	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244021	FF	On-Demand	Anodyne	ADRB2	50	48
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244021	FF	On-Demand	Anodyne	ADRB1	84	48
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244021	FF	On-Demand	Anodyne	GRIN1	29	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244021	FF	On-Demand	Anodyne	ADRB3	59	48
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244021	FF	On-Demand	Anodyne	ABCB1	19	43
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244022	EF	On-Demand	Anodyne	ADRB2	47	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244022	EF	On-Demand	Anodyne	ADRB1	78	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244022	EF	On-Demand	Anodyne	GRIN1	17	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244022	EF	On-Demand	Anodyne	ADRB3	48	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244023	EF	On-Demand	Anodyne	ADRB2	47	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244023	EF	On-Demand	Anodyne	ADRB1	78	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244023	EF	On-Demand	Anodyne	GRIN1	17	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244023	EF	On-Demand	Anodyne	ADRB3	48	42
N#Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244024	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244024	DD	On-Demand	Mild	ADRB1	65	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244025	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244025	DD	On-Demand	Mild	ADRB1	65	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244026	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244026	DD	On-Demand	Mild	ADRB1	65	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244027	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244027	DD	On-Demand	Mild	ADRB1	65	40
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(C(F)(F)F)c1	ZINC000872244032	FF	On-Demand	Anodyne	LUXR	58	48
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(C(F)(F)F)c1	ZINC000872244032	FF	On-Demand	Anodyne	TRAR	63	40
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(C(F)(F)F)c1	ZINC000872244033	FF	On-Demand	Anodyne	LUXR	58	48
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(C(F)(F)F)c1	ZINC000872244033	FF	On-Demand	Anodyne	TRAR	63	40
CSc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244037	EE	On-Demand	Anodyne	ADRB2	38	41
CSc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244037	EE	On-Demand	Anodyne	ADRB1	63	41
CSc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244037	EE	On-Demand	Anodyne	ADRB3	41	41
CSc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244038	EE	On-Demand	Anodyne	ADRB2	38	41
CSc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244038	EE	On-Demand	Anodyne	ADRB1	63	41
CSc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244038	EE	On-Demand	Anodyne	ADRB3	41	41
CSc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244039	EE	On-Demand	Anodyne	ADRB2	38	41
CSc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244039	EE	On-Demand	Anodyne	ADRB1	63	41
CSc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244039	EE	On-Demand	Anodyne	ADRB3	41	41
CSc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244040	EE	On-Demand	Anodyne	ADRB2	38	41
CSc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244040	EE	On-Demand	Anodyne	ADRB1	63	41
CSc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244040	EE	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1ccccc1	ZINC000872244052	CE	On-Demand	Anodyne	ADRB2	20	43
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1ccccc1	ZINC000872244052	CE	On-Demand	Anodyne	ADRB3	53	39
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1ccccc1	ZINC000872244053	CE	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1ccccc1	ZINC000872244053	CE	On-Demand	Anodyne	ADRB3	53	39
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244056	DE	On-Demand	Mild	ADRB2	40	41
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244056	DE	On-Demand	Mild	ADRB1	70	41
N#Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244056	DE	On-Demand	Mild	ADRB3	38	41
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244057	DE	On-Demand	Mild	ADRB2	40	41
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244057	DE	On-Demand	Mild	ADRB1	70	41
N#Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244057	DE	On-Demand	Mild	ADRB3	38	41
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244063	EE	On-Demand	Anodyne	ADRB2	35	43
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244063	EE	On-Demand	Anodyne	ADRB1	67	44
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244063	EE	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244064	EE	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244064	EE	On-Demand	Anodyne	ADRB1	67	44
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1F	ZINC000872244064	EE	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244068	EF	On-Demand	Anodyne	ADRB2	46	44
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244068	EF	On-Demand	Anodyne	ADRB1	71	44
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244068	EF	On-Demand	Anodyne	GRIN1	15	47
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244068	EF	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244069	EF	On-Demand	Anodyne	ADRB2	46	44
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244069	EF	On-Demand	Anodyne	ADRB1	71	44
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244069	EF	On-Demand	Anodyne	GRIN1	15	47
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Cl)cc1	ZINC000872244069	EF	On-Demand	Anodyne	ADRB3	46	44
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000872244076	EF	On-Demand	Anodyne	SLC16A1	41	30
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000872244077	EF	On-Demand	Anodyne	SLC16A1	41	30
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000872244078	EF	On-Demand	Anodyne	SLC16A1	41	30
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000872244079	EF	On-Demand	Anodyne	SLC16A1	41	30
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244084	EE	On-Demand	Bother	ADRB2	28	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244084	EE	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244084	EE	On-Demand	Bother	ADRB3	29	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244085	EE	On-Demand	Bother	ADRB2	28	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244085	EE	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872244085	EE	On-Demand	Bother	ADRB3	29	47
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244118	DD	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244118	DD	On-Demand	Mild	ADRB1	74	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244118	DD	On-Demand	Mild	CASR	43	44
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244118	DD	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244119	DD	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244119	DD	On-Demand	Mild	ADRB1	74	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244119	DD	On-Demand	Mild	CASR	43	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244119	DD	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244120	DD	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244120	DD	On-Demand	Mild	ADRB1	74	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244120	DD	On-Demand	Mild	CASR	43	44
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244120	DD	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244121	DD	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244121	DD	On-Demand	Mild	ADRB1	74	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244121	DD	On-Demand	Mild	CASR	43	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244121	DD	On-Demand	Mild	CYP2D6	19	44
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244128	GG	On-Demand	Anodyne	ADRB2	42	43
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244128	GG	On-Demand	Anodyne	ADRB1	65	43
O[C@@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244128	GG	On-Demand	Anodyne	ADRB3	42	43
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244129	GG	On-Demand	Anodyne	ADRB2	42	43
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244129	GG	On-Demand	Anodyne	ADRB1	65	43
O[C@H](CNCc1ncc(Cl)s1)COc1ccc(Br)cc1	ZINC000872244129	GG	On-Demand	Anodyne	ADRB3	42	43
O=C1OCC[C@H]1CCCNC[C@@H](O)CCc1ccccc1	ZINC000872244130	CD	On-Demand	Anodyne	LUXR	50	33
O=C1OCC[C@@H]1CCCNC[C@@H](O)CCc1ccccc1	ZINC000872244131	CD	On-Demand	Anodyne	LUXR	50	33
O=C1OCC[C@H]1CCCNC[C@H](O)CCc1ccccc1	ZINC000872244132	CD	On-Demand	Anodyne	LUXR	50	33
O=C1OCC[C@@H]1CCCNC[C@H](O)CCc1ccccc1	ZINC000872244133	CD	On-Demand	Anodyne	LUXR	50	33
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244146	EE	On-Demand	Anodyne	LUXR	61	37
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244146	EE	On-Demand	Anodyne	TRAR	51	32
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244146	EE	On-Demand	Anodyne	LASR	47	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244147	EE	On-Demand	Anodyne	LUXR	61	37
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244147	EE	On-Demand	Anodyne	TRAR	51	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cc(F)cc(F)c1	ZINC000872244147	EE	On-Demand	Anodyne	LASR	47	32
O=C1OCC[C@H]1CCCNC[C@H](O)COCc1ccccc1	ZINC000872244149	DD	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@H]1CCCNC[C@H](O)COCc1ccccc1	ZINC000872244149	DD	On-Demand	Anodyne	TRAR	41	38
O=C1OCC[C@@H]1CCCNC[C@H](O)COCc1ccccc1	ZINC000872244150	DD	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@@H]1CCCNC[C@H](O)COCc1ccccc1	ZINC000872244150	DD	On-Demand	Anodyne	TRAR	41	38
O=C1OCC[C@H]1CCCNC[C@@H](O)COCc1ccccc1	ZINC000872244151	DD	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@H]1CCCNC[C@@H](O)COCc1ccccc1	ZINC000872244151	DD	On-Demand	Anodyne	TRAR	41	38
O=C1OCC[C@@H]1CCCNC[C@@H](O)COCc1ccccc1	ZINC000872244152	DD	On-Demand	Anodyne	LUXR	42	33
O=C1OCC[C@@H]1CCCNC[C@@H](O)COCc1ccccc1	ZINC000872244152	DD	On-Demand	Anodyne	TRAR	41	38
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244155	CD	On-Demand	Anodyne	ADRB2	57	51
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244155	CD	On-Demand	Anodyne	ADRB1	90	48
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244155	CD	On-Demand	Anodyne	ADRB3	60	48
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244156	CD	On-Demand	Anodyne	ADRB2	57	51
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244156	CD	On-Demand	Anodyne	ADRB1	90	48
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1	ZINC000872244156	CD	On-Demand	Anodyne	ADRB3	60	48
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244157	CD	On-Demand	Anodyne	ADRB2	57	51
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244157	CD	On-Demand	Anodyne	ADRB1	90	48
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244157	CD	On-Demand	Anodyne	ADRB3	60	48
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244158	CD	On-Demand	Anodyne	ADRB2	57	51
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244158	CD	On-Demand	Anodyne	ADRB1	90	48
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1	ZINC000872244158	CD	On-Demand	Anodyne	ADRB3	60	48
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244163	DF	On-Demand	Anodyne	LUXR	61	37
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244163	DF	On-Demand	Anodyne	TRAR	52	34
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244163	DF	On-Demand	Anodyne	LASR	42	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244164	DF	On-Demand	Anodyne	LUXR	61	37
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244164	DF	On-Demand	Anodyne	TRAR	52	34
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Cl)c1	ZINC000872244164	DF	On-Demand	Anodyne	LASR	42	32
N#Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244165	FE	On-Demand	Mild	ADRB2	41	44
N#Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244165	FE	On-Demand	Mild	ADRB1	69	45
N#Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244165	FE	On-Demand	Mild	ADRB3	36	45
N#Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244166	FE	On-Demand	Mild	ADRB2	41	44
N#Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244166	FE	On-Demand	Mild	ADRB1	69	45
N#Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244166	FE	On-Demand	Mild	ADRB3	36	45
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872244171	FF	On-Demand	Anodyne	ADRB2	23	59
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872244171	FF	On-Demand	Anodyne	ADRB1	68	59
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872244172	FF	On-Demand	Anodyne	ADRB2	23	59
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1cccc2[nH]ccc12	ZINC000872244172	FF	On-Demand	Anodyne	ADRB1	68	59
O=C1OCC[C@@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244200	EG	On-Demand	Anodyne	LUXR	53	34
O=C1OCC[C@@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244200	EG	On-Demand	Anodyne	TRAR	66	37
O=C1OCC[C@@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244200	EG	On-Demand	Anodyne	LASR	41	37
O=C1OCC[C@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244201	EG	On-Demand	Anodyne	LUXR	53	34
O=C1OCC[C@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244201	EG	On-Demand	Anodyne	TRAR	66	37
O=C1OCC[C@H]1CCCNCC1(O)CCC(c2ccccc2)CC1	ZINC000872244201	EG	On-Demand	Anodyne	LASR	41	37
O[C@@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(F)c1	ZINC000872244220	DF	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(F)c1	ZINC000872244220	DF	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(F)c1	ZINC000872244221	DF	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(F)c1	ZINC000872244221	DF	On-Demand	Anodyne	ADRB3	36	42
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244232	EF	On-Demand	Anodyne	LUXR	36	48
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244232	EF	On-Demand	Anodyne	TRAR	31	48
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244233	EF	On-Demand	Anodyne	LUXR	36	48
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244233	EF	On-Demand	Anodyne	TRAR	31	48
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244234	EF	On-Demand	Anodyne	LUXR	36	48
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244234	EF	On-Demand	Anodyne	TRAR	31	48
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244235	EF	On-Demand	Anodyne	LUXR	36	48
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000872244235	EF	On-Demand	Anodyne	TRAR	31	48
CSc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244236	EG	On-Demand	Anodyne	ADRB2	43	40
CSc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244236	EG	On-Demand	Anodyne	ADRB1	64	40
CSc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244236	EG	On-Demand	Anodyne	ADRB3	41	40
CSc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244237	EG	On-Demand	Anodyne	ADRB2	43	40
CSc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244237	EG	On-Demand	Anodyne	ADRB1	64	40
CSc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244237	EG	On-Demand	Anodyne	ADRB3	41	40
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244240	FF	On-Demand	Anodyne	LUXR	60	45
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244240	FF	On-Demand	Anodyne	TRAR	54	37
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244240	FF	On-Demand	Anodyne	LASR	43	37
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244241	FF	On-Demand	Anodyne	LUXR	60	45
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244241	FF	On-Demand	Anodyne	TRAR	54	37
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(Br)c1	ZINC000872244241	FF	On-Demand	Anodyne	LASR	43	37
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872244242	EF	On-Demand	Anodyne	LUXR	30	42
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872244243	EF	On-Demand	Anodyne	LUXR	30	42
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000872244244	EF	On-Demand	Anodyne	LUXR	30	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000872244245	EF	On-Demand	Anodyne	LUXR	30	42
O=C1CCc2cc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)ccc2N1	ZINC000872244247	GE	On-Demand	Anodyne	ADRB1	41	39
O=C1CCc2cc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)ccc2N1	ZINC000872244248	GE	On-Demand	Anodyne	ADRB1	41	39
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872244265	EF	On-Demand	Anodyne	CXCR4	62	36
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872244265	EF	On-Demand	Anodyne	LUXR	47	48
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872244266	EF	On-Demand	Anodyne	CXCR4	62	36
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872244266	EF	On-Demand	Anodyne	LUXR	47	48
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872244267	EF	On-Demand	Anodyne	CXCR4	62	36
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872244267	EF	On-Demand	Anodyne	LUXR	47	48
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872244268	EF	On-Demand	Anodyne	CXCR4	62	36
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872244268	EF	On-Demand	Anodyne	LUXR	47	48
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244272	DE	On-Demand	Mild	ADRB2	26	55
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244272	DE	On-Demand	Mild	ADRB1	76	54
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244272	DE	On-Demand	Mild	CASR	42	44
N#Cc1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244272	DE	On-Demand	Mild	CYP2D6	19	45
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244273	DE	On-Demand	Mild	ADRB2	26	55
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244273	DE	On-Demand	Mild	ADRB1	76	54
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244273	DE	On-Demand	Mild	CASR	42	44
N#Cc1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244273	DE	On-Demand	Mild	CYP2D6	19	45
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244280	FF	On-Demand	Anodyne	ADRB1	63	40
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244280	FF	On-Demand	Anodyne	GRIN1	28	49
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244280	FF	On-Demand	Anodyne	ADRB3	42	41
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244281	FF	On-Demand	Anodyne	ADRB1	63	40
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244281	FF	On-Demand	Anodyne	GRIN1	28	49
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244281	FF	On-Demand	Anodyne	ADRB3	42	41
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244282	FF	On-Demand	Anodyne	ADRB1	63	40
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244282	FF	On-Demand	Anodyne	GRIN1	28	49
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244282	FF	On-Demand	Anodyne	ADRB3	42	41
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244283	FF	On-Demand	Anodyne	ADRB1	63	40
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244283	FF	On-Demand	Anodyne	GRIN1	28	49
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872244283	FF	On-Demand	Anodyne	ADRB3	42	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244294	FF	On-Demand	Anodyne	LUXR	66	37
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244294	FF	On-Demand	Anodyne	TRAR	73	44
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244294	FF	On-Demand	Anodyne	LASR	49	44
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244295	FF	On-Demand	Anodyne	LUXR	66	37
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244295	FF	On-Demand	Anodyne	TRAR	73	44
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Br)cc1	ZINC000872244295	FF	On-Demand	Anodyne	LASR	49	44
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244309	EF	On-Demand	Anodyne	ADRB2	48	48
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244309	EF	On-Demand	Anodyne	ADRB1	75	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244309	EF	On-Demand	Anodyne	ADRB3	51	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244310	EF	On-Demand	Anodyne	ADRB2	48	48
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244310	EF	On-Demand	Anodyne	ADRB1	75	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244310	EF	On-Demand	Anodyne	ADRB3	51	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244311	EF	On-Demand	Anodyne	ADRB2	48	48
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244311	EF	On-Demand	Anodyne	ADRB1	75	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872244311	EF	On-Demand	Anodyne	ADRB3	51	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244312	EF	On-Demand	Anodyne	ADRB2	48	48
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244312	EF	On-Demand	Anodyne	ADRB1	75	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872244312	EF	On-Demand	Anodyne	ADRB3	51	42
Cc1c(F)cccc1NC(=O)CCNCCC[C@@H]1CCOC1=O	ZINC000872244317	DE	On-Demand	Anodyne	LUXR	51	35
Cc1c(F)cccc1NC(=O)CCNCCC[C@@H]1CCOC1=O	ZINC000872244317	DE	On-Demand	Anodyne	TRAR	55	31
Cc1c(F)cccc1NC(=O)CCNCCC[C@@H]1CCOC1=O	ZINC000872244317	DE	On-Demand	Anodyne	LASR	42	31
Cc1c(F)cccc1NC(=O)CCNCCC[C@H]1CCOC1=O	ZINC000872244318	DE	On-Demand	Anodyne	LUXR	51	35
Cc1c(F)cccc1NC(=O)CCNCCC[C@H]1CCOC1=O	ZINC000872244318	DE	On-Demand	Anodyne	TRAR	55	31
Cc1c(F)cccc1NC(=O)CCNCCC[C@H]1CCOC1=O	ZINC000872244318	DE	On-Demand	Anodyne	LASR	42	31
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244339	EE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244339	EE	On-Demand	Anodyne	ADRB1	70	49
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244339	EE	On-Demand	Anodyne	ADRB3	44	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244339	EE	On-Demand	Anodyne	TRAR	30	46
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244340	EE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244340	EE	On-Demand	Anodyne	ADRB1	70	49
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244340	EE	On-Demand	Anodyne	ADRB3	44	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244340	EE	On-Demand	Anodyne	TRAR	30	46
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244341	EE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244341	EE	On-Demand	Anodyne	ADRB1	70	49
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244341	EE	On-Demand	Anodyne	ADRB3	44	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872244341	EE	On-Demand	Anodyne	TRAR	30	46
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244342	EE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244342	EE	On-Demand	Anodyne	ADRB1	70	49
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244342	EE	On-Demand	Anodyne	ADRB3	44	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872244342	EE	On-Demand	Anodyne	TRAR	30	46
CCOc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244345	EF	On-Demand	Anodyne	ADRB2	51	43
CCOc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244345	EF	On-Demand	Anodyne	ADRB1	71	43
CCOc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244345	EF	On-Demand	Anodyne	GRIN1	18	42
CCOc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244345	EF	On-Demand	Anodyne	ADRB3	46	42
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244346	EF	On-Demand	Anodyne	ADRB2	51	43
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244346	EF	On-Demand	Anodyne	ADRB1	71	43
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244346	EF	On-Demand	Anodyne	GRIN1	18	42
CCOc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244346	EF	On-Demand	Anodyne	ADRB3	46	42
CON(C)C(=O)CCNCCC[C@H]1CCOC1=O	ZINC000872244353	CC	On-Demand	Anodyne	LASR	40	34
CON(C)C(=O)CCNCCC[C@@H]1CCOC1=O	ZINC000872244354	CC	On-Demand	Anodyne	LASR	40	34
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244368	FD	On-Demand	Anodyne	ADRB2	45	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244368	FD	On-Demand	Anodyne	ADRB1	86	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244368	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244368	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244369	FD	On-Demand	Anodyne	ADRB2	45	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244369	FD	On-Demand	Anodyne	ADRB1	86	54
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244369	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244369	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244370	FD	On-Demand	Anodyne	ADRB2	45	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244370	FD	On-Demand	Anodyne	ADRB1	86	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244370	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244370	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244371	FD	On-Demand	Anodyne	ADRB2	45	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244371	FD	On-Demand	Anodyne	ADRB1	86	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244371	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244371	FD	On-Demand	Anodyne	ADRB3	54	54
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244374	EF	On-Demand	Anodyne	LUXR	17	44
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244374	EF	On-Demand	Anodyne	TRAR	20	44
O=C1OCC[C@@H]1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244375	EF	On-Demand	Anodyne	LUXR	17	44
O=C1OCC[C@@H]1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244375	EF	On-Demand	Anodyne	TRAR	20	44
O=C1OCC[C@H]1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244376	EF	On-Demand	Anodyne	LUXR	17	44
O=C1OCC[C@H]1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244376	EF	On-Demand	Anodyne	TRAR	20	44
O=C1OCC[C@H]1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244377	EF	On-Demand	Anodyne	LUXR	17	44
O=C1OCC[C@H]1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000872244377	EF	On-Demand	Anodyne	TRAR	20	44
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244382	EF	On-Demand	Anodyne	ADRB2	38	54
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244382	EF	On-Demand	Anodyne	ADRB1	63	47
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244382	EF	On-Demand	Anodyne	ADRB3	26	47
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244382	EF	On-Demand	Anodyne	ABCB1	16	41
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244383	EF	On-Demand	Anodyne	ADRB2	38	54
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244383	EF	On-Demand	Anodyne	ADRB1	63	47
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244383	EF	On-Demand	Anodyne	ADRB3	26	47
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000872244383	EF	On-Demand	Anodyne	ABCB1	16	41
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244384	EF	On-Demand	Anodyne	ADRB2	38	54
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244384	EF	On-Demand	Anodyne	ADRB1	63	47
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244384	EF	On-Demand	Anodyne	ADRB3	26	47
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244384	EF	On-Demand	Anodyne	ABCB1	16	41
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244385	EF	On-Demand	Anodyne	ADRB2	38	54
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244385	EF	On-Demand	Anodyne	ADRB1	63	47
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244385	EF	On-Demand	Anodyne	ADRB3	26	47
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000872244385	EF	On-Demand	Anodyne	ABCB1	16	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244390	DE	On-Demand	Anodyne	LUXR	64	36
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244390	DE	On-Demand	Anodyne	TRAR	51	32
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244390	DE	On-Demand	Anodyne	LASR	42	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244391	DE	On-Demand	Anodyne	LUXR	64	36
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244391	DE	On-Demand	Anodyne	TRAR	51	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccc(F)c1	ZINC000872244391	DE	On-Demand	Anodyne	LASR	42	32
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872244414	FE	On-Demand	Anodyne	ADRB2	23	40
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872244414	FE	On-Demand	Anodyne	ADRB1	54	35
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872244415	FE	On-Demand	Anodyne	ADRB2	23	40
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872244415	FE	On-Demand	Anodyne	ADRB1	54	35
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872244416	FE	On-Demand	Anodyne	ADRB2	23	40
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872244416	FE	On-Demand	Anodyne	ADRB1	54	35
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872244417	FE	On-Demand	Anodyne	ADRB2	23	40
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872244417	FE	On-Demand	Anodyne	ADRB1	54	35
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244433	DD	On-Demand	Anodyne	ADRB2	43	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244433	DD	On-Demand	Anodyne	ADRB1	76	49
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244433	DD	On-Demand	Anodyne	ADRB3	47	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244434	DD	On-Demand	Anodyne	ADRB2	43	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244434	DD	On-Demand	Anodyne	ADRB1	76	49
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244434	DD	On-Demand	Anodyne	ADRB3	47	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244435	DD	On-Demand	Anodyne	ADRB2	43	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244435	DD	On-Demand	Anodyne	ADRB1	76	49
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000872244435	DD	On-Demand	Anodyne	ADRB3	47	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244436	DD	On-Demand	Anodyne	ADRB2	43	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244436	DD	On-Demand	Anodyne	ADRB1	76	49
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000872244436	DD	On-Demand	Anodyne	ADRB3	47	42
CC[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244453	BC	On-Demand	Anodyne	LASR	42	38
CC[C@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244454	BC	On-Demand	Anodyne	LASR	42	38
CC[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244455	BC	On-Demand	Anodyne	LASR	42	38
CC[C@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244456	BC	On-Demand	Anodyne	LASR	42	38
Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244461	DF	On-Demand	Anodyne	ADRB2	52	51
Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244461	DF	On-Demand	Anodyne	ADRB1	73	43
Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244461	DF	On-Demand	Anodyne	GRIN1	17	41
Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244461	DF	On-Demand	Anodyne	ADRB3	48	43
Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244462	DF	On-Demand	Anodyne	ADRB2	52	51
Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244462	DF	On-Demand	Anodyne	ADRB1	73	43
Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244462	DF	On-Demand	Anodyne	GRIN1	17	41
Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244462	DF	On-Demand	Anodyne	ADRB3	48	43
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244465	EE	On-Demand	Mild	ADRB2	43	44
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244465	EE	On-Demand	Mild	ADRB1	73	44
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244465	EE	On-Demand	Mild	GRIN1	16	40
N#CCc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244465	EE	On-Demand	Mild	ADRB3	46	44
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244466	EE	On-Demand	Mild	ADRB2	43	44
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244466	EE	On-Demand	Mild	ADRB1	73	44
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244466	EE	On-Demand	Mild	GRIN1	16	40
N#CCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244466	EE	On-Demand	Mild	ADRB3	46	44
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244470	ED	On-Demand	Anodyne	ADRB2	20	57
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244470	ED	On-Demand	Anodyne	ADRB1	47	52
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244470	ED	On-Demand	Anodyne	HTR1A	15	57
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244470	ED	On-Demand	Anodyne	SLC6A4	16	41
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244470	ED	On-Demand	Anodyne	ADRB3	15	52
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244471	ED	On-Demand	Anodyne	ADRB2	20	57
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244471	ED	On-Demand	Anodyne	ADRB1	47	52
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244471	ED	On-Demand	Anodyne	HTR1A	15	57
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244471	ED	On-Demand	Anodyne	SLC6A4	16	41
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872244471	ED	On-Demand	Anodyne	ADRB3	15	52
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244472	ED	On-Demand	Anodyne	ADRB2	20	57
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244472	ED	On-Demand	Anodyne	ADRB1	47	52
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244472	ED	On-Demand	Anodyne	HTR1A	15	57
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244472	ED	On-Demand	Anodyne	SLC6A4	16	41
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244472	ED	On-Demand	Anodyne	ADRB3	15	52
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244473	ED	On-Demand	Anodyne	ADRB2	20	57
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244473	ED	On-Demand	Anodyne	ADRB1	47	52
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244473	ED	On-Demand	Anodyne	HTR1A	15	57
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244473	ED	On-Demand	Anodyne	SLC6A4	16	41
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872244473	ED	On-Demand	Anodyne	ADRB3	15	52
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000872244485	EE	On-Demand	Anodyne	ADRB2	32	52
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000872244485	EE	On-Demand	Anodyne	ADRB1	58	41
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000872244486	EE	On-Demand	Anodyne	ADRB2	32	52
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000872244486	EE	On-Demand	Anodyne	ADRB1	58	41
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000872244487	EE	On-Demand	Anodyne	ADRB2	32	52
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000872244487	EE	On-Demand	Anodyne	ADRB1	58	41
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000872244488	EE	On-Demand	Anodyne	ADRB2	32	52
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000872244488	EE	On-Demand	Anodyne	ADRB1	58	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ncc(Cl)s2)CC1	ZINC000872244504	GF	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ncc(Cl)s2)CC1	ZINC000872244505	GF	On-Demand	Anodyne	GPR119	50	44
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccnc1	ZINC000872244518	CD	On-Demand	Anodyne	LUXR	56	31
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccnc1	ZINC000872244518	CD	On-Demand	Anodyne	TRAR	45	31
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1cccnc1	ZINC000872244518	CD	On-Demand	Anodyne	LASR	41	31
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccnc1	ZINC000872244519	CD	On-Demand	Anodyne	LUXR	56	31
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccnc1	ZINC000872244519	CD	On-Demand	Anodyne	TRAR	45	31
O=C(CCNCCC[C@H]1CCOC1=O)Nc1cccnc1	ZINC000872244519	CD	On-Demand	Anodyne	LASR	41	31
Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244539	DD	On-Demand	Anodyne	ADRB2	47	45
Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244539	DD	On-Demand	Anodyne	ADRB1	72	49
Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244539	DD	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244540	DD	On-Demand	Anodyne	ADRB2	47	45
Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244540	DD	On-Demand	Anodyne	ADRB1	72	49
Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244540	DD	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244541	DD	On-Demand	Anodyne	ADRB2	47	45
Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244541	DD	On-Demand	Anodyne	ADRB1	72	49
Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244541	DD	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244542	DD	On-Demand	Anodyne	ADRB2	47	45
Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244542	DD	On-Demand	Anodyne	ADRB1	72	49
Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244542	DD	On-Demand	Anodyne	ADRB3	45	43
O[C@@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244550	EG	On-Demand	Anodyne	ADRB2	45	40
O[C@@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244550	EG	On-Demand	Anodyne	ADRB1	58	50
O[C@@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244550	EG	On-Demand	Anodyne	ADRB3	67	50
O[C@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244551	EG	On-Demand	Anodyne	ADRB2	45	40
O[C@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244551	EG	On-Demand	Anodyne	ADRB1	58	50
O[C@H](CNCCOC(F)(F)C(F)(F)F)c1cccc(Cl)c1	ZINC000872244551	EG	On-Demand	Anodyne	ADRB3	67	50
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244560	FE	On-Demand	Anodyne	ADRB1	43	47
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244560	FE	On-Demand	Anodyne	PDS	44	38
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244561	FE	On-Demand	Anodyne	ADRB1	43	47
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244561	FE	On-Demand	Anodyne	PDS	44	38
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244562	FE	On-Demand	Anodyne	ADRB1	43	47
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244562	FE	On-Demand	Anodyne	PDS	44	38
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244563	FE	On-Demand	Anodyne	ADRB1	43	47
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872244563	FE	On-Demand	Anodyne	PDS	44	38
Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244564	EE	On-Demand	Anodyne	ADRB2	54	52
Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244564	EE	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244564	EE	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244565	EE	On-Demand	Anodyne	ADRB2	54	52
Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244565	EE	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F)cc1	ZINC000872244565	EE	On-Demand	Anodyne	ADRB3	49	47
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244612	CE	On-Demand	Anodyne	ADRB2	46	39
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244612	CE	On-Demand	Anodyne	ADRB1	51	45
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244612	CE	On-Demand	Anodyne	ADRB3	59	46
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244612	CE	On-Demand	Anodyne	CYP3A4	48	36
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244613	CE	On-Demand	Anodyne	ADRB2	46	39
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244613	CE	On-Demand	Anodyne	ADRB1	51	45
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244613	CE	On-Demand	Anodyne	ADRB3	59	46
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244613	CE	On-Demand	Anodyne	CYP3A4	48	36
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244614	CE	On-Demand	Anodyne	ADRB2	46	39
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244614	CE	On-Demand	Anodyne	ADRB1	51	45
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244614	CE	On-Demand	Anodyne	ADRB3	59	46
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000872244614	CE	On-Demand	Anodyne	CYP3A4	48	36
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244615	CE	On-Demand	Anodyne	ADRB2	46	39
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244615	CE	On-Demand	Anodyne	ADRB1	51	45
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244615	CE	On-Demand	Anodyne	ADRB3	59	46
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000872244615	CE	On-Demand	Anodyne	CYP3A4	48	36
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872244618	EF	On-Demand	Anodyne	TRAR	44	46
O=C1OCC[C@@H]1CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872244619	EF	On-Demand	Anodyne	TRAR	44	46
O=C1OCC[C@H]1CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872244620	EF	On-Demand	Anodyne	TRAR	44	46
O=C1OCC[C@H]1CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000872244621	EF	On-Demand	Anodyne	TRAR	44	46
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1C(F)(F)F	ZINC000872244632	FG	On-Demand	Anodyne	ADRB2	26	40
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1C(F)(F)F	ZINC000872244632	FG	On-Demand	Anodyne	ADRB1	58	36
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1C(F)(F)F	ZINC000872244633	FG	On-Demand	Anodyne	ADRB2	26	40
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1C(F)(F)F	ZINC000872244633	FG	On-Demand	Anodyne	ADRB1	58	36
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244655	ED	On-Demand	Anodyne	ADRB2	33	43
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244655	ED	On-Demand	Anodyne	ADRB1	66	41
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244655	ED	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244655	ED	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244656	ED	On-Demand	Anodyne	ADRB2	33	43
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244656	ED	On-Demand	Anodyne	ADRB1	66	41
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244656	ED	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244656	ED	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244657	ED	On-Demand	Anodyne	ADRB2	33	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244657	ED	On-Demand	Anodyne	ADRB1	66	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244657	ED	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)c1	ZINC000872244657	ED	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244658	ED	On-Demand	Anodyne	ADRB2	33	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244658	ED	On-Demand	Anodyne	ADRB1	66	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244658	ED	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)c1	ZINC000872244658	ED	On-Demand	Anodyne	ABCB1	16	43
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc(Br)c1	ZINC000872244667	GG	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc(Br)c1	ZINC000872244667	GG	On-Demand	Anodyne	ADRB1	44	39
O[C@H](CNCc1ncc(Cl)s1)COc1cccc(Br)c1	ZINC000872244668	GG	On-Demand	Anodyne	ADRB2	35	43
O[C@H](CNCc1ncc(Cl)s1)COc1cccc(Br)c1	ZINC000872244668	GG	On-Demand	Anodyne	ADRB1	44	39
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244670	GH	On-Demand	Anodyne	LTA4H	48	44
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244670	GH	On-Demand	Anodyne	LUXR	52	34
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244670	GH	On-Demand	Anodyne	TRAR	73	34
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244670	GH	On-Demand	Anodyne	LASR	41	34
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244671	GH	On-Demand	Anodyne	LTA4H	48	44
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244671	GH	On-Demand	Anodyne	LUXR	52	34
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244671	GH	On-Demand	Anodyne	TRAR	73	34
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000872244671	GH	On-Demand	Anodyne	LASR	41	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC[C@@H]2CCOC2=O)CC1	ZINC000872244672	FD	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC[C@H]2CCOC2=O)CC1	ZINC000872244673	FD	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC[C@@H]2CCOC2=O)CC1	ZINC000872244674	FD	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC[C@H]2CCOC2=O)CC1	ZINC000872244675	FD	On-Demand	Anodyne	GPR119	26	44
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000872244705	EE	On-Demand	Anodyne	TRAR	19	41
O=C1OCC[C@@H]1CCCNC[C@H](O)c1ccc(Br)cc1	ZINC000872244706	EE	On-Demand	Anodyne	TRAR	19	41
O=C1OCC[C@H]1CCCNC[C@H](O)c1ccc(Br)cc1	ZINC000872244707	EE	On-Demand	Anodyne	TRAR	19	41
O=C1OCC[C@H]1CCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000872244708	EE	On-Demand	Anodyne	TRAR	19	41
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244709	ED	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244709	ED	On-Demand	Mild	ADRB1	73	42
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244709	ED	On-Demand	Mild	ADRB3	47	42
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244710	ED	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244710	ED	On-Demand	Mild	ADRB1	73	42
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244710	ED	On-Demand	Mild	ADRB3	47	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244711	ED	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244711	ED	On-Demand	Mild	ADRB1	73	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244711	ED	On-Demand	Mild	ADRB3	47	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244712	ED	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244712	ED	On-Demand	Mild	ADRB1	73	42
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244712	ED	On-Demand	Mild	ADRB3	47	42
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244724	DE	On-Demand	Anodyne	ADRB2	30	41
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244724	DE	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244724	DE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244725	DE	On-Demand	Anodyne	ADRB2	30	41
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244725	DE	On-Demand	Anodyne	ADRB1	58	40
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1F	ZINC000872244725	DE	On-Demand	Anodyne	ADRB3	19	40
Cc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)c(C)c1	ZINC000872244728	EF	On-Demand	Anodyne	ADRB2	19	44
Cc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c(C)c1	ZINC000872244729	EF	On-Demand	Anodyne	ADRB2	19	44
O[C@@H](CNCCOC(F)(F)C(F)(F)F)CN1CCc2ccccc2C1	ZINC000872244733	FE	On-Demand	Anodyne	NOD2	40	36
O[C@H](CNCCOC(F)(F)C(F)(F)F)CN1CCc2ccccc2C1	ZINC000872244734	FE	On-Demand	Anodyne	NOD2	40	36
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872244735	FE	On-Demand	Anodyne	ADRB2	30	40
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872244735	FE	On-Demand	Anodyne	ADRB1	52	45
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000872244736	FE	On-Demand	Anodyne	ADRB2	30	40
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000872244736	FE	On-Demand	Anodyne	ADRB1	52	45
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000872244737	FE	On-Demand	Anodyne	ADRB2	30	40
O=C1OCC[C@H]1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000872244737	FE	On-Demand	Anodyne	ADRB1	52	45
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872244738	FE	On-Demand	Anodyne	ADRB2	30	40
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000872244738	FE	On-Demand	Anodyne	ADRB1	52	45
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244760	FG	On-Demand	Anodyne	ADRB2	56	45
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244760	FG	On-Demand	Anodyne	ADRB1	86	45
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244760	FG	On-Demand	Anodyne	ADRB3	62	45
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244761	FG	On-Demand	Anodyne	ADRB2	56	45
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244761	FG	On-Demand	Anodyne	ADRB1	86	45
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244761	FG	On-Demand	Anodyne	ADRB3	62	45
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244762	FG	On-Demand	Anodyne	ADRB2	56	45
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244762	FG	On-Demand	Anodyne	ADRB1	86	45
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244762	FG	On-Demand	Anodyne	ADRB3	62	45
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244763	FG	On-Demand	Anodyne	ADRB2	56	45
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244763	FG	On-Demand	Anodyne	ADRB1	86	45
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872244763	FG	On-Demand	Anodyne	ADRB3	62	45
CC(C)(C)[C@@H](O)CNCCC[C@@H]1CCOC1=O	ZINC000872244767	BD	On-Demand	Anodyne	LASR	41	35
CC(C)(C)[C@@H](O)CNCCC[C@H]1CCOC1=O	ZINC000872244768	BD	On-Demand	Anodyne	LASR	41	35
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872244770	IJ	On-Demand	Bother	TAAR1	26	48
O=C(CCNCc1ncc(Cl)s1)Nc1cccnc1	ZINC000872244771	CE	On-Demand	Anodyne	NAMPT	25	40
Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)c(C)c1	ZINC000872244772	DD	On-Demand	Anodyne	ADRB2	17	42
Cc1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)c(C)c1	ZINC000872244773	DD	On-Demand	Anodyne	ADRB2	17	42
Cc1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)c(C)c1	ZINC000872244774	DD	On-Demand	Anodyne	ADRB2	17	42
Cc1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)c(C)c1	ZINC000872244775	DD	On-Demand	Anodyne	ADRB2	17	42
CN(C)c1ccc(NC(=O)CCNCCC[C@H]2CCOC2=O)cc1	ZINC000872244776	EE	On-Demand	Anodyne	LUXR	46	33
CN(C)c1ccc(NC(=O)CCNCCC[C@H]2CCOC2=O)cc1	ZINC000872244776	EE	On-Demand	Anodyne	TRAR	56	33
CN(C)c1ccc(NC(=O)CCNCCC[C@H]2CCOC2=O)cc1	ZINC000872244776	EE	On-Demand	Anodyne	LASR	43	33
CN(C)c1ccc(NC(=O)CCNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244777	EE	On-Demand	Anodyne	LUXR	46	33
CN(C)c1ccc(NC(=O)CCNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244777	EE	On-Demand	Anodyne	TRAR	56	33
CN(C)c1ccc(NC(=O)CCNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244777	EE	On-Demand	Anodyne	LASR	43	33
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244786	DE	On-Demand	Anodyne	LUXR	63	38
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244786	DE	On-Demand	Anodyne	TRAR	68	34
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244786	DE	On-Demand	Anodyne	LASR	43	34
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244787	DE	On-Demand	Anodyne	LUXR	63	38
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244787	DE	On-Demand	Anodyne	TRAR	68	34
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1F	ZINC000872244787	DE	On-Demand	Anodyne	LASR	43	34
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244824	EE	On-Demand	Anodyne	ADRB2	67	55
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244824	EE	On-Demand	Anodyne	ADRB1	101	58
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244824	EE	On-Demand	Anodyne	ADRB3	64	58
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244825	EE	On-Demand	Anodyne	ADRB2	67	55
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244825	EE	On-Demand	Anodyne	ADRB1	101	58
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccccc1	ZINC000872244825	EE	On-Demand	Anodyne	ADRB3	64	58
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244835	EE	On-Demand	Anodyne	ADRB2	51	47
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244835	EE	On-Demand	Anodyne	ADRB1	81	48
O[C@@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244835	EE	On-Demand	Anodyne	ADRB3	46	48
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244836	EE	On-Demand	Anodyne	ADRB2	51	47
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244836	EE	On-Demand	Anodyne	ADRB1	81	48
O[C@H](CNCCOC(F)(F)C(F)(F)F)COc1ccc(F)cc1	ZINC000872244836	EE	On-Demand	Anodyne	ADRB3	46	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244845	FE	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244845	FE	On-Demand	Anodyne	ADRB1	91	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244845	FE	On-Demand	Anodyne	GRIN1	29	46
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244845	FE	On-Demand	Anodyne	ADRB3	58	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244846	FE	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244846	FE	On-Demand	Anodyne	ADRB1	91	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244846	FE	On-Demand	Anodyne	GRIN1	29	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244846	FE	On-Demand	Anodyne	ADRB3	58	56
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244865	ED	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244865	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244865	ED	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244866	ED	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244866	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244866	ED	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244867	ED	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244867	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2CCOC2=O)cc1	ZINC000872244867	ED	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244868	ED	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244868	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2CCOC2=O)cc1	ZINC000872244868	ED	On-Demand	Anodyne	ADRB3	42	41
O=C1OCC[C@H]1CCCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000872244877	EE	On-Demand	Anodyne	LUXR	37	40
O=C1OCC[C@@H]1CCCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000872244878	EE	On-Demand	Anodyne	LUXR	37	40
O=C1OCC[C@@H]1CCCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000872244879	EE	On-Demand	Anodyne	LUXR	37	40
O=C1OCC[C@H]1CCCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000872244880	EE	On-Demand	Anodyne	LUXR	37	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244881	EE	On-Demand	Bother	ADRB2	25	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ncc(Cl)s1	ZINC000872244881	EE	On-Demand	Bother	ADRB1	53	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244882	EE	On-Demand	Bother	ADRB2	25	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ncc(Cl)s1	ZINC000872244882	EE	On-Demand	Bother	ADRB1	53	38
C#CCNC(=O)CCNCCC[C@@H]1CCOC1=O	ZINC000872244891	CC	On-Demand	Mild	LASR	47	36
C#CCNC(=O)CCNCCC[C@H]1CCOC1=O	ZINC000872244892	CC	On-Demand	Mild	LASR	47	36
COC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244899	FE	On-Demand	Anodyne	ADRB2	52	47
COC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244899	FE	On-Demand	Anodyne	ADRB1	83	47
COC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244899	FE	On-Demand	Anodyne	GRIN1	18	42
COC(=O)c1ccc(OC[C@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244899	FE	On-Demand	Anodyne	ADRB3	54	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244900	FE	On-Demand	Anodyne	ADRB2	52	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244900	FE	On-Demand	Anodyne	ADRB1	83	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244900	FE	On-Demand	Anodyne	GRIN1	18	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2ncc(Cl)s2)cc1	ZINC000872244900	FE	On-Demand	Anodyne	ADRB3	54	47
O=C1OCC[C@@H]1CCCNCC1(O)CCC1	ZINC000872244901	BC	On-Demand	Anodyne	LASR	47	33
O=C1OCC[C@H]1CCCNCC1(O)CCC1	ZINC000872244902	BC	On-Demand	Anodyne	LASR	47	33
C[C@@H](OC[C@@H](O)CNCc1ncc(Cl)s1)c1ccc(Cl)cc1	ZINC000872244906	FH	On-Demand	Anodyne	FFAR2	23	42
C[C@@H](OC[C@H](O)CNCc1ncc(Cl)s1)c1ccc(Cl)cc1	ZINC000872244907	FH	On-Demand	Anodyne	FFAR2	23	42
O=C(CCNCCOC(F)(F)C(F)(F)F)Nc1ccccc1	ZINC000872244908	EF	On-Demand	Anodyne	HDAC10	17	42
O=C(CCNCCOC(F)(F)C(F)(F)F)Nc1ccccc1	ZINC000872244908	EF	On-Demand	Anodyne	HDAC3	16	42
O=C(CCNCCOC(F)(F)C(F)(F)F)Nc1ccccc1	ZINC000872244908	EF	On-Demand	Anodyne	HDAC6	15	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCC[C@@H]2CCOC2=O)CC1	ZINC000872244934	FE	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCC[C@@H]2CCOC2=O)CC1	ZINC000872244935	FE	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCC[C@H]2CCOC2=O)CC1	ZINC000872244936	FE	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCC[C@H]2CCOC2=O)CC1	ZINC000872244937	FE	On-Demand	Anodyne	GPR119	18	42
CN(C[C@@H](O)CNCCC[C@H]1CCOC1=O)C1CC1	ZINC000872244952	CC	On-Demand	Anodyne	TRAR	45	32
CN(C[C@H](O)CNCCC[C@@H]1CCOC1=O)C1CC1	ZINC000872244953	CC	On-Demand	Anodyne	TRAR	45	32
CN(C[C@H](O)CNCCC[C@H]1CCOC1=O)C1CC1	ZINC000872244954	CC	On-Demand	Anodyne	TRAR	45	32
CN(C[C@@H](O)CNCCC[C@@H]1CCOC1=O)C1CC1	ZINC000872244955	CC	On-Demand	Anodyne	TRAR	45	32
CSc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872244971	EG	On-Demand	Anodyne	ADRB2	33	42
CSc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872244971	EG	On-Demand	Anodyne	ADRB1	44	41
CSc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872244972	EG	On-Demand	Anodyne	ADRB2	33	42
CSc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872244972	EG	On-Demand	Anodyne	ADRB1	44	41
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1F	ZINC000872244987	DD	On-Demand	Anodyne	ADRB2	28	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccccc1F	ZINC000872244987	DD	On-Demand	Anodyne	ADRB1	55	41
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1F	ZINC000872244988	DD	On-Demand	Anodyne	ADRB2	28	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccccc1F	ZINC000872244988	DD	On-Demand	Anodyne	ADRB1	55	41
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1F	ZINC000872244989	DD	On-Demand	Anodyne	ADRB2	28	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccccc1F	ZINC000872244989	DD	On-Demand	Anodyne	ADRB1	55	41
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1F	ZINC000872244990	DD	On-Demand	Anodyne	ADRB2	28	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccccc1F	ZINC000872244990	DD	On-Demand	Anodyne	ADRB1	55	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244991	DF	On-Demand	Anodyne	LUXR	64	44
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244991	DF	On-Demand	Anodyne	TRAR	69	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244991	DF	On-Demand	Anodyne	LASR	47	32
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244992	DF	On-Demand	Anodyne	LUXR	64	44
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244992	DF	On-Demand	Anodyne	TRAR	69	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccc(Cl)cc1	ZINC000872244992	DF	On-Demand	Anodyne	LASR	47	32
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	HDAC10	23	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	HDAC2	17	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	HDAC3	15	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	HDAC6	15	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	HDAC11	26	41
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	LUXR	65	36
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	TRAR	76	39
O=C(CCNCCC[C@@H]1CCOC1=O)Nc1ccccc1	ZINC000872245019	CD	On-Demand	Anodyne	LASR	55	39
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	HDAC10	23	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	HDAC2	17	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	HDAC3	15	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	HDAC6	15	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	HDAC11	26	41
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	LUXR	65	36
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	TRAR	76	39
O=C(CCNCCC[C@H]1CCOC1=O)Nc1ccccc1	ZINC000872245020	CD	On-Demand	Anodyne	LASR	55	39
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	ADRB2	54	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	ADRB1	91	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	GRIN1	27	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	ADRB3	60	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245023	GG	On-Demand	Anodyne	PDS	59	33
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	ADRB2	54	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	ADRB1	91	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	GRIN1	27	46
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	ADRB3	60	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(OC(C)(C)C)c2)cc1	ZINC000872245024	GG	On-Demand	Anodyne	PDS	59	33
O=C1OCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000872245047	CD	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000872245048	CD	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000872245049	CD	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000872245050	CD	On-Demand	Anodyne	LUXR	47	34
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245059	FE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245059	FE	On-Demand	Anodyne	ADRB1	64	49
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245059	FE	On-Demand	Anodyne	ADRB3	42	42
O=C1OCC[C@@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245059	FE	On-Demand	Anodyne	TRAR	43	46
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245060	FE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245060	FE	On-Demand	Anodyne	ADRB1	64	49
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245060	FE	On-Demand	Anodyne	ADRB3	42	42
O=C1OCC[C@@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245060	FE	On-Demand	Anodyne	TRAR	43	46
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245061	FE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245061	FE	On-Demand	Anodyne	ADRB1	64	49
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245061	FE	On-Demand	Anodyne	ADRB3	42	42
O=C1OCC[C@H]1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000872245061	FE	On-Demand	Anodyne	TRAR	43	46
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245062	FE	On-Demand	Anodyne	ADRB2	37	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245062	FE	On-Demand	Anodyne	ADRB1	64	49
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245062	FE	On-Demand	Anodyne	ADRB3	42	42
O=C1OCC[C@H]1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872245062	FE	On-Demand	Anodyne	TRAR	43	46
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)c2ccccc2F)C1	ZINC000872245078	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2ccccc2F)C1	ZINC000872245079	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245087	CD	On-Demand	Anodyne	ADRB2	21	64
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245087	CD	On-Demand	Anodyne	ADRB1	30	64
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245087	CD	On-Demand	Anodyne	HTR1A	17	65
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245087	CD	On-Demand	Anodyne	SLC6A4	19	44
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245088	CD	On-Demand	Anodyne	ADRB2	21	64
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245088	CD	On-Demand	Anodyne	ADRB1	30	64
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245088	CD	On-Demand	Anodyne	HTR1A	17	65
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245088	CD	On-Demand	Anodyne	SLC6A4	19	44
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872245091	CC	On-Demand	Bother	CACNA1C	45	34
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872245091	CC	On-Demand	Bother	CACNA1D	69	34
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872245092	CC	On-Demand	Bother	CACNA1C	45	34
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872245092	CC	On-Demand	Bother	CACNA1D	69	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	CTSD	107	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	PGC	63	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	CMA1	32	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	PAPA1_CARPA	37	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	CTSK	18	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	CTSL	19	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	PGA	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	BACE2	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	TIMP3	45	30
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	TACR3	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	REN	97	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	REN1	21	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	BACE1	94	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	FPR1	53	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	PLM1_PLAFA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	PLM2_PLAFA	59	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872245094	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245120	FG	On-Demand	Anodyne	PGC	49	31
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245120	FG	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245120	FG	On-Demand	Anodyne	FPR1	45	38
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245121	EF	On-Demand	Anodyne	ADRB2	19	57
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245121	EF	On-Demand	Anodyne	ADRB1	48	57
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245121	EF	On-Demand	Anodyne	HTR1A	15	57
O[C@@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245121	EF	On-Demand	Anodyne	SLC6A4	19	45
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245122	FG	On-Demand	Anodyne	PGC	49	31
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245122	FG	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000872245122	FG	On-Demand	Anodyne	FPR1	45	38
O[C@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245124	EF	On-Demand	Anodyne	ADRB2	19	57
O[C@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245124	EF	On-Demand	Anodyne	ADRB1	48	57
O[C@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245124	EF	On-Demand	Anodyne	HTR1A	15	57
O[C@H](CNCc1ncc(Cl)s1)COc1cccc2[nH]ccc12	ZINC000872245124	EF	On-Demand	Anodyne	SLC6A4	19	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245142	GF	On-Demand	Anodyne	ADRB2	36	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245142	GF	On-Demand	Anodyne	ADRB1	74	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245142	GF	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245143	GF	On-Demand	Anodyne	ADRB2	36	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245143	GF	On-Demand	Anodyne	ADRB1	74	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245143	GF	On-Demand	Anodyne	ADRB3	47	48
N#Cc1ccccc1OC[C@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245164	FE	On-Demand	Mild	ADRB2	28	56
N#Cc1ccccc1OC[C@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245164	FE	On-Demand	Mild	ADRB1	85	59
N#Cc1ccccc1OC[C@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245164	FE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245164	FE	On-Demand	Mild	CYP2D6	24	50
N#Cc1ccccc1OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245166	FE	On-Demand	Mild	ADRB2	28	56
N#Cc1ccccc1OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245166	FE	On-Demand	Mild	ADRB1	85	59
N#Cc1ccccc1OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245166	FE	On-Demand	Mild	CASR	47	49
N#Cc1ccccc1OC[C@@H](O)CNCCOC(F)(F)C(F)(F)F	ZINC000872245166	FE	On-Demand	Mild	CYP2D6	24	50
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1Cl	ZINC000872245177	EF	On-Demand	Anodyne	ADRB2	35	53
O[C@H](CNCc1ncc(Cl)s1)COc1ccccc1Cl	ZINC000872245177	EF	On-Demand	Anodyne	ADRB1	56	38
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1Cl	ZINC000872245178	EF	On-Demand	Anodyne	ADRB2	35	53
O[C@@H](CNCc1ncc(Cl)s1)COc1ccccc1Cl	ZINC000872245178	EF	On-Demand	Anodyne	ADRB1	56	38
O[C@H]1C[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872245185	BD	On-Demand	Anodyne	PTGFR	32	42
O=C1OCC[C@H]1CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872245186	EE	On-Demand	Anodyne	LUXR	18	40
O=C1OCC[C@@H]1CCCNC[C@H](O)c1cccc(Br)c1	ZINC000872245187	EE	On-Demand	Anodyne	LUXR	18	40
O=C1OCC[C@H]1CCCNC[C@H](O)c1cccc(Br)c1	ZINC000872245188	EE	On-Demand	Anodyne	LUXR	18	40
O=C1OCC[C@@H]1CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000872245189	EE	On-Demand	Anodyne	LUXR	18	40
O=C1OCC[C@@H]1CCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245190	ED	On-Demand	Anodyne	LUXR	46	33
O=C1OCC[C@@H]1CCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245190	ED	On-Demand	Anodyne	NPFFR1	41	38
O[C@H]1C[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000872245191	BD	On-Demand	Anodyne	PTGFR	32	42
O=C1OCC[C@H]1CCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245192	ED	On-Demand	Anodyne	LUXR	46	33
O=C1OCC[C@H]1CCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245192	ED	On-Demand	Anodyne	NPFFR1	41	38
O=C1OCC[C@H]1CCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245193	ED	On-Demand	Anodyne	LUXR	46	33
O=C1OCC[C@H]1CCCNC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245193	ED	On-Demand	Anodyne	NPFFR1	41	38
O=C1OCC[C@@H]1CCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245194	ED	On-Demand	Anodyne	LUXR	46	33
O=C1OCC[C@@H]1CCCNC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872245194	ED	On-Demand	Anodyne	NPFFR1	41	38
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245199	FE	On-Demand	Anodyne	ADRB2	50	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245199	FE	On-Demand	Anodyne	ADRB1	82	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245199	FE	On-Demand	Anodyne	ADRB3	50	53
CC(=O)Nc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245200	FE	On-Demand	Anodyne	ADRB2	50	62
CC(=O)Nc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245200	FE	On-Demand	Anodyne	ADRB1	82	62
CC(=O)Nc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245200	FE	On-Demand	Anodyne	ADRB3	50	53
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245201	EF	On-Demand	Anodyne	ADRB2	42	47
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245201	EF	On-Demand	Anodyne	ADRB1	73	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245201	EF	On-Demand	Anodyne	ADRB3	45	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245201	EF	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245201	EF	On-Demand	Anodyne	PDS	53	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245202	EF	On-Demand	Anodyne	ADRB2	42	47
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245202	EF	On-Demand	Anodyne	ADRB1	73	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245202	EF	On-Demand	Anodyne	ADRB3	45	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245202	EF	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ncc(Cl)s2)c1	ZINC000872245202	EF	On-Demand	Anodyne	PDS	53	38
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245212	DF	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245212	DF	On-Demand	Mild	ADRB1	70	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245212	DF	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245212	DF	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245216	DF	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245216	DF	On-Demand	Mild	ADRB1	70	52
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245216	DF	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245216	DF	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245218	DF	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245218	DF	On-Demand	Mild	ADRB1	70	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245218	DF	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872245218	DF	On-Demand	Mild	CYP2D6	19	44
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245223	DF	On-Demand	Mild	ADRB2	21	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245223	DF	On-Demand	Mild	ADRB1	70	52
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245223	DF	On-Demand	Mild	CASR	42	43
N#Cc1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872245223	DF	On-Demand	Mild	CYP2D6	19	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000872245227	FF	On-Demand	Anodyne	PAPA1_CARPA	28	46
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000872245229	FF	On-Demand	Anodyne	PAPA1_CARPA	28	46
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245230	DC	On-Demand	Anodyne	ADRB2	50	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245230	DC	On-Demand	Anodyne	ADRB1	89	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245230	DC	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245230	DC	On-Demand	Anodyne	ADRB3	57	57
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245232	DC	On-Demand	Anodyne	ADRB2	50	60
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245232	DC	On-Demand	Anodyne	ADRB1	89	60
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245232	DC	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245232	DC	On-Demand	Anodyne	ADRB3	57	57
COC[C@@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872245237	CD	On-Demand	Anodyne	ROCK1	23	45
COC[C@@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872245237	CD	On-Demand	Anodyne	ROCK2	15	45
Cc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000872245241	FG	On-Demand	Anodyne	ADRB2	15	41
Cc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000872245247	FG	On-Demand	Anodyne	ADRB2	15	41
CON(C)C(=O)CCNCc1cccc2ncccc12	ZINC000872245286	CD	On-Demand	Anodyne	METG	46	31
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245294	GF	On-Demand	Anodyne	ADRB2	42	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245294	GF	On-Demand	Anodyne	ADRB1	64	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245294	GF	On-Demand	Anodyne	ADRB3	42	43
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245296	GF	On-Demand	Anodyne	ADRB2	42	40
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245296	GF	On-Demand	Anodyne	ADRB1	64	43
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245296	GF	On-Demand	Anodyne	ADRB3	42	43
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872245312	EE	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872245312	EE	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872245312	EE	On-Demand	Anodyne	ADRB3	41	42
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872245315	EE	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872245315	EE	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872245315	EE	On-Demand	Anodyne	ADRB3	41	42
CCOc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245317	GD	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245317	GD	On-Demand	Anodyne	ADRB1	67	43
CCOc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245317	GD	On-Demand	Anodyne	ADRB3	44	40
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872245318	EE	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872245318	EE	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872245318	EE	On-Demand	Anodyne	ADRB3	41	42
CCOc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245319	GD	On-Demand	Anodyne	ADRB2	48	43
CCOc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245319	GD	On-Demand	Anodyne	ADRB1	67	43
CCOc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245319	GD	On-Demand	Anodyne	ADRB3	44	40
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872245320	EE	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872245320	EE	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872245320	EE	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245336	GD	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245336	GD	On-Demand	Anodyne	ADRB1	64	44
CC(=O)c1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245336	GD	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245341	GD	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245341	GD	On-Demand	Anodyne	ADRB1	64	44
CC(=O)c1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245341	GD	On-Demand	Anodyne	ADRB3	39	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245343	DF	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245343	DF	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245343	DF	On-Demand	Bother	ADRB3	27	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245345	DF	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245345	DF	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245345	DF	On-Demand	Bother	ADRB3	27	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245346	DF	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245346	DF	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245346	DF	On-Demand	Bother	ADRB3	27	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245347	DF	On-Demand	Bother	ADRB2	25	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245347	DF	On-Demand	Bother	ADRB1	41	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245347	DF	On-Demand	Bother	ADRB3	27	47
Cc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245357	EE	On-Demand	Anodyne	ADRB2	40	44
Cc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245357	EE	On-Demand	Anodyne	ADRB1	54	42
Cc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245357	EE	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245358	EE	On-Demand	Anodyne	ADRB2	40	44
Cc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245358	EE	On-Demand	Anodyne	ADRB1	54	42
Cc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872245358	EE	On-Demand	Anodyne	ADRB3	37	43
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccc(Cl)cc1	ZINC000872245361	EF	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccc(Cl)cc1	ZINC000872245363	EF	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccc(Cl)cc1	ZINC000872245366	EF	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccc(Cl)cc1	ZINC000872245367	EF	On-Demand	Anodyne	ADRB1	41	44
CC(=O)c1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245370	EF	On-Demand	Anodyne	ADRB2	42	46
CC(=O)c1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245370	EF	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245370	EF	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245370	EF	On-Demand	Anodyne	ABCB1	15	55
CC(=O)c1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245372	EF	On-Demand	Anodyne	ADRB2	42	46
CC(=O)c1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245372	EF	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245372	EF	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872245372	EF	On-Demand	Anodyne	ABCB1	15	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3ncccc23)CC1	ZINC000872245374	GG	On-Demand	Anodyne	GPR119	51	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3ncccc23)CC1	ZINC000872245376	GG	On-Demand	Anodyne	GPR119	51	50
O[C@H](CNCc1nc(-c2ccncc2)cs1)Cc1ccc(C(F)(F)F)cc1	ZINC000872245397	GH	On-Demand	Anodyne	GIPR	24	41
O[C@@H](CNCc1nc(-c2ccncc2)cs1)Cc1ccc(C(F)(F)F)cc1	ZINC000872245398	GH	On-Demand	Anodyne	GIPR	24	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872245422	FG	On-Demand	Anodyne	ADRB1	38	43
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872245422	FG	On-Demand	Anodyne	ADRB3	60	43
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872245422	FG	On-Demand	Anodyne	CYP3A4	42	38
COCCc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245463	GF	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245463	GF	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245463	GF	On-Demand	Anodyne	ADRB3	37	41
COCCc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245464	GF	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245464	GF	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245464	GF	On-Demand	Anodyne	ADRB3	37	41
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872245468	DD	On-Demand	Anodyne	ADRB2	23	42
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872245468	DD	On-Demand	Anodyne	ADRB1	53	34
O[C@H]1C[C@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872245469	DD	On-Demand	Anodyne	ADRB2	23	42
O[C@H]1C[C@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000872245469	DD	On-Demand	Anodyne	ADRB1	53	34
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	PGC	59	36
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	PAPA1_CARPA	37	47
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	CCKAR	26	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	CTSK	18	52
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	CTSL	20	47
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	REN	76	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000872245492	EE	On-Demand	Anodyne	FPR1	53	43
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	PGC	59	36
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	PAPA1_CARPA	37	47
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	CCKAR	26	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	CTSK	18	52
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	CTSL	20	47
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	REN	76	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000872245493	EE	On-Demand	Anodyne	FPR1	53	43
COc1ccccc1COC[C@H](O)CNCc1cccc2ncccc12	ZINC000872245498	FF	On-Demand	Anodyne	ADRB2	18	41
COc1ccccc1COC[C@@H](O)CNCc1cccc2ncccc12	ZINC000872245499	FF	On-Demand	Anodyne	ADRB2	18	41
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccc(Oc2ccccc2)cc1	ZINC000872245505	EG	On-Demand	Anodyne	LTA4H	61	51
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccc(Oc2ccccc2)cc1	ZINC000872245505	EG	On-Demand	Anodyne	CA1	17	40
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccc(Oc2ccccc2)cc1	ZINC000872245505	EG	On-Demand	Anodyne	F13A1	15	41
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245518	FG	On-Demand	Anodyne	ADRB2	32	45
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245518	FG	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245518	FG	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245518	FG	On-Demand	Anodyne	PDS	65	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245519	FG	On-Demand	Anodyne	ADRB2	32	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245519	FG	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245519	FG	On-Demand	Anodyne	ABCB1	16	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872245519	FG	On-Demand	Anodyne	PDS	65	36
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245528	DG	On-Demand	Anodyne	ADRB2	19	62
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245528	DG	On-Demand	Anodyne	ADRB1	39	62
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245528	DG	On-Demand	Anodyne	HTR1A	15	62
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245528	DG	On-Demand	Anodyne	SLC6A4	17	42
O[C@@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245529	DG	On-Demand	Anodyne	ADRB2	19	62
O[C@@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245529	DG	On-Demand	Anodyne	ADRB1	39	62
O[C@@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245529	DG	On-Demand	Anodyne	HTR1A	15	62
O[C@@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245529	DG	On-Demand	Anodyne	SLC6A4	17	42
O[C@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245530	DG	On-Demand	Anodyne	ADRB2	19	62
O[C@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245530	DG	On-Demand	Anodyne	ADRB1	39	62
O[C@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245530	DG	On-Demand	Anodyne	HTR1A	15	62
O[C@H](CNCCC[C@@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245530	DG	On-Demand	Anodyne	SLC6A4	17	42
O[C@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245531	DG	On-Demand	Anodyne	ADRB2	19	62
O[C@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245531	DG	On-Demand	Anodyne	ADRB1	39	62
O[C@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245531	DG	On-Demand	Anodyne	HTR1A	15	62
O[C@H](CNCCC[C@H]1C=CCC1)COc1cccc2[nH]ccc12	ZINC000872245531	DG	On-Demand	Anodyne	SLC6A4	17	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245553	DF	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245553	DF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245553	DF	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245553	DF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245554	DF	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245554	DF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245554	DF	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245554	DF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245555	DF	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245555	DF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245555	DF	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)c1	ZINC000872245555	DF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245556	DF	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245556	DF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245556	DF	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)c1	ZINC000872245556	DF	On-Demand	Anodyne	ABCB1	19	44
O[C@]1(CNCc2nc(-c3ccncc3)cs2)CCN(Cc2ccccc2)C1	ZINC000872245571	GF	On-Demand	Anodyne	ROCK1	18	42
O[C@@]1(CNCc2nc(-c3ccncc3)cs2)CCN(Cc2ccccc2)C1	ZINC000872245572	GF	On-Demand	Anodyne	ROCK1	18	42
Cc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245573	FG	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245573	FG	On-Demand	Anodyne	ADRB1	59	48
Cc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245573	FG	On-Demand	Anodyne	ADRB3	42	48
Cc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245574	FG	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245574	FG	On-Demand	Anodyne	ADRB1	59	48
Cc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872245574	FG	On-Demand	Anodyne	ADRB3	42	48
C#CCNC(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872245614	DD	On-Demand	Mild	ROCK1	23	42
C#CCNC(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872245614	DD	On-Demand	Mild	ROCK2	16	42
CON(C)C(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872245641	DD	On-Demand	Anodyne	ROCK1	24	43
CON(C)C(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872245641	DD	On-Demand	Anodyne	ROCK2	17	43
Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245654	FD	On-Demand	Anodyne	ADRB2	48	52
Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245654	FD	On-Demand	Anodyne	ADRB1	65	47
Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245654	FD	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245657	FD	On-Demand	Anodyne	ADRB2	48	52
Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245657	FD	On-Demand	Anodyne	ADRB1	65	47
Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872245657	FD	On-Demand	Anodyne	ADRB3	43	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245674	GD	On-Demand	Anodyne	ADRB2	22	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245674	GD	On-Demand	Anodyne	ADRB1	36	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245674	GD	On-Demand	Anodyne	HTR1A	16	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245674	GD	On-Demand	Anodyne	SLC6A4	19	44
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245674	GD	On-Demand	Anodyne	ADRB3	15	58
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245675	GD	On-Demand	Anodyne	ADRB2	22	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245675	GD	On-Demand	Anodyne	ADRB1	36	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245675	GD	On-Demand	Anodyne	HTR1A	16	63
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245675	GD	On-Demand	Anodyne	SLC6A4	19	44
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000872245675	GD	On-Demand	Anodyne	ADRB3	15	58
CC(=O)c1cccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245693	GD	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1cccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245693	GD	On-Demand	Anodyne	ADRB1	55	40
CC(=O)c1cccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245693	GD	On-Demand	Anodyne	ABCB1	19	46
CC(=O)c1cccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245694	GD	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1cccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245694	GD	On-Demand	Anodyne	ADRB1	55	40
CC(=O)c1cccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1	ZINC000872245694	GD	On-Demand	Anodyne	ABCB1	19	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245699	FE	On-Demand	Anodyne	ADRB2	37	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245699	FE	On-Demand	Anodyne	ADRB1	62	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245699	FE	On-Demand	Anodyne	ADRB3	41	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245700	FE	On-Demand	Anodyne	ADRB2	37	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245700	FE	On-Demand	Anodyne	ADRB1	62	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000872245700	FE	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245710	FG	On-Demand	Anodyne	ADRB2	37	46
O[C@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245710	FG	On-Demand	Anodyne	ADRB1	50	44
O[C@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245710	FG	On-Demand	Anodyne	ADRB3	36	44
O[C@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245710	FG	On-Demand	Anodyne	PDS	58	38
O[C@@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245711	FG	On-Demand	Anodyne	ADRB2	37	46
O[C@@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245711	FG	On-Demand	Anodyne	ADRB1	50	44
O[C@@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245711	FG	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COc1ccccc1	ZINC000872245711	FG	On-Demand	Anodyne	PDS	58	38
Oc1nc2cc(CNC[C@@]3(O)CCN(Cc4ccccc4)C3)ccc2o1	ZINC000872245712	FE	On-Demand	Anodyne	NPFFR1	42	35
Oc1nc2cc(CNC[C@]3(O)CCN(Cc4ccccc4)C3)ccc2o1	ZINC000872245713	FE	On-Demand	Anodyne	NPFFR1	42	35
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872245722	GF	On-Demand	Anodyne	ADRB2	32	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000872245722	GF	On-Demand	Anodyne	ADRB1	57	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872245723	GF	On-Demand	Anodyne	ADRB2	32	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000872245723	GF	On-Demand	Anodyne	ADRB1	57	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245726	FF	On-Demand	Anodyne	ADRB1	53	37
CC(=O)c1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872245727	FF	On-Demand	Anodyne	ADRB1	53	37
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1cccc(C(F)(F)F)c1	ZINC000872245738	DE	On-Demand	Anodyne	HDAC10	15	55
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1cccc(C(F)(F)F)c1	ZINC000872245738	DE	On-Demand	Anodyne	CCR2	25	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872245754	GH	On-Demand	Anodyne	CCR2	42	37
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000872245755	GH	On-Demand	Anodyne	CCR2	42	37
COCCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245769	DC	On-Demand	Anodyne	ADRB2	48	61
COCCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245769	DC	On-Demand	Anodyne	ADRB1	77	61
COCCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245769	DC	On-Demand	Anodyne	ADRB3	53	50
COCCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245770	DC	On-Demand	Anodyne	ADRB2	48	61
COCCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245770	DC	On-Demand	Anodyne	ADRB1	77	61
COCCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872245770	DC	On-Demand	Anodyne	ADRB3	53	50
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245784	GF	On-Demand	Anodyne	ADRB2	22	55
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245784	GF	On-Demand	Anodyne	ADRB1	33	55
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245784	GF	On-Demand	Anodyne	SLC6A4	17	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245784	GF	On-Demand	Anodyne	ADRB3	15	55
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245785	GF	On-Demand	Anodyne	ADRB2	22	55
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245785	GF	On-Demand	Anodyne	ADRB1	33	55
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245785	GF	On-Demand	Anodyne	SLC6A4	17	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000872245785	GF	On-Demand	Anodyne	ADRB3	15	55
C[C@H](CNC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872245794	GE	On-Demand	Anodyne	OPRD1	27	44
C[C@H](CNC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872245795	GE	On-Demand	Anodyne	OPRD1	27	44
C[C@@H](CNC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872245796	GE	On-Demand	Anodyne	OPRD1	27	44
C[C@@H](CNC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000872245797	GE	On-Demand	Anodyne	OPRD1	27	44
C[C@H](CNC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)S(C)(=O)=O	ZINC000872245805	GD	On-Demand	Anodyne	GPR119	20	41
C[C@@H](CNC[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)S(C)(=O)=O	ZINC000872245806	GD	On-Demand	Anodyne	GPR119	20	41
C[C@H](CNC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)S(C)(=O)=O	ZINC000872245807	GD	On-Demand	Anodyne	GPR119	20	41
C[C@@H](CNC[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)S(C)(=O)=O	ZINC000872245808	GD	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000872245809	FE	On-Demand	Anodyne	ADRB2	53	48
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000872245809	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000872245809	FE	On-Demand	Anodyne	ADRB3	48	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000872245809	FE	On-Demand	Anodyne	ABCB1	26	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000872245810	FE	On-Demand	Anodyne	ADRB2	53	48
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000872245810	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000872245810	FE	On-Demand	Anodyne	ADRB3	48	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000872245810	FE	On-Demand	Anodyne	ABCB1	26	44
COC[C@@H](C)OC[C@@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872245871	ED	On-Demand	Anodyne	ROCK1	20	41
COC[C@@H](C)OC[C@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872245873	ED	On-Demand	Anodyne	ROCK1	20	41
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000872245890	EF	On-Demand	Anodyne	ADRB1	35	48
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000872245890	EF	On-Demand	Anodyne	ADRB3	60	48
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000872245894	EF	On-Demand	Anodyne	ADRB1	35	48
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000872245894	EF	On-Demand	Anodyne	ADRB3	60	48
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245902	CF	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245902	CF	On-Demand	Anodyne	ADRB1	50	40
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245902	CF	On-Demand	Anodyne	ADRB3	16	40
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245903	CF	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245903	CF	On-Demand	Anodyne	ADRB1	50	40
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245903	CF	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245904	CF	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245904	CF	On-Demand	Anodyne	ADRB1	50	40
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1F	ZINC000872245904	CF	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245905	CF	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245905	CF	On-Demand	Anodyne	ADRB1	50	40
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1F	ZINC000872245905	CF	On-Demand	Anodyne	ADRB3	16	40
Cc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245944	DG	On-Demand	Anodyne	ADRB2	49	48
Cc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245944	DG	On-Demand	Anodyne	ADRB1	65	42
Cc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245944	DG	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245945	DG	On-Demand	Anodyne	ADRB2	49	48
Cc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245945	DG	On-Demand	Anodyne	ADRB1	65	42
Cc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872245945	DG	On-Demand	Anodyne	ADRB3	43	42
O=C(Nc1cc(F)ccc1OCC(F)(F)F)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000872245950	JI	On-Demand	Anodyne	SFRP1	45	31
O[C@@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245961	EG	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245961	EG	On-Demand	Anodyne	ROCK1	23	47
O[C@@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245961	EG	On-Demand	Anodyne	ROCK2	16	46
O=C(Nc1cc(F)ccc1OCC(F)(F)F)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000872245962	JI	On-Demand	Anodyne	SFRP1	45	31
O[C@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245963	EG	On-Demand	Anodyne	ADRB3	21	44
O[C@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245963	EG	On-Demand	Anodyne	ROCK1	23	47
O[C@H](CCc1ccccc1)CNCc1nc(-c2ccncc2)cs1	ZINC000872245963	EG	On-Demand	Anodyne	ROCK2	16	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1)C2	ZINC000872246010	ED	On-Demand	Anodyne	ADRB2	57	51
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1)C2	ZINC000872246010	ED	On-Demand	Anodyne	ADRB1	85	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1)C2	ZINC000872246010	ED	On-Demand	Anodyne	ADRB3	58	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1)C2	ZINC000872246010	ED	On-Demand	Anodyne	ABCB1	21	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1)C2	ZINC000872246011	ED	On-Demand	Anodyne	ADRB2	57	51
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1)C2	ZINC000872246011	ED	On-Demand	Anodyne	ADRB1	85	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1)C2	ZINC000872246011	ED	On-Demand	Anodyne	ADRB3	58	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1)C2	ZINC000872246011	ED	On-Demand	Anodyne	ABCB1	21	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246019	DC	On-Demand	Anodyne	ADRB2	51	48
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246019	DC	On-Demand	Anodyne	ADRB1	77	48
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246019	DC	On-Demand	Anodyne	ADRB3	52	48
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246019	DC	On-Demand	Anodyne	ABCB1	18	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246020	DC	On-Demand	Anodyne	ADRB2	51	48
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246020	DC	On-Demand	Anodyne	ADRB1	77	48
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246020	DC	On-Demand	Anodyne	ADRB3	52	48
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246020	DC	On-Demand	Anodyne	ABCB1	18	46
O=C(CCNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)Nc1ccccc1	ZINC000872246042	ED	On-Demand	Anodyne	HDAC10	15	40
O=C(CCNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)Nc1ccccc1	ZINC000872246042	ED	On-Demand	Anodyne	HDAC11	16	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(O)c(Cl)c2)CC1	ZINC000872246060	GG	On-Demand	Anodyne	GPR119	46	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(O)c(Cl)c2)CC1	ZINC000872246065	GG	On-Demand	Anodyne	GPR119	46	47
CC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872246069	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872246069	FE	On-Demand	Anodyne	ADRB1	41	38
CC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872246071	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872246071	FE	On-Demand	Anodyne	ADRB1	41	38
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246077	EE	On-Demand	Anodyne	ADRB2	53	50
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246077	EE	On-Demand	Anodyne	ADRB1	80	45
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246077	EE	On-Demand	Anodyne	ADRB3	56	45
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246077	EE	On-Demand	Anodyne	ABCB1	17	42
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246080	EE	On-Demand	Anodyne	ADRB2	53	50
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246080	EE	On-Demand	Anodyne	ADRB1	80	45
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246080	EE	On-Demand	Anodyne	ADRB3	56	45
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000872246080	EE	On-Demand	Anodyne	ABCB1	17	42
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CC2CCCC2)C1	ZINC000872246088	EF	On-Demand	Anodyne	REN	36	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CC2CCCC2)C1	ZINC000872246091	EF	On-Demand	Anodyne	REN	36	41
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)C2CCCCC2)C1	ZINC000872246094	EF	On-Demand	Anodyne	REN	28	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)C2CCCCC2)C1	ZINC000872246097	EF	On-Demand	Anodyne	REN	28	40
CN(CCC#N)C[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246101	ED	On-Demand	Mild	CTSV	29	40
CN(CCC#N)C[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246106	ED	On-Demand	Mild	CTSV	29	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)c2ccccc2Br)C1	ZINC000872246107	GG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CN(CCC#N)C[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246108	ED	On-Demand	Mild	CTSV	29	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2ccccc2Br)C1	ZINC000872246109	GG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CN(CCC#N)C[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246110	ED	On-Demand	Mild	CTSV	29	40
Oc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000872246123	EF	On-Demand	Anodyne	ADRB2	37	40
Oc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000872246123	EF	On-Demand	Anodyne	ADRB1	53	39
Oc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000872246123	EF	On-Demand	Anodyne	GRIN1	15	44
Oc1ccc(CNC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000872246125	EF	On-Demand	Anodyne	ADRB2	37	40
Oc1ccc(CNC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000872246125	EF	On-Demand	Anodyne	ADRB1	53	39
Oc1ccc(CNC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000872246125	EF	On-Demand	Anodyne	GRIN1	15	44
O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872246130	II	On-Demand	Anodyne	P2RX7	49	45
O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000872246145	II	On-Demand	Anodyne	P2RX7	49	45
CON(C)C(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246162	DD	On-Demand	Anodyne	ADRB2	17	51
CON(C)C(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246162	DD	On-Demand	Anodyne	ADRB1	31	40
CON(C)C(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246162	DD	On-Demand	Anodyne	ADRB3	33	41
CON(C)C(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246163	DD	On-Demand	Anodyne	ADRB2	17	51
CON(C)C(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246163	DD	On-Demand	Anodyne	ADRB1	31	40
CON(C)C(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246163	DD	On-Demand	Anodyne	ADRB3	33	41
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246170	FE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246170	FE	On-Demand	Bother	ADRB3	46	42
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246171	FE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246171	FE	On-Demand	Bother	ADRB3	46	42
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246172	FE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246172	FE	On-Demand	Bother	ADRB3	46	42
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246173	FE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872246173	FE	On-Demand	Bother	ADRB3	46	42
CCOC(=O)C1CCC(O)(CNC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872246177	FE	On-Demand	Anodyne	TIMP3	67	34
CCOC(=O)C1CCC(O)(CNC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000872246178	FE	On-Demand	Anodyne	TIMP3	67	34
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246196	CC	On-Demand	Anodyne	ADRB2	43	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246196	CC	On-Demand	Anodyne	ADRB1	73	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246196	CC	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246196	CC	On-Demand	Anodyne	ABCB1	22	57
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246197	CC	On-Demand	Anodyne	ADRB2	43	44
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246197	CC	On-Demand	Anodyne	ADRB1	73	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246197	CC	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872246197	CC	On-Demand	Anodyne	ABCB1	22	57
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246198	EF	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246198	EF	On-Demand	Anodyne	ADRB1	85	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246198	EF	On-Demand	Anodyne	GRIN1	30	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246198	EF	On-Demand	Anodyne	ADRB3	56	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246198	EF	On-Demand	Anodyne	ADCYAP1R1	55	36
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246199	EF	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246199	EF	On-Demand	Anodyne	ADRB1	85	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246199	EF	On-Demand	Anodyne	GRIN1	30	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246199	EF	On-Demand	Anodyne	ADRB3	56	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246199	EF	On-Demand	Anodyne	ADCYAP1R1	55	36
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	ADRB2	58	54
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	ADRB1	96	51
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	MAOB	29	56
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	GRIN1	29	57
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	ADRB3	70	51
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	CTSV	26	40
Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246207	EF	On-Demand	Anodyne	PDS	70	40
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	ADRB2	58	54
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	ADRB1	96	51
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	MAOB	29	56
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	GRIN1	29	57
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	ADRB3	70	51
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	CTSV	26	40
Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246208	EF	On-Demand	Anodyne	PDS	70	40
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	ADRB2	58	54
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	ADRB1	96	51
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	MAOB	29	56
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	GRIN1	29	57
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	ADRB3	70	51
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	CTSV	26	40
Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246209	EF	On-Demand	Anodyne	PDS	70	40
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	ADRB2	58	54
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	ADRB1	96	51
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	MAOB	29	56
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	GRIN1	29	57
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	ADRB3	70	51
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	CTSV	26	40
Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246210	EF	On-Demand	Anodyne	PDS	70	40
CC(=O)c1cccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246298	EF	On-Demand	Anodyne	ADRB2	38	48
CC(=O)c1cccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246298	EF	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1cccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246298	EF	On-Demand	Anodyne	ABCB1	21	46
CC(=O)c1cccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246300	EF	On-Demand	Anodyne	ADRB2	38	48
CC(=O)c1cccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246300	EF	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1cccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)c1	ZINC000872246300	EF	On-Demand	Anodyne	ABCB1	21	46
NC(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872246301	CD	On-Demand	Anodyne	ROCK1	25	43
NC(=O)CCNCc1nc(-c2ccncc2)cs1	ZINC000872246301	CD	On-Demand	Anodyne	ROCK2	17	43
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2cccc3ncccc23)CC1	ZINC000872246305	GG	On-Demand	Anodyne	ADAM17	15	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2cccc3ncccc23)CC1	ZINC000872246307	GG	On-Demand	Anodyne	ADAM17	15	42
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccccc1Cl	ZINC000872246325	EF	On-Demand	Anodyne	ADRB2	18	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	PGC	52	35
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	CTSK	20	53
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	REN	62	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000872246328	EF	On-Demand	Anodyne	NAAA	42	38
CSc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246329	FF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246329	FF	On-Demand	Anodyne	ADRB1	45	40
CSc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246329	FF	On-Demand	Anodyne	ADRB3	32	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	PGC	52	35
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	CTSK	20	53
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	REN	62	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000872246330	EF	On-Demand	Anodyne	NAAA	42	38
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccccc1Cl	ZINC000872246331	EF	On-Demand	Anodyne	ADRB2	18	44
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246333	HF	On-Demand	Anodyne	CA2	41	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246333	HF	On-Demand	Anodyne	CA1	35	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246333	HF	On-Demand	Anodyne	CA4	46	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246333	HF	On-Demand	Anodyne	CA12	21	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246333	HF	On-Demand	Anodyne	CA9	24	42
CSc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246334	FF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246334	FF	On-Demand	Anodyne	ADRB1	45	40
CSc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246334	FF	On-Demand	Anodyne	ADRB3	32	41
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccccc1Cl	ZINC000872246335	EF	On-Demand	Anodyne	ADRB2	18	44
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872246336	FE	On-Demand	Anodyne	ADRB2	28	49
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872246336	FE	On-Demand	Anodyne	ADRB1	54	33
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1Cl)C2	ZINC000872246336	FE	On-Demand	Anodyne	ADRB3	17	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1Cl)C2	ZINC000872246337	FE	On-Demand	Anodyne	ADRB2	28	49
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1Cl)C2	ZINC000872246337	FE	On-Demand	Anodyne	ADRB1	54	33
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1Cl)C2	ZINC000872246337	FE	On-Demand	Anodyne	ADRB3	17	41
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccccc1Cl	ZINC000872246338	EF	On-Demand	Anodyne	ADRB2	18	44
CC[C@@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872246355	CE	On-Demand	Anodyne	ROCK1	23	42
CC[C@@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872246355	CE	On-Demand	Anodyne	ROCK2	15	42
CC[C@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872246357	CE	On-Demand	Anodyne	ROCK1	23	42
CC[C@H](O)CNCc1nc(-c2ccncc2)cs1	ZINC000872246357	CE	On-Demand	Anodyne	ROCK2	15	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872246360	DD	On-Demand	Mild	ADRB1	65	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872246360	DD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872246360	DD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872246367	DD	On-Demand	Mild	ADRB1	65	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872246367	DD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872246367	DD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872246377	DD	On-Demand	Mild	ADRB1	65	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872246377	DD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872246377	DD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872246385	DD	On-Demand	Mild	ADRB1	65	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872246385	DD	On-Demand	Mild	CASR	41	42
N#Cc1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872246385	DD	On-Demand	Mild	CYP2D6	17	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246388	DF	On-Demand	Anodyne	ADRB2	54	50
Cc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246388	DF	On-Demand	Anodyne	ADRB1	72	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246388	DF	On-Demand	Anodyne	GRIN1	30	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246388	DF	On-Demand	Anodyne	ADRB3	49	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246390	GF	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246390	GF	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246390	GF	On-Demand	Anodyne	ADRB3	52	43
Cc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246391	DF	On-Demand	Anodyne	ADRB2	54	50
Cc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246391	DF	On-Demand	Anodyne	ADRB1	72	47
Cc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246391	DF	On-Demand	Anodyne	GRIN1	30	47
Cc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246391	DF	On-Demand	Anodyne	ADRB3	49	47
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246394	GF	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246394	GF	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872246394	GF	On-Demand	Anodyne	ADRB3	52	43
N#Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246397	FD	On-Demand	Mild	ADRB2	30	40
N#Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246397	FD	On-Demand	Mild	ADRB1	61	41
N#Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246400	FD	On-Demand	Mild	ADRB2	30	40
N#Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246400	FD	On-Demand	Mild	ADRB1	61	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872246401	DE	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872246401	DE	On-Demand	Anodyne	ADRB1	49	41
COc1cccc(OC)c1OC[C@@H](O)CNCc1cccc2ncccc12	ZINC000872246408	FF	On-Demand	Anodyne	ADRB2	31	44
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872246411	DE	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872246411	DE	On-Demand	Anodyne	ADRB1	49	41
COc1cccc(OC)c1OC[C@H](O)CNCc1cccc2ncccc12	ZINC000872246412	FF	On-Demand	Anodyne	ADRB2	31	44
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872246422	DE	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872246422	DE	On-Demand	Anodyne	ADRB1	49	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872246433	DE	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872246433	DE	On-Demand	Anodyne	ADRB1	49	41
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@H](CNCCS(C)(=O)=O)C2	ZINC000872246452	GD	On-Demand	Anodyne	GPR119	23	42
NC(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246453	CC	On-Demand	Anodyne	ADRB2	16	52
NC(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246453	CC	On-Demand	Anodyne	ADRB1	33	42
NC(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246453	CC	On-Demand	Anodyne	MAOB	15	43
NC(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246453	CC	On-Demand	Anodyne	ADRB3	32	42
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@@H](CNCCS(C)(=O)=O)C2	ZINC000872246459	GD	On-Demand	Anodyne	GPR119	23	42
NC(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246470	CC	On-Demand	Anodyne	ADRB2	16	52
NC(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246470	CC	On-Demand	Anodyne	ADRB1	33	42
NC(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246470	CC	On-Demand	Anodyne	MAOB	15	43
NC(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246470	CC	On-Demand	Anodyne	ADRB3	32	42
O[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1cccc(Cl)c1	ZINC000872246482	FF	On-Demand	Anodyne	ADRB2	25	59
O[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1cccc(Cl)c1	ZINC000872246482	FF	On-Demand	Anodyne	ADRB1	43	59
O[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1cccc(Cl)c1	ZINC000872246482	FF	On-Demand	Anodyne	ADRB3	24	59
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246488	FF	On-Demand	Anodyne	ADRB2	25	59
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246488	FF	On-Demand	Anodyne	ADRB1	43	59
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246488	FF	On-Demand	Anodyne	ADRB3	24	59
N#Cc1ccccc1OC[C@@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246490	GG	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246490	GG	On-Demand	Mild	CASR	45	46
N#Cc1ccccc1OC[C@@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246490	GG	On-Demand	Mild	CYP2D6	20	46
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246493	FF	On-Demand	Anodyne	ADRB2	25	59
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246493	FF	On-Demand	Anodyne	ADRB1	43	59
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246493	FF	On-Demand	Anodyne	ADRB3	24	59
N#Cc1ccccc1OC[C@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246495	GG	On-Demand	Mild	ADRB1	66	45
N#Cc1ccccc1OC[C@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246495	GG	On-Demand	Mild	CASR	45	46
N#Cc1ccccc1OC[C@H](O)CNCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000872246495	GG	On-Demand	Mild	CYP2D6	20	46
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246499	FF	On-Demand	Anodyne	ADRB2	25	59
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246499	FF	On-Demand	Anodyne	ADRB1	43	59
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000872246499	FF	On-Demand	Anodyne	ADRB3	24	59
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccc(F)cc1	ZINC000872246509	DE	On-Demand	Anodyne	ADRB1	42	44
Cc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246512	DF	On-Demand	Anodyne	ADRB2	46	58
Cc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246512	DF	On-Demand	Anodyne	ADRB1	57	44
Cc1ccc(OC[C@@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246512	DF	On-Demand	Anodyne	ADRB3	31	42
Cc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246514	DF	On-Demand	Anodyne	ADRB2	46	58
Cc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246514	DF	On-Demand	Anodyne	ADRB1	57	44
Cc1ccc(OC[C@H](O)CNCC2(OC(C)C)CCC2)cc1	ZINC000872246514	DF	On-Demand	Anodyne	ADRB3	31	42
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccc(F)cc1	ZINC000872246517	DE	On-Demand	Anodyne	ADRB1	42	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000872246522	FE	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000872246522	FE	On-Demand	Anodyne	ADRB1	56	38
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000872246525	FE	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000872246525	FE	On-Demand	Anodyne	ADRB1	56	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2C[C@H](O)C2)CC1	ZINC000872246526	ED	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2C[C@H](O)C2)CC1	ZINC000872246528	ED	On-Demand	Anodyne	GPR119	36	43
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccc(F)cc1	ZINC000872246530	DE	On-Demand	Anodyne	ADRB1	42	44
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccc(F)cc1	ZINC000872246539	DE	On-Demand	Anodyne	ADRB1	42	44
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000872246547	GF	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000872246547	GF	On-Demand	Anodyne	ADRB1	51	33
N#Cc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246549	DF	On-Demand	Mild	ADRB2	31	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246549	DF	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246549	DF	On-Demand	Mild	ADRB3	32	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872246550	GF	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000872246550	GF	On-Demand	Anodyne	ADRB1	51	33
N#Cc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246557	DF	On-Demand	Mild	ADRB2	31	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246557	DF	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246557	DF	On-Demand	Mild	ADRB3	32	40
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1cccc(Br)c1	ZINC000872246558	EE	On-Demand	Anodyne	EGFR	22	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246561	DF	On-Demand	Mild	ADRB2	31	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246561	DF	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246561	DF	On-Demand	Mild	ADRB3	32	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246564	DF	On-Demand	Mild	ADRB2	31	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246564	DF	On-Demand	Mild	ADRB1	63	40
N#Cc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246564	DF	On-Demand	Mild	ADRB3	32	40
CC(C)(C#N)C[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246577	DE	On-Demand	Mild	CTSV	31	41
CC(C)(C#N)C[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246584	DE	On-Demand	Mild	CTSV	31	41
O[C@@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246585	FF	On-Demand	Anodyne	ADRB3	17	40
O[C@@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246585	FF	On-Demand	Anodyne	ROCK1	22	43
O[C@@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246585	FF	On-Demand	Anodyne	ROCK2	15	43
CC(C)(C#N)C[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872246586	DE	On-Demand	Mild	CTSV	31	41
O[C@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246587	FF	On-Demand	Anodyne	ADRB3	17	40
O[C@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246587	FF	On-Demand	Anodyne	ROCK1	22	43
O[C@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1	ZINC000872246587	FF	On-Demand	Anodyne	ROCK2	15	43
CC(C)(C#N)C[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872246588	DE	On-Demand	Mild	CTSV	31	41
COCCc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246610	FE	On-Demand	Anodyne	ADRB2	40	52
COCCc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246610	FE	On-Demand	Anodyne	ADRB1	60	52
COCCc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246610	FE	On-Demand	Anodyne	ADRB3	42	48
COCCc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246612	FE	On-Demand	Anodyne	ADRB2	40	52
COCCc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246612	FE	On-Demand	Anodyne	ADRB1	60	52
COCCc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872246612	FE	On-Demand	Anodyne	ADRB3	42	48
N#CCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246614	GD	On-Demand	Mild	ADRB2	36	40
N#CCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246614	GD	On-Demand	Mild	ADRB1	68	44
N#CCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246614	GD	On-Demand	Mild	ADRB3	45	40
N#CCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246622	GD	On-Demand	Mild	ADRB2	36	40
N#CCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246622	GD	On-Demand	Mild	ADRB1	68	44
N#CCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872246622	GD	On-Demand	Mild	ADRB3	45	40
OC[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246639	EG	On-Demand	Anodyne	ADRB1	18	40
OC[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246639	EG	On-Demand	Anodyne	ADRB3	20	40
OC[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246641	EG	On-Demand	Anodyne	ADRB1	18	40
OC[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246641	EG	On-Demand	Anodyne	ADRB3	20	40
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246667	DF	On-Demand	Mild	ADRB2	38	43
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246667	DF	On-Demand	Mild	ADRB1	69	43
N#CCc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246667	DF	On-Demand	Mild	ADRB3	44	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246668	DF	On-Demand	Mild	ADRB2	38	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246668	DF	On-Demand	Mild	ADRB1	69	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246668	DF	On-Demand	Mild	ADRB3	44	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246669	DF	On-Demand	Mild	ADRB2	38	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246669	DF	On-Demand	Mild	ADRB1	69	43
N#CCc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872246669	DF	On-Demand	Mild	ADRB3	44	43
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246670	DF	On-Demand	Mild	ADRB2	38	43
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246670	DF	On-Demand	Mild	ADRB1	69	43
N#CCc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872246670	DF	On-Demand	Mild	ADRB3	44	43
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872246697	FE	On-Demand	Anodyne	ADRB2	39	40
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000872246697	FE	On-Demand	Anodyne	ADRB1	60	41
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872246698	FE	On-Demand	Anodyne	ADRB2	39	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000872246698	FE	On-Demand	Anodyne	ADRB1	60	41
COC[C@@H](O)CNC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000872246705	FD	On-Demand	Anodyne	OPRD1	19	42
COC[C@@H](O)CNC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000872246706	FD	On-Demand	Anodyne	OPRD1	19	42
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNCCC(N)=O	ZINC000872246707	ED	On-Demand	Anodyne	OPRD1	29	44
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNCCC(N)=O	ZINC000872246708	ED	On-Demand	Anodyne	OPRD1	29	44
OC[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246709	EG	On-Demand	Anodyne	ADRB1	18	40
OC[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246709	EG	On-Demand	Anodyne	ADRB3	20	40
OC[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246711	EG	On-Demand	Anodyne	ADRB1	18	40
OC[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000872246711	EG	On-Demand	Anodyne	ADRB3	20	40
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	LTA4H	22	40
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC8	17	45
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC10	30	45
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC2	21	45
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC3	19	45
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC6	23	45
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	FUCA1	18	41
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000872246731	BD	On-Demand	Anodyne	HDAC11	28	45
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](CO)c2ccc(Cl)cc2)cc1	ZINC000872246733	GE	On-Demand	Anodyne	PTGS2	17	43
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](CO)c2ccc(Cl)cc2)cc1	ZINC000872246735	GE	On-Demand	Anodyne	PTGS2	17	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](CO)c2ccc(Cl)cc2)cc1	ZINC000872246737	GE	On-Demand	Anodyne	PTGS2	17	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](CO)c2ccc(Cl)cc2)cc1	ZINC000872246743	GE	On-Demand	Anodyne	PTGS2	17	43
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	ADRB2	42	47
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	ADRB1	82	49
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	MAOB	30	51
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	GRIN1	25	52
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	ADRB3	48	49
N#Cc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246745	FE	On-Demand	Mild	PDS	44	38
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	ADRB2	42	47
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	ADRB1	82	49
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	MAOB	30	51
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	GRIN1	25	52
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	ADRB3	48	49
N#Cc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246749	FE	On-Demand	Mild	PDS	44	38
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	ADRB2	42	47
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	ADRB1	82	49
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	MAOB	30	51
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	GRIN1	25	52
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	ADRB3	48	49
N#Cc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246751	FE	On-Demand	Mild	PDS	44	38
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	ADRB2	42	47
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	ADRB1	82	49
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	MAOB	30	51
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	GRIN1	25	52
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	ADRB3	48	49
N#Cc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872246753	FE	On-Demand	Mild	PDS	44	38
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246785	JG	On-Demand	Anodyne	CA2	38	43
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246785	JG	On-Demand	Anodyne	CA1	33	43
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246785	JG	On-Demand	Anodyne	CA4	44	42
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246785	JG	On-Demand	Anodyne	CA12	19	43
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1	ZINC000872246785	JG	On-Demand	Anodyne	CA9	21	43
O[C@@H](CNCc1cccc2ncccc12)CN1CCCC1	ZINC000872246824	CD	On-Demand	Anodyne	HNMT	55	38
O[C@@H](CNCc1cccc2ncccc12)CN1CCCC1	ZINC000872246824	CD	On-Demand	Anodyne	ABCB1	16	42
O[C@H](CNCc1cccc2ncccc12)CN1CCCC1	ZINC000872246826	CD	On-Demand	Anodyne	HNMT	55	38
O[C@H](CNCc1cccc2ncccc12)CN1CCCC1	ZINC000872246826	CD	On-Demand	Anodyne	ABCB1	16	42
C#CCNC(=O)CCNCc1ccc2oc(O)nc2c1	ZINC000872246827	CC	On-Demand	Mild	AGPAT2	21	41
O[C@@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1F	ZINC000872246828	FG	On-Demand	Anodyne	ROCK1	17	47
O[C@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1F	ZINC000872246830	FG	On-Demand	Anodyne	ROCK1	17	47
COC[C@@H](C)OC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872246853	DD	On-Demand	Anodyne	NCE103	15	43
COC[C@@H](C)OC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872246855	DD	On-Demand	Anodyne	NCE103	15	43
O=C(CCNC[C@H]1C[C@H](O)C1)Nc1cccc(F)c1	ZINC000872246869	CD	On-Demand	Anodyne	FUCA1	17	48
N#Cc1ccccc1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246870	FD	On-Demand	Mild	ADRB2	22	56
N#Cc1ccccc1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246870	FD	On-Demand	Mild	ADRB1	75	51
N#Cc1ccccc1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246870	FD	On-Demand	Mild	CASR	43	45
N#Cc1ccccc1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246870	FD	On-Demand	Mild	CYP2D6	18	45
N#Cc1ccccc1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246872	FD	On-Demand	Mild	ADRB2	22	56
N#Cc1ccccc1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246872	FD	On-Demand	Mild	ADRB1	75	51
N#Cc1ccccc1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246872	FD	On-Demand	Mild	CASR	43	45
N#Cc1ccccc1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246872	FD	On-Demand	Mild	CYP2D6	18	45
N#CCc1ccc(OC[C@@H](O)CNCc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000872246885	GG	On-Demand	Mild	ADRB2	23	40
OC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246891	EG	On-Demand	Anodyne	ADRB1	45	47
OC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246891	EG	On-Demand	Anodyne	ADRB3	52	47
OC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246893	EG	On-Demand	Anodyne	ADRB1	45	47
OC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246893	EG	On-Demand	Anodyne	ADRB3	52	47
N#CCc1ccc(OC[C@H](O)CNCc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000872246894	GG	On-Demand	Mild	ADRB2	23	40
OC[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246897	EG	On-Demand	Anodyne	ADRB1	45	47
OC[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246897	EG	On-Demand	Anodyne	ADRB3	52	47
COc1cccc(OC)c1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246899	GD	On-Demand	Anodyne	ADRB2	30	40
COc1cccc(OC)c1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246899	GD	On-Demand	Anodyne	ADRB1	40	41
COc1cccc(OC)c1OC[C@@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246899	GD	On-Demand	Anodyne	ADRB3	15	42
OC[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246900	EG	On-Demand	Anodyne	ADRB1	45	47
OC[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000872246900	EG	On-Demand	Anodyne	ADRB3	52	47
COc1cccc(OC)c1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246902	GD	On-Demand	Anodyne	ADRB2	30	40
COc1cccc(OC)c1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246902	GD	On-Demand	Anodyne	ADRB1	40	41
COc1cccc(OC)c1OC[C@H](O)CNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000872246902	GD	On-Demand	Anodyne	ADRB3	15	42
O[C@H]1C[C@H](CNC[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872246904	GF	On-Demand	Anodyne	SLC6A4	15	41
O[C@H]1C[C@H](CNC[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872246904	GF	On-Demand	Anodyne	SLC6A3	48	44
O[C@H]1C[C@H](CNC[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872246909	GF	On-Demand	Anodyne	SLC6A4	15	41
O[C@H]1C[C@H](CNC[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1	ZINC000872246909	GF	On-Demand	Anodyne	SLC6A3	48	44
OC1(CNCc2nc(-c3ccncc3)cs2)CCC1	ZINC000872246966	CE	On-Demand	Anodyne	ROCK1	23	40
OC1(CNCc2nc(-c3ccncc3)cs2)CCC1	ZINC000872246966	CE	On-Demand	Anodyne	ROCK2	16	40
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(O)c2)c1	ZINC000872246977	EE	On-Demand	Anodyne	ADRB2	95	62
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(O)c2)c1	ZINC000872246977	EE	On-Demand	Anodyne	ADRB1	83	49
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(O)c2)c1	ZINC000872246977	EE	On-Demand	Anodyne	INHA	62	35
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(O)c2)c1	ZINC000872246977	EE	On-Demand	Anodyne	ADRB3	70	49
Cc1ccc(OC[C@@H](O)CNCC2CC(NC(=O)OC(C)(C)C)C2)cc1	ZINC000872246982	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@@H](O)CNCC2CC(NC(=O)OC(C)(C)C)C2)cc1	ZINC000872246982	FF	On-Demand	Anodyne	ADRB1	56	42
Cc1ccc(OC[C@H](O)CNCC2CC(NC(=O)OC(C)(C)C)C2)cc1	ZINC000872246984	FF	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@H](O)CNCC2CC(NC(=O)OC(C)(C)C)C2)cc1	ZINC000872246984	FF	On-Demand	Anodyne	ADRB1	56	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246991	GG	On-Demand	Anodyne	ADRB2	59	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246991	GG	On-Demand	Anodyne	ADRB1	87	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246991	GG	On-Demand	Anodyne	GRIN1	31	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246991	GG	On-Demand	Anodyne	ADRB3	60	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872246991	GG	On-Demand	Anodyne	ABCB1	25	42
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccccc1F	ZINC000872247010	DE	On-Demand	Anodyne	ADRB1	46	37
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccccc1F	ZINC000872247011	DE	On-Demand	Anodyne	ADRB1	46	37
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccccc1F	ZINC000872247012	DE	On-Demand	Anodyne	ADRB1	46	37
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccccc1F	ZINC000872247013	DE	On-Demand	Anodyne	ADRB1	46	37
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247092	GG	On-Demand	Anodyne	ADRB2	59	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247092	GG	On-Demand	Anodyne	ADRB1	87	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247092	GG	On-Demand	Anodyne	GRIN1	31	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247092	GG	On-Demand	Anodyne	ADRB3	60	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247092	GG	On-Demand	Anodyne	ABCB1	25	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247095	FF	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247095	FF	On-Demand	Anodyne	ADRB1	96	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247095	FF	On-Demand	Anodyne	TSHR	43	33
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247095	FF	On-Demand	Anodyne	GRIN1	34	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247095	FF	On-Demand	Anodyne	ADRB3	68	61
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247096	FF	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247096	FF	On-Demand	Anodyne	ADRB1	96	61
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247096	FF	On-Demand	Anodyne	TSHR	43	33
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247096	FF	On-Demand	Anodyne	GRIN1	34	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247096	FF	On-Demand	Anodyne	ADRB3	68	61
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872247131	EE	On-Demand	Anodyne	NCE103	15	43
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872247132	EE	On-Demand	Anodyne	NCE103	15	43
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247133	EF	On-Demand	Mild	ADRB2	36	44
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247133	EF	On-Demand	Mild	ADRB1	58	44
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247133	EF	On-Demand	Mild	GRIN1	27	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247133	EF	On-Demand	Mild	ADRB3	39	44
N#CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247134	EF	On-Demand	Mild	ADRB2	36	44
N#CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247134	EF	On-Demand	Mild	ADRB1	58	44
N#CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247134	EF	On-Demand	Mild	GRIN1	27	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872247134	EF	On-Demand	Mild	ADRB3	39	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247140	DC	On-Demand	Anodyne	ADRB2	31	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247140	DC	On-Demand	Anodyne	ADRB1	38	43
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247140	DC	On-Demand	Anodyne	ADRB3	17	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247141	DC	On-Demand	Anodyne	ADRB2	31	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247141	DC	On-Demand	Anodyne	ADRB1	38	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1C[C@H](O)C1	ZINC000872247141	DC	On-Demand	Anodyne	ADRB3	17	44
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247163	DD	On-Demand	Anodyne	ADRB2	21	40
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247163	DD	On-Demand	Anodyne	ADRB1	36	44
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247163	DD	On-Demand	Anodyne	PDS	49	43
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247165	DD	On-Demand	Anodyne	ADRB2	21	40
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247165	DD	On-Demand	Anodyne	ADRB1	36	44
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000872247165	DD	On-Demand	Anodyne	PDS	49	43
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247167	CC	On-Demand	Mild	ADRB2	37	44
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247167	CC	On-Demand	Mild	ADRB1	65	44
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247167	CC	On-Demand	Mild	ADRB3	42	44
N#CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247182	CC	On-Demand	Mild	ADRB2	37	44
N#CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247182	CC	On-Demand	Mild	ADRB1	65	44
N#CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247182	CC	On-Demand	Mild	ADRB3	42	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247186	GG	On-Demand	Anodyne	ADRB2	48	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247186	GG	On-Demand	Anodyne	ADRB1	79	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247186	GG	On-Demand	Anodyne	ADRB3	54	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247186	GG	On-Demand	Anodyne	ABCB1	27	41
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247188	GG	On-Demand	Anodyne	ADRB2	48	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247188	GG	On-Demand	Anodyne	ADRB1	79	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247188	GG	On-Demand	Anodyne	ADRB3	54	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247188	GG	On-Demand	Anodyne	ABCB1	27	41
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@@H](CNC[C@H](O)c1ccccn1)C2	ZINC000872247195	GF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@H](CNC[C@@H](O)c1ccccn1)C2	ZINC000872247197	GF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@@H](CNC[C@@H](O)c1ccccn1)C2	ZINC000872247200	GF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@H](CNC[C@H](O)c1ccccn1)C2	ZINC000872247202	GF	On-Demand	Anodyne	GPR119	25	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247219	CD	On-Demand	Anodyne	ADRB2	47	46
CCOc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247219	CD	On-Demand	Anodyne	ADRB1	65	44
CCOc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247219	CD	On-Demand	Anodyne	ADRB3	41	43
CCOc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247249	CD	On-Demand	Anodyne	ADRB2	47	46
CCOc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247249	CD	On-Demand	Anodyne	ADRB1	65	44
CCOc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247249	CD	On-Demand	Anodyne	ADRB3	41	43
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNCCS(C)(=O)=O	ZINC000872247264	FD	On-Demand	Anodyne	OPRD1	16	42
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNCCS(C)(=O)=O	ZINC000872247266	FD	On-Demand	Anodyne	OPRD1	16	42
COCCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247269	GD	On-Demand	Anodyne	ADRB2	46	57
COCCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247269	GD	On-Demand	Anodyne	ADRB1	77	57
COCCc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247269	GD	On-Demand	Anodyne	ADRB3	53	45
COCCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247272	GD	On-Demand	Anodyne	ADRB2	46	57
COCCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247272	GD	On-Demand	Anodyne	ADRB1	77	57
COCCc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247272	GD	On-Demand	Anodyne	ADRB3	53	45
O[C@@H](CNCc1nc(-c2ccncc2)cs1)CN1CCCC1	ZINC000872247300	DD	On-Demand	Anodyne	ROCK1	24	46
O[C@@H](CNCc1nc(-c2ccncc2)cs1)CN1CCCC1	ZINC000872247300	DD	On-Demand	Anodyne	ROCK2	16	46
O[C@H](CNCc1nc(-c2ccncc2)cs1)CN1CCCC1	ZINC000872247301	DD	On-Demand	Anodyne	ROCK1	24	46
O[C@H](CNCc1nc(-c2ccncc2)cs1)CN1CCCC1	ZINC000872247301	DD	On-Demand	Anodyne	ROCK2	16	46
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872247316	GD	On-Demand	Anodyne	SIGMAR1	45	37
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872247316	GD	On-Demand	Anodyne	NPFFR1	41	37
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872247317	GD	On-Demand	Anodyne	SIGMAR1	45	37
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@]1(O)CCN(Cc3ccccc3)C1)C2	ZINC000872247317	GD	On-Demand	Anodyne	NPFFR1	41	37
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247334	GF	On-Demand	Anodyne	ADRB2	50	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247334	GF	On-Demand	Anodyne	ADRB1	84	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247334	GF	On-Demand	Anodyne	ADRB3	64	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247334	GF	On-Demand	Anodyne	ROCK2	18	42
CSc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247336	CD	On-Demand	Anodyne	ADRB2	37	43
CSc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247336	CD	On-Demand	Anodyne	ADRB1	57	40
CSc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247336	CD	On-Demand	Anodyne	ADRB3	34	40
CSc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247337	CD	On-Demand	Anodyne	ADRB2	37	43
CSc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247337	CD	On-Demand	Anodyne	ADRB1	57	40
CSc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872247337	CD	On-Demand	Anodyne	ADRB3	34	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247338	GF	On-Demand	Anodyne	ADRB2	50	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247338	GF	On-Demand	Anodyne	ADRB1	84	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247338	GF	On-Demand	Anodyne	ADRB3	64	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872247338	GF	On-Demand	Anodyne	ROCK2	18	42
O[C@@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COCc1ccccc1	ZINC000872247341	FG	On-Demand	Anodyne	TACR1	33	44
O[C@H](CNCc1cc(C(F)(F)F)cc(Cl)n1)COCc1ccccc1	ZINC000872247344	FG	On-Demand	Anodyne	TACR1	33	44
CC(C)(C)OC(=O)NC1CC(CNC[C@@H](O)c2ccccc2Cl)C1	ZINC000872247346	FG	On-Demand	Anodyne	REN	24	40
CC(C)(C)OC(=O)NC1CC(CNC[C@H](O)c2ccccc2Cl)C1	ZINC000872247348	FG	On-Demand	Anodyne	REN	24	40
Cc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872247349	EG	On-Demand	Anodyne	ADRB2	32	43
Cc1ccc(OC[C@@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872247349	EG	On-Demand	Anodyne	ADRB1	42	39
Cc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872247351	EG	On-Demand	Anodyne	ADRB2	32	43
Cc1ccc(OC[C@H](O)CNCc2noc3c2CC(C)(C)CC3)cc1	ZINC000872247351	EG	On-Demand	Anodyne	ADRB1	42	39
O[C@@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1F	ZINC000872247418	EG	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1F	ZINC000872247418	EG	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1F	ZINC000872247419	EG	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1F	ZINC000872247419	EG	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247428	CD	On-Demand	Anodyne	ADRB2	42	47
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247428	CD	On-Demand	Anodyne	ADRB1	64	41
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247428	CD	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247429	CD	On-Demand	Anodyne	ADRB2	42	47
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247429	CD	On-Demand	Anodyne	ADRB1	64	41
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247429	CD	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247430	CD	On-Demand	Anodyne	ADRB2	42	47
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247430	CD	On-Demand	Anodyne	ADRB1	64	41
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccccc1	ZINC000872247430	CD	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247431	CD	On-Demand	Anodyne	ADRB2	42	47
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247431	CD	On-Demand	Anodyne	ADRB1	64	41
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccccc1	ZINC000872247431	CD	On-Demand	Anodyne	ADRB3	41	41
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872247459	EE	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872247460	EE	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872247461	EE	On-Demand	Mild	ADRB1	46	41
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872247462	EE	On-Demand	Mild	ADRB1	46	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872247472	EE	On-Demand	Anodyne	ADRB1	41	39
CCOc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872247473	EE	On-Demand	Anodyne	ADRB1	41	39
CCOc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872247474	EE	On-Demand	Anodyne	ADRB1	41	39
CCOc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872247475	EE	On-Demand	Anodyne	ADRB1	41	39
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1cccc2ccccc12	ZINC000872247498	EG	On-Demand	Anodyne	ADRB2	23	52
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1cccc2ccccc12	ZINC000872247498	EG	On-Demand	Anodyne	ADRB1	36	50
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1cccc2ccccc12	ZINC000872247499	EG	On-Demand	Anodyne	ADRB2	23	52
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1cccc2ccccc12	ZINC000872247499	EG	On-Demand	Anodyne	ADRB1	36	50
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1cccc2ccccc12	ZINC000872247500	EG	On-Demand	Anodyne	ADRB2	23	52
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1cccc2ccccc12	ZINC000872247500	EG	On-Demand	Anodyne	ADRB1	36	50
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1cccc2ccccc12	ZINC000872247501	EG	On-Demand	Anodyne	ADRB2	23	52
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1cccc2ccccc12	ZINC000872247501	EG	On-Demand	Anodyne	ADRB1	36	50
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNCCC#N	ZINC000872247513	DF	On-Demand	Mild	OPRD1	16	42
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNCCC#N	ZINC000872247513	DF	On-Demand	Mild	CFTR	49	32
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNCCC#N	ZINC000872247514	DF	On-Demand	Mild	OPRD1	16	42
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNCCC#N	ZINC000872247514	DF	On-Demand	Mild	CFTR	49	32
O[C@H]1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872247555	CD	On-Demand	Anodyne	ADRB1	33	45
O[C@H]1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000872247555	CD	On-Demand	Anodyne	ADRB3	46	45
O[C@H]1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872247556	CD	On-Demand	Anodyne	ADRB1	33	45
O[C@H]1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000872247556	CD	On-Demand	Anodyne	ADRB3	46	45
O[C@H]1C[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872247563	CC	On-Demand	Anodyne	SIGMAR1	56	40
O[C@H]1C[C@H](CNC[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872247563	CC	On-Demand	Anodyne	NPFFR1	42	37
O[C@H]1C[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872247564	CC	On-Demand	Anodyne	SIGMAR1	56	40
O[C@H]1C[C@H](CNC[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000872247564	CC	On-Demand	Anodyne	NPFFR1	42	37
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	ADRB2	51	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	ADRB1	78	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	GRIN1	27	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	ADRB3	54	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	ADCYAP1R1	44	33
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247628	EF	On-Demand	Anodyne	PDS	68	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	ADRB2	51	45
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	ADRB1	78	41
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	GRIN1	27	46
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	ADRB3	54	41
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	ADCYAP1R1	44	33
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)c1	ZINC000872247629	EF	On-Demand	Anodyne	PDS	68	38
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247640	GD	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247640	GD	On-Demand	Anodyne	ADRB3	80	45
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247641	GD	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247641	GD	On-Demand	Anodyne	ADRB3	80	45
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247642	GD	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247642	GD	On-Demand	Anodyne	ADRB3	80	45
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247643	GD	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872247643	GD	On-Demand	Anodyne	ADRB3	80	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247665	CC	On-Demand	Anodyne	ADRB2	38	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247665	CC	On-Demand	Anodyne	ADRB1	68	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247665	CC	On-Demand	Anodyne	ADRB3	40	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247665	CC	On-Demand	Anodyne	ABCB1	28	49
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247665	CC	On-Demand	Anodyne	PDS	62	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247666	CC	On-Demand	Anodyne	ADRB2	38	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247666	CC	On-Demand	Anodyne	ADRB1	68	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247666	CC	On-Demand	Anodyne	ADRB3	40	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247666	CC	On-Demand	Anodyne	ABCB1	28	49
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c1	ZINC000872247666	CC	On-Demand	Anodyne	PDS	62	38
O=C(CCNCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)Nc1cccnc1	ZINC000872247740	ED	On-Demand	Anodyne	NAMPT	22	41
Oc1nc2cc(CNC[C@@H](O)COc3cccc(C(F)(F)F)c3)ccc2o1	ZINC000872247752	GG	On-Demand	Anodyne	PDS	45	39
Oc1nc2cc(CNC[C@H](O)COc3cccc(C(F)(F)F)c3)ccc2o1	ZINC000872247755	GG	On-Demand	Anodyne	PDS	45	39
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872247756	EG	On-Demand	Bother	CACNA1D	45	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(C(F)(F)F)s2)c1	ZINC000872247757	EG	On-Demand	Bother	CACNA1D	45	38
O[C@@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1Cl	ZINC000872247803	GH	On-Demand	Anodyne	ROCK1	18	47
O[C@H](CNCc1nc(-c2ccncc2)cs1)COCc1ccccc1Cl	ZINC000872247808	GH	On-Demand	Anodyne	ROCK1	18	47
CSc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247811	GE	On-Demand	Anodyne	ADRB1	57	41
CSc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1	ZINC000872247817	GE	On-Demand	Anodyne	ADRB1	57	41
CCOc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247821	FE	On-Demand	Anodyne	ADRB2	40	43
CCOc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247821	FE	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccc(OC[C@@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247821	FE	On-Demand	Anodyne	ADRB3	37	43
CCOc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247825	FE	On-Demand	Anodyne	ADRB2	40	43
CCOc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247825	FE	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccc(OC[C@H](O)CNCc2ccc3oc(O)nc3c2)cc1	ZINC000872247825	FE	On-Demand	Anodyne	ADRB3	37	43
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247866	DD	On-Demand	Anodyne	ADRB2	28	45
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247866	DD	On-Demand	Anodyne	ADRB1	30	48
O[C@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247866	DD	On-Demand	Anodyne	ADRB3	106	49
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247867	DD	On-Demand	Anodyne	ADRB2	28	45
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247867	DD	On-Demand	Anodyne	ADRB1	30	48
O[C@@H](CNCCn1ccc(C(F)(F)F)n1)c1cccnc1	ZINC000872247867	DD	On-Demand	Anodyne	ADRB3	106	49
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872247868	ED	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872247868	ED	On-Demand	Anodyne	ADRB1	58	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872247868	ED	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872247869	ED	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872247869	ED	On-Demand	Anodyne	ADRB1	58	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872247869	ED	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872247870	ED	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872247870	ED	On-Demand	Anodyne	ADRB1	58	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872247870	ED	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872247871	ED	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872247871	ED	On-Demand	Anodyne	ADRB1	58	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872247871	ED	On-Demand	Anodyne	ADRB3	35	41
C#CCNC(=O)CCNCCc1ccc(OC)c(O)c1	ZINC000872247891	CC	On-Demand	Mild	INHA	54	33
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247894	EF	On-Demand	Anodyne	ADRB2	52	53
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247894	EF	On-Demand	Anodyne	ADRB1	78	48
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247894	EF	On-Demand	Anodyne	ADRB3	52	48
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247894	EF	On-Demand	Anodyne	ABCB1	17	42
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247895	EF	On-Demand	Anodyne	ADRB2	52	53
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247895	EF	On-Demand	Anodyne	ADRB1	78	48
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247895	EF	On-Demand	Anodyne	ADRB3	52	48
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000872247895	EF	On-Demand	Anodyne	ABCB1	17	42
N#CCC[C@@H](C#N)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872247928	CE	On-Demand	Mild	CTSV	32	42
N#CCC[C@H](C#N)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872247929	CE	On-Demand	Mild	CTSV	32	42
N#CCC[C@H](C#N)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872247930	CE	On-Demand	Mild	CTSV	32	42
N#CCC[C@@H](C#N)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872247931	CE	On-Demand	Mild	CTSV	32	42
CON(C)C(=O)CCNCc1ccc(O)c(Cl)c1	ZINC000872247932	CD	On-Demand	Anodyne	NCE103	18	48
O=C(CCNC[C@@H](O)Cc1cccc(Cl)c1)Nc1ccccc1F	ZINC000872247933	FG	On-Demand	Anodyne	ADRB3	23	41
O=C(CCNC[C@H](O)Cc1cccc(Cl)c1)Nc1ccccc1F	ZINC000872247934	FG	On-Demand	Anodyne	ADRB3	23	41
O[C@H]1C[C@H](CNC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872247972	EF	On-Demand	Anodyne	SLC6A3	28	42
O[C@H]1C[C@H](CNC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872247972	EF	On-Demand	Anodyne	MAN1B1	44	33
O[C@H]1C[C@H](CNC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872247973	EF	On-Demand	Anodyne	SLC6A3	28	42
O[C@H]1C[C@H](CNC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000872247973	EF	On-Demand	Anodyne	MAN1B1	44	33
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872247983	EE	On-Demand	Anodyne	ADRB1	36	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000872247983	EE	On-Demand	Anodyne	ADRB3	49	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872247984	EE	On-Demand	Anodyne	ADRB1	36	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000872247984	EE	On-Demand	Anodyne	ADRB3	49	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000872247987	GF	On-Demand	Anodyne	ADRB2	36	56
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000872247987	GF	On-Demand	Anodyne	ADRB1	63	37
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000872247987	GF	On-Demand	Anodyne	ADRB3	21	54
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000872247988	GF	On-Demand	Anodyne	ADRB2	36	56
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000872247988	GF	On-Demand	Anodyne	ADRB1	63	37
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000872247988	GF	On-Demand	Anodyne	ADRB3	21	54
COCCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247989	FF	On-Demand	Anodyne	ADRB2	46	54
COCCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247989	FF	On-Demand	Anodyne	ADRB1	73	54
COCCc1ccc(OC[C@@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247989	FF	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247990	FF	On-Demand	Anodyne	ADRB2	46	54
COCCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247990	FF	On-Demand	Anodyne	ADRB1	73	54
COCCc1ccc(OC[C@H](O)CNCc2cccc3ncccc23)cc1	ZINC000872247990	FF	On-Demand	Anodyne	ADRB3	48	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872248006	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872248006	EE	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872248006	EE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872248007	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872248007	EE	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872248007	EE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872248008	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872248008	EE	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872248008	EE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872248009	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872248009	EE	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872248009	EE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ADRB2	36	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ADRB1	54	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ROCK1	25	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ROCK2	19	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248038	GF	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ADRB2	36	41
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ADRB1	54	41
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ROCK1	25	43
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ROCK2	19	44
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)c1	ZINC000872248040	GF	On-Demand	Anodyne	ABCB1	16	42
Cc1ccc(OC[C@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c(C)c1	ZINC000872248043	FD	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(OC[C@@H](O)CNCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c(C)c1	ZINC000872248046	FD	On-Demand	Anodyne	ADRB2	21	45
N#CCc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248071	GF	On-Demand	Mild	ADRB2	38	41
N#CCc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248071	GF	On-Demand	Mild	ADRB1	57	41
N#CCc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248071	GF	On-Demand	Mild	ADRB3	44	41
N#CCc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248074	GF	On-Demand	Mild	ADRB2	38	41
N#CCc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248074	GF	On-Demand	Mild	ADRB1	57	41
N#CCc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248074	GF	On-Demand	Mild	ADRB3	44	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248075	DE	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248075	DE	On-Demand	Anodyne	ADRB1	42	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248077	DE	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248077	DE	On-Demand	Anodyne	ADRB1	42	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248079	DE	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248079	DE	On-Demand	Anodyne	ADRB1	42	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248081	DE	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248081	DE	On-Demand	Anodyne	ADRB1	42	44
CSc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248086	GG	On-Demand	Anodyne	ADRB2	36	41
CSc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248086	GG	On-Demand	Anodyne	ADRB1	46	44
CSc1ccc(OC[C@@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248086	GG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248093	GG	On-Demand	Anodyne	ADRB2	47	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248093	GG	On-Demand	Anodyne	ADRB1	80	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248093	GG	On-Demand	Anodyne	GRIN1	18	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248093	GG	On-Demand	Anodyne	ADRB3	51	54
CSc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248094	GG	On-Demand	Anodyne	ADRB2	36	41
CSc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248094	GG	On-Demand	Anodyne	ADRB1	46	44
CSc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248094	GG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248095	GG	On-Demand	Anodyne	ADRB2	47	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248095	GG	On-Demand	Anodyne	ADRB1	80	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248095	GG	On-Demand	Anodyne	GRIN1	18	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248095	GG	On-Demand	Anodyne	ADRB3	51	54
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248097	DE	On-Demand	Anodyne	ADRB2	18	43
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248099	DE	On-Demand	Anodyne	ADRB2	18	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872248100	FD	On-Demand	Anodyne	ADRB2	42	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872248100	FD	On-Demand	Anodyne	ADRB1	67	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000872248100	FD	On-Demand	Anodyne	ADRB3	43	42
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248101	DE	On-Demand	Anodyne	ADRB2	18	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248102	DE	On-Demand	Anodyne	ADRB2	18	43
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872248103	FD	On-Demand	Anodyne	ADRB2	42	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872248103	FD	On-Demand	Anodyne	ADRB1	67	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc(F)cc1)C2	ZINC000872248103	FD	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)c1	ZINC000872248104	DE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)c1	ZINC000872248104	DE	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)c1	ZINC000872248106	DE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)c1	ZINC000872248106	DE	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)c1	ZINC000872248108	DE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)c1	ZINC000872248108	DE	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)c1	ZINC000872248110	DE	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)c1	ZINC000872248110	DE	On-Demand	Anodyne	ABCB1	18	47
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248117	GF	On-Demand	Anodyne	ADRB2	44	54
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248117	GF	On-Demand	Anodyne	ADRB1	62	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248117	GF	On-Demand	Anodyne	ADRB3	42	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248120	GF	On-Demand	Anodyne	ADRB2	44	54
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248120	GF	On-Demand	Anodyne	ADRB1	62	40
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000872248120	GF	On-Demand	Anodyne	ADRB3	42	42
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1F)C2	ZINC000872248216	FD	On-Demand	Anodyne	ADRB2	25	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1F)C2	ZINC000872248216	FD	On-Demand	Anodyne	ADRB1	57	39
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@@H](O)COc1ccccc1F)C2	ZINC000872248216	FD	On-Demand	Anodyne	ADRB3	15	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1F)C2	ZINC000872248218	FD	On-Demand	Anodyne	ADRB2	25	41
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1F)C2	ZINC000872248218	FD	On-Demand	Anodyne	ADRB1	57	39
O=S1(=O)[C@H]2CC[C@H]1CC(CNC[C@H](O)COc1ccccc1F)C2	ZINC000872248218	FD	On-Demand	Anodyne	ADRB3	15	41
CCOc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248226	GG	On-Demand	Anodyne	ADRB2	43	43
CCOc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248226	GG	On-Demand	Anodyne	ADRB1	59	48
CCOc1ccc(OC[C@H](O)CNCc2nc(-c3ccncc3)cs2)cc1	ZINC000872248226	GG	On-Demand	Anodyne	ADRB3	40	48
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COC1CCOCC1	ZINC000872248240	ED	On-Demand	Anodyne	ADRB1	18	42
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COC1CCOCC1	ZINC000872248243	ED	On-Demand	Anodyne	ADRB1	18	42
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COC1CCOCC1	ZINC000872248246	ED	On-Demand	Anodyne	ADRB1	18	42
O[C@H](CNC[C@@H](O)COC1CCOCC1)Cc1cccc(Cl)c1	ZINC000872248249	ED	On-Demand	Anodyne	ADRB1	18	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccc(O)c(Cl)c1	ZINC000872248311	EE	On-Demand	Anodyne	NCE103	16	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccc(O)c(Cl)c1	ZINC000872248312	EE	On-Demand	Anodyne	NCE103	16	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248359	DF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248359	DF	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248359	DF	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248360	DF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248360	DF	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248360	DF	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248361	DF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248361	DF	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872248361	DF	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248362	DF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248362	DF	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872248362	DF	On-Demand	Anodyne	ADRB3	43	42
CS(=O)(=O)c1ccc([C@H](O)CNCCn2ccc(C(F)(F)F)n2)cc1	ZINC000872248384	GD	On-Demand	Anodyne	ADRB2	16	40
CS(=O)(=O)c1ccc([C@H](O)CNCCn2ccc(C(F)(F)F)n2)cc1	ZINC000872248384	GD	On-Demand	Anodyne	ADRB3	49	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2ccc(C(F)(F)F)n2)cc1	ZINC000872248385	GD	On-Demand	Anodyne	ADRB2	16	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2ccc(C(F)(F)F)n2)cc1	ZINC000872248385	GD	On-Demand	Anodyne	ADRB3	49	35
N#CCc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248452	FE	On-Demand	Mild	ADRB2	44	45
N#CCc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248452	FE	On-Demand	Mild	ADRB1	82	50
N#CCc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248452	FE	On-Demand	Mild	MAOB	25	49
N#CCc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248452	FE	On-Demand	Mild	GRIN1	26	51
N#CCc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248452	FE	On-Demand	Mild	ADRB3	54	50
N#CCc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248453	FE	On-Demand	Mild	ADRB2	44	45
N#CCc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248453	FE	On-Demand	Mild	ADRB1	82	50
N#CCc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248453	FE	On-Demand	Mild	MAOB	25	49
N#CCc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248453	FE	On-Demand	Mild	GRIN1	26	51
N#CCc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248453	FE	On-Demand	Mild	ADRB3	54	50
N#CCc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248454	FE	On-Demand	Mild	ADRB2	44	45
N#CCc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248454	FE	On-Demand	Mild	ADRB1	82	50
N#CCc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248454	FE	On-Demand	Mild	MAOB	25	49
N#CCc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248454	FE	On-Demand	Mild	GRIN1	26	51
N#CCc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248454	FE	On-Demand	Mild	ADRB3	54	50
N#CCc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248455	FE	On-Demand	Mild	ADRB2	44	45
N#CCc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248455	FE	On-Demand	Mild	ADRB1	82	50
N#CCc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248455	FE	On-Demand	Mild	MAOB	25	49
N#CCc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248455	FE	On-Demand	Mild	GRIN1	26	51
N#CCc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248455	FE	On-Demand	Mild	ADRB3	54	50
CCOC(=O)CC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248463	DD	On-Demand	Anodyne	NCE103	15	42
CCOC(=O)CC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248464	DD	On-Demand	Anodyne	NCE103	15	42
O=C(CCNC[C@@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248471	EE	On-Demand	Anodyne	ADRB2	19	43
O=C(CCNC[C@@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248471	EE	On-Demand	Anodyne	ADRB1	47	44
O=C(CCNC[C@@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248471	EE	On-Demand	Anodyne	ADRB3	59	44
O=C(CCNC[C@@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248471	EE	On-Demand	Anodyne	NAMPT	22	40
O=C(CCNC[C@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248472	EE	On-Demand	Anodyne	ADRB2	19	43
O=C(CCNC[C@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248472	EE	On-Demand	Anodyne	ADRB1	47	44
O=C(CCNC[C@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248472	EE	On-Demand	Anodyne	ADRB3	59	44
O=C(CCNC[C@H](O)Cc1cccc(Cl)c1)Nc1cccnc1	ZINC000872248472	EE	On-Demand	Anodyne	NAMPT	22	40
OC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248473	DE	On-Demand	Anodyne	ADRB2	21	41
OC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248473	DE	On-Demand	Anodyne	ADRB1	33	45
OC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248473	DE	On-Demand	Anodyne	ADRB3	98	50
OC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248474	DE	On-Demand	Anodyne	ADRB2	21	41
OC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248474	DE	On-Demand	Anodyne	ADRB1	33	45
OC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248474	DE	On-Demand	Anodyne	ADRB3	98	50
OC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248475	DE	On-Demand	Anodyne	ADRB2	21	41
OC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248475	DE	On-Demand	Anodyne	ADRB1	33	45
OC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248475	DE	On-Demand	Anodyne	ADRB3	98	50
OC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248476	DE	On-Demand	Anodyne	ADRB2	21	41
OC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248476	DE	On-Demand	Anodyne	ADRB1	33	45
OC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000872248476	DE	On-Demand	Anodyne	ADRB3	98	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	ADRB2	60	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	ADRB1	116	61
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	TSHR	43	32
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	MAOB	30	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	GRIN1	33	60
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	ADRB3	84	61
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	ABCB1	21	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248481	GE	On-Demand	Anodyne	PDS	84	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	ADRB2	60	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	ADRB1	116	61
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	TSHR	43	32
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	MAOB	30	51
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	GRIN1	33	60
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	ADRB3	84	61
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	ABCB1	21	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248482	GE	On-Demand	Anodyne	PDS	84	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	ADRB2	60	56
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	ADRB1	116	61
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	TSHR	43	32
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	MAOB	30	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	GRIN1	33	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	ADRB3	84	61
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	ABCB1	21	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248483	GE	On-Demand	Anodyne	PDS	84	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	ADRB2	60	56
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	ADRB1	116	61
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	TSHR	43	32
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	MAOB	30	51
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	GRIN1	33	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	ADRB3	84	61
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	ABCB1	21	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248484	GE	On-Demand	Anodyne	PDS	84	41
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COCc1ccccc1F	ZINC000872248490	FF	On-Demand	Anodyne	ADRB1	18	40
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COCc1ccccc1F	ZINC000872248491	FF	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COCc1ccccc1F	ZINC000872248492	FF	On-Demand	Anodyne	ADRB1	18	40
O[C@H](CNC[C@@H](O)COCc1ccccc1F)Cc1cccc(Cl)c1	ZINC000872248493	FF	On-Demand	Anodyne	ADRB1	18	40
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	ADRB2	32	56
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	ADRB1	84	53
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	ADRB3	27	48
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	CASR	48	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	CYP2D6	21	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248495	FE	On-Demand	Mild	CTSV	26	40
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	ADRB2	32	56
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	ADRB1	84	53
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	ADRB3	27	48
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	CASR	48	49
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	CYP2D6	21	49
N#Cc1ccccc1OC[C@H](O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248496	FE	On-Demand	Mild	CTSV	26	40
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	ADRB2	32	56
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	ADRB1	84	53
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	ADRB3	27	48
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	CASR	48	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	CYP2D6	21	49
N#Cc1ccccc1OC[C@@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248497	FE	On-Demand	Mild	CTSV	26	40
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	ADRB2	32	56
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	ADRB1	84	53
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	ADRB3	27	48
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	CASR	48	49
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	CYP2D6	21	49
N#Cc1ccccc1OC[C@H](O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248498	FE	On-Demand	Mild	CTSV	26	40
OC[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248507	DF	On-Demand	Anodyne	ADRB1	25	44
OC[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248507	DF	On-Demand	Anodyne	ADRB3	34	44
OC[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248508	DF	On-Demand	Anodyne	ADRB1	25	44
OC[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248508	DF	On-Demand	Anodyne	ADRB3	34	44
OC[C@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248509	DF	On-Demand	Anodyne	ADRB1	25	44
OC[C@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248509	DF	On-Demand	Anodyne	ADRB3	34	44
OC[C@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248510	DF	On-Demand	Anodyne	ADRB1	25	44
OC[C@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000872248510	DF	On-Demand	Anodyne	ADRB3	34	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	ADRB2	51	55
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	ADRB1	94	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	MAOB	30	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	GRIN1	21	51
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	ADRB3	67	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	CTSV	28	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248515	GE	On-Demand	Anodyne	PDS	92	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	ADRB2	51	55
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	ADRB1	94	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	MAOB	30	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	GRIN1	21	51
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	ADRB3	67	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	CTSV	28	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248516	GE	On-Demand	Anodyne	PDS	92	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	ADRB2	51	55
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	ADRB1	94	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	MAOB	30	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	GRIN1	21	51
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	ADRB3	67	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	CTSV	28	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248517	GE	On-Demand	Anodyne	PDS	92	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	ADRB2	51	55
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	ADRB1	94	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	MAOB	30	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	GRIN1	21	51
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	ADRB3	67	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	CTSV	28	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000872248518	GE	On-Demand	Anodyne	PDS	92	47
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)COc3ccc(F)cc3)C[C@H]1C2	ZINC000872248525	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccc(F)cc3)C[C@H]1C2	ZINC000872248526	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccc(F)cc3)C[C@H]1C2	ZINC000872248527	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)COc3ccc(F)cc3)C[C@H]1C2	ZINC000872248528	GF	On-Demand	Anodyne	ADRB2	23	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248529	DD	On-Demand	Anodyne	ADRB2	50	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248529	DD	On-Demand	Anodyne	ADRB1	81	50
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248529	DD	On-Demand	Anodyne	GRIN1	19	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248529	DD	On-Demand	Anodyne	ADRB3	57	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248529	DD	On-Demand	Anodyne	ABCB1	34	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248530	DD	On-Demand	Anodyne	ADRB2	50	49
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248530	DD	On-Demand	Anodyne	ADRB1	81	50
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248530	DD	On-Demand	Anodyne	GRIN1	19	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248530	DD	On-Demand	Anodyne	ADRB3	57	49
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)cc1	ZINC000872248530	DD	On-Demand	Anodyne	ABCB1	34	44
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248541	FE	On-Demand	Anodyne	ADRB2	38	45
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248541	FE	On-Demand	Anodyne	ADRB1	68	39
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248541	FE	On-Demand	Anodyne	ADRB3	37	41
O[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248541	FE	On-Demand	Anodyne	ABCB1	24	41
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248542	FE	On-Demand	Anodyne	ADRB2	38	45
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248542	FE	On-Demand	Anodyne	ADRB1	68	39
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248542	FE	On-Demand	Anodyne	ADRB3	37	41
O[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248542	FE	On-Demand	Anodyne	ABCB1	24	41
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248543	FE	On-Demand	Anodyne	ADRB2	38	45
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248543	FE	On-Demand	Anodyne	ADRB1	68	39
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248543	FE	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)COc1ccccc1F	ZINC000872248543	FE	On-Demand	Anodyne	ABCB1	24	41
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1ccc2ccccc2c1	ZINC000872248546	EG	On-Demand	Anodyne	ADRB2	25	50
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1ccc2ccccc2c1	ZINC000872248547	EG	On-Demand	Anodyne	ADRB2	25	50
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1ccc2ccccc2c1	ZINC000872248548	EG	On-Demand	Anodyne	ADRB2	25	50
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1ccc2ccccc2c1	ZINC000872248549	EG	On-Demand	Anodyne	ADRB2	25	50
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248551	FG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248551	FG	On-Demand	Anodyne	ADRB1	64	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248551	FG	On-Demand	Anodyne	ADRB3	35	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248552	FG	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248552	FG	On-Demand	Anodyne	ADRB1	64	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872248552	FG	On-Demand	Anodyne	ADRB3	35	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1	ZINC000872248600	ED	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1	ZINC000872248601	ED	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)c1	ZINC000872248602	ED	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1	ZINC000872248603	ED	On-Demand	Bother	ADRB1	21	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248637	EE	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248637	EE	On-Demand	Anodyne	ADRB1	73	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248637	EE	On-Demand	Anodyne	ADRB3	50	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248638	EE	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248638	EE	On-Demand	Anodyne	ADRB1	73	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248638	EE	On-Demand	Anodyne	ADRB3	50	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248639	EE	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248639	EE	On-Demand	Anodyne	ADRB1	73	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C)(C)CO2)cc1	ZINC000872248639	EE	On-Demand	Anodyne	ADRB3	50	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248640	EE	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248640	EE	On-Demand	Anodyne	ADRB1	73	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C)(C)CO2)cc1	ZINC000872248640	EE	On-Demand	Anodyne	ADRB3	50	44
O[C@H](CNC[C@@H](O)COc1ccccc1F)Cc1cccc(Cl)c1	ZINC000872248644	FE	On-Demand	Anodyne	ADRB2	38	45
O[C@H](CNC[C@@H](O)COc1ccccc1F)Cc1cccc(Cl)c1	ZINC000872248644	FE	On-Demand	Anodyne	ADRB1	68	39
O[C@H](CNC[C@@H](O)COc1ccccc1F)Cc1cccc(Cl)c1	ZINC000872248644	FE	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNC[C@@H](O)COc1ccccc1F)Cc1cccc(Cl)c1	ZINC000872248644	FE	On-Demand	Anodyne	ABCB1	24	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248645	FE	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248645	FE	On-Demand	Anodyne	CTSL	16	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248645	FE	On-Demand	Anodyne	PDS	72	39
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248646	FE	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248646	FE	On-Demand	Anodyne	CTSL	16	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248646	FE	On-Demand	Anodyne	PDS	72	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248647	FE	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248647	FE	On-Demand	Anodyne	CTSL	16	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000872248647	FE	On-Demand	Anodyne	PDS	72	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248648	FE	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248648	FE	On-Demand	Anodyne	CTSL	16	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872248648	FE	On-Demand	Anodyne	PDS	72	39
Oc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248661	EG	On-Demand	Anodyne	ADRB2	43	50
Oc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248661	EG	On-Demand	Anodyne	ADRB1	56	43
Oc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248661	EG	On-Demand	Anodyne	ADRB3	32	40
Oc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248661	EG	On-Demand	Anodyne	CASR	30	40
Oc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248662	EG	On-Demand	Anodyne	ADRB2	43	50
Oc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248662	EG	On-Demand	Anodyne	ADRB1	56	43
Oc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248662	EG	On-Demand	Anodyne	ADRB3	32	40
Oc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000872248662	EG	On-Demand	Anodyne	CASR	30	40
COc1ccccc1COC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248664	FF	On-Demand	Anodyne	ADRB1	22	43
COc1ccccc1COC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248664	FF	On-Demand	Anodyne	ADRB3	17	43
COc1ccccc1COC[C@@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248664	FF	On-Demand	Anodyne	ADCYAP1R1	42	36
COc1ccccc1COC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248665	FF	On-Demand	Anodyne	ADRB1	22	43
COc1ccccc1COC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248665	FF	On-Demand	Anodyne	ADRB3	17	43
COc1ccccc1COC[C@H](O)CNCc1ccc(O)c(Cl)c1	ZINC000872248665	FF	On-Demand	Anodyne	ADCYAP1R1	42	36
CC(C)(C)OC(=O)CS(=O)(=O)CCNCc1ccc(O)c(Cl)c1	ZINC000872248680	FD	On-Demand	Anodyne	NCE103	15	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	ADRB2	56	53
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	ADRB1	110	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	MAOB	32	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	GRIN1	29	56
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	ADRB3	81	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	ABCB1	30	55
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248689	GE	On-Demand	Anodyne	PDS	88	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	ADRB2	56	53
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	ADRB1	110	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	MAOB	32	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	GRIN1	29	56
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	ADRB3	81	52
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	ABCB1	30	55
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248690	GE	On-Demand	Anodyne	PDS	88	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	ADRB2	56	53
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	ADRB1	110	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	MAOB	32	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	GRIN1	29	56
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	ADRB3	81	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	ABCB1	30	55
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248691	GE	On-Demand	Anodyne	PDS	88	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	ADRB2	56	53
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	ADRB1	110	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	MAOB	32	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	GRIN1	29	56
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	ADRB3	81	52
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	ABCB1	30	55
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000872248692	GE	On-Demand	Anodyne	PDS	88	42
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248693	FF	On-Demand	Anodyne	PGC	50	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248693	FF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248693	FF	On-Demand	Anodyne	FPR1	46	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248693	FF	On-Demand	Anodyne	Q82323_9DELA	71	31
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248694	FF	On-Demand	Anodyne	PGC	50	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248694	FF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248694	FF	On-Demand	Anodyne	FPR1	46	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248694	FF	On-Demand	Anodyne	Q82323_9DELA	71	31
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248695	FF	On-Demand	Anodyne	PGC	50	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248695	FF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248695	FF	On-Demand	Anodyne	FPR1	46	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248695	FF	On-Demand	Anodyne	Q82323_9DELA	71	31
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248696	FF	On-Demand	Anodyne	PGC	50	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248696	FF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248696	FF	On-Demand	Anodyne	FPR1	46	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)C[C@H]1C2	ZINC000872248696	FF	On-Demand	Anodyne	Q82323_9DELA	71	31
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248708	DD	On-Demand	Anodyne	ADRB2	46	57
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248708	DD	On-Demand	Anodyne	ADRB1	60	42
O[C@H]1C[C@H](CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248708	DD	On-Demand	Anodyne	ADRB3	39	42
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248709	DD	On-Demand	Anodyne	ADRB2	46	57
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248709	DD	On-Demand	Anodyne	ADRB1	60	42
O[C@H]1C[C@H](CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000872248709	DD	On-Demand	Anodyne	ADRB3	39	42
C=CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c(OC)c1	ZINC000872248710	DD	On-Demand	Mild	ADRB2	15	43
C=CCc1ccc(OC[C@H](O)CNC[C@H]2C[C@H](O)C2)c(OC)c1	ZINC000872248710	DD	On-Demand	Mild	ADRB1	15	42
C=CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c(OC)c1	ZINC000872248711	DD	On-Demand	Mild	ADRB2	15	43
C=CCc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H](O)C2)c(OC)c1	ZINC000872248711	DD	On-Demand	Mild	ADRB1	15	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248718	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248718	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248718	FE	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248719	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248719	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000872248719	FE	On-Demand	Anodyne	ABCB1	15	46
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248720	FE	On-Demand	Anodyne	ADRB2	62	47
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248720	FE	On-Demand	Anodyne	ADRB3	60	44
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248721	FE	On-Demand	Anodyne	ADRB2	62	47
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248721	FE	On-Demand	Anodyne	ADRB3	60	44
O[C@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248728	DF	On-Demand	Anodyne	ADRB2	39	41
O[C@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248728	DF	On-Demand	Anodyne	ADRB1	56	46
O[C@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248728	DF	On-Demand	Anodyne	ADRB3	74	46
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)c1ccccc1	ZINC000872248729	DF	On-Demand	Anodyne	ADRB2	39	41
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)c1ccccc1	ZINC000872248729	DF	On-Demand	Anodyne	ADRB1	56	46
O[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)c1ccccc1	ZINC000872248729	DF	On-Demand	Anodyne	ADRB3	74	46
O[C@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248730	DF	On-Demand	Anodyne	ADRB2	39	41
O[C@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248730	DF	On-Demand	Anodyne	ADRB1	56	46
O[C@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248730	DF	On-Demand	Anodyne	ADRB3	74	46
O[C@@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248731	DF	On-Demand	Anodyne	ADRB2	39	41
O[C@@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248731	DF	On-Demand	Anodyne	ADRB1	56	46
O[C@@H](CNC[C@H](O)c1ccccc1)Cc1cccc(Cl)c1	ZINC000872248731	DF	On-Demand	Anodyne	ADRB3	74	46
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872248735	DD	On-Demand	Anodyne	ADRB2	38	63
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872248735	DD	On-Demand	Anodyne	ADRB1	62	39
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872248735	DD	On-Demand	Anodyne	ADRB3	22	57
O[C@H]1C[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000872248735	DD	On-Demand	Anodyne	ABCB1	24	41
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872248736	DD	On-Demand	Anodyne	ADRB2	38	63
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872248736	DD	On-Demand	Anodyne	ADRB1	62	39
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872248736	DD	On-Demand	Anodyne	ADRB3	22	57
O[C@H]1C[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000872248736	DD	On-Demand	Anodyne	ABCB1	24	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248751	ED	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248751	ED	On-Demand	Anodyne	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248751	ED	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248752	ED	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248752	ED	On-Demand	Anodyne	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248752	ED	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248753	ED	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248753	ED	On-Demand	Anodyne	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248753	ED	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248754	ED	On-Demand	Anodyne	ADRB2	37	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248754	ED	On-Demand	Anodyne	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248754	ED	On-Demand	Anodyne	ADRB3	47	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000872248779	ED	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872248780	ED	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000872248781	ED	On-Demand	Bother	ADRB1	40	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872248782	ED	On-Demand	Bother	ADRB1	40	32
CS(=O)(=O)c1ccc([C@@H](O)CNCC(F)(F)c2ccc(F)cc2F)cc1	ZINC000872248806	GF	On-Demand	Anodyne	CTSF	50	33
CS(=O)(=O)c1ccc([C@H](O)CNCC(F)(F)c2ccc(F)cc2F)cc1	ZINC000872248807	GF	On-Demand	Anodyne	CTSF	50	33
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248828	EE	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872248828	EE	On-Demand	Anodyne	ADRB1	53	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248829	EE	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872248829	EE	On-Demand	Anodyne	ADRB1	53	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248830	EE	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872248830	EE	On-Demand	Anodyne	ADRB1	53	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248831	EE	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872248831	EE	On-Demand	Anodyne	ADRB1	53	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248860	GF	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248860	GF	On-Demand	Anodyne	ADRB1	49	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248860	GF	On-Demand	Anodyne	ADRB3	34	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248861	GF	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248861	GF	On-Demand	Anodyne	ADRB1	49	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248861	GF	On-Demand	Anodyne	ADRB3	34	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248862	GF	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248862	GF	On-Demand	Anodyne	ADRB1	49	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248862	GF	On-Demand	Anodyne	ADRB3	34	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248863	GF	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248863	GF	On-Demand	Anodyne	ADRB1	49	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]1C2	ZINC000872248863	GF	On-Demand	Anodyne	ADRB3	34	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248866	FE	On-Demand	Anodyne	ADRB2	63	48
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248866	FE	On-Demand	Anodyne	ADRB1	92	48
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248866	FE	On-Demand	Anodyne	GRIN1	31	48
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248866	FE	On-Demand	Anodyne	ADRB3	65	48
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248866	FE	On-Demand	Anodyne	ADCYAP1R1	66	36
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248867	FE	On-Demand	Anodyne	ADRB2	63	48
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248867	FE	On-Demand	Anodyne	ADRB1	92	48
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248867	FE	On-Demand	Anodyne	GRIN1	31	48
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248867	FE	On-Demand	Anodyne	ADRB3	65	48
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(O)c(Cl)c2)cc1	ZINC000872248867	FE	On-Demand	Anodyne	ADCYAP1R1	66	36
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3F)C[C@H]1C2	ZINC000872248869	GF	On-Demand	Anodyne	ADRB2	21	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)COc3ccccc3F)C[C@H]1C2	ZINC000872248870	GF	On-Demand	Anodyne	ADRB2	21	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)COc3ccccc3F)C[C@H]1C2	ZINC000872248871	GF	On-Demand	Anodyne	ADRB2	21	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3F)C[C@H]1C2	ZINC000872248872	GF	On-Demand	Anodyne	ADRB2	21	41
COc1ccc(OC)c([C@H](O)CNC[C@@H](CO)c2ccc(Cl)cc2)c1	ZINC000872248883	FF	On-Demand	Anodyne	ADRB1	15	43
COc1ccc(OC)c([C@H](O)CNC[C@@H](CO)c2ccc(Cl)cc2)c1	ZINC000872248883	FF	On-Demand	Anodyne	ADRB3	20	43
COc1ccc(OC)c([C@H](O)CNC[C@H](CO)c2ccc(Cl)cc2)c1	ZINC000872248886	FF	On-Demand	Anodyne	ADRB1	15	43
COc1ccc(OC)c([C@H](O)CNC[C@H](CO)c2ccc(Cl)cc2)c1	ZINC000872248886	FF	On-Demand	Anodyne	ADRB3	20	43
CC(=O)Nc1ccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248896	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248896	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248896	GE	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248897	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248897	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CC(C(=O)OC(C)(C)C)C2)cc1	ZINC000872248897	GE	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)COc1cccc2[nH]ccc12	ZINC000872248944	EE	On-Demand	Anodyne	ADRB1	26	59
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)COc1cccc2[nH]ccc12	ZINC000872248945	EE	On-Demand	Anodyne	ADRB1	26	59
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)COc1cccc2[nH]ccc12	ZINC000872248946	EE	On-Demand	Anodyne	ADRB1	26	59
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)COc1cccc2[nH]ccc12	ZINC000872248947	EE	On-Demand	Anodyne	ADRB1	26	59
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248956	CF	On-Demand	Anodyne	ADRB2	53	50
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248956	CF	On-Demand	Anodyne	ADRB1	85	47
O[C@@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248956	CF	On-Demand	Anodyne	ADRB3	57	47
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248957	CF	On-Demand	Anodyne	ADRB2	53	50
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248957	CF	On-Demand	Anodyne	ADRB1	85	47
O[C@@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248957	CF	On-Demand	Anodyne	ADRB3	57	47
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248958	CF	On-Demand	Anodyne	ADRB2	53	50
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248958	CF	On-Demand	Anodyne	ADRB1	85	47
O[C@H](CNCCC[C@@H]1C=CCC1)COc1ccccc1	ZINC000872248958	CF	On-Demand	Anodyne	ADRB3	57	47
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248959	CF	On-Demand	Anodyne	ADRB2	53	50
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248959	CF	On-Demand	Anodyne	ADRB1	85	47
O[C@H](CNCCC[C@H]1C=CCC1)COc1ccccc1	ZINC000872248959	CF	On-Demand	Anodyne	ADRB3	57	47
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248993	CF	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248993	CF	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248993	CF	On-Demand	Anodyne	CYP3A4	40	32
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248994	CF	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248994	CF	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248994	CF	On-Demand	Anodyne	CYP3A4	40	32
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248995	CF	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248995	CF	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1cccc(Cl)c1	ZINC000872248995	CF	On-Demand	Anodyne	CYP3A4	40	32
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248996	CF	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248996	CF	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNC[C@@H]1C[C@H]2CCC[C@H]2O1)c1cccc(Cl)c1	ZINC000872248996	CF	On-Demand	Anodyne	CYP3A4	40	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872249013	DF	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872249013	DF	On-Demand	Bother	ADRB1	48	36
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872249014	DF	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC[C@H]1C=CCC1	ZINC000872249014	DF	On-Demand	Bother	ADRB1	48	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872249015	DF	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC[C@@H]1C=CCC1	ZINC000872249015	DF	On-Demand	Bother	ADRB1	48	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872249016	DF	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC[C@H]1C=CCC1	ZINC000872249016	DF	On-Demand	Bother	ADRB1	48	36
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872249027	FE	On-Demand	Anodyne	ADRB2	37	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872249027	FE	On-Demand	Anodyne	ADRB1	69	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1	ZINC000872249027	FE	On-Demand	Anodyne	ADRB3	45	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872249028	FE	On-Demand	Anodyne	ADRB2	37	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872249028	FE	On-Demand	Anodyne	ADRB1	69	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1	ZINC000872249028	FE	On-Demand	Anodyne	ADRB3	45	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872249029	FE	On-Demand	Anodyne	ADRB2	37	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872249029	FE	On-Demand	Anodyne	ADRB1	69	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CCC[C@H]3O2)cc1	ZINC000872249029	FE	On-Demand	Anodyne	ADRB3	45	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872249030	FE	On-Demand	Anodyne	ADRB2	37	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872249030	FE	On-Demand	Anodyne	ADRB1	69	49
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1	ZINC000872249030	FE	On-Demand	Anodyne	ADRB3	45	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249052	FG	On-Demand	Mild	ADRB2	32	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249052	FG	On-Demand	Mild	ADRB1	53	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249052	FG	On-Demand	Mild	ADRB3	33	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249053	FG	On-Demand	Mild	ADRB2	32	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249053	FG	On-Demand	Mild	ADRB1	53	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C(F)(F)F)s2)cc1	ZINC000872249053	FG	On-Demand	Mild	ADRB3	33	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249058	EF	On-Demand	Anodyne	ADRB2	45	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249058	EF	On-Demand	Anodyne	ADRB1	88	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249058	EF	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249058	EF	On-Demand	Anodyne	ADRB3	57	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249059	EF	On-Demand	Anodyne	ADRB2	45	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249059	EF	On-Demand	Anodyne	ADRB1	88	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249059	EF	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249059	EF	On-Demand	Anodyne	ADRB3	57	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249060	EF	On-Demand	Anodyne	ADRB2	45	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249060	EF	On-Demand	Anodyne	ADRB1	88	55
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249060	EF	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCC[C@@H]2C=CCC2)cc1	ZINC000872249060	EF	On-Demand	Anodyne	ADRB3	57	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249061	EF	On-Demand	Anodyne	ADRB2	45	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249061	EF	On-Demand	Anodyne	ADRB1	88	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249061	EF	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC[C@H]2C=CCC2)cc1	ZINC000872249061	EF	On-Demand	Anodyne	ADRB3	57	55
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249094	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249094	FE	On-Demand	Anodyne	ADRB1	41	38
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249095	FE	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249095	FE	On-Demand	Anodyne	ADRB1	41	38
C[C@H](NC[C@H](O)COc1ccccc1F)c1ccc(C(F)(F)F)nc1	ZINC000872249122	FG	On-Demand	Anodyne	ADRB2	27	47
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccc(C(F)(F)F)nc1	ZINC000872249123	FG	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249126	GG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249126	GG	On-Demand	Anodyne	ADRB1	24	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249127	GG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249127	GG	On-Demand	Anodyne	ADRB1	24	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249128	GG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249128	GG	On-Demand	Anodyne	ADRB1	24	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249129	GG	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000872249129	GG	On-Demand	Anodyne	ADRB1	24	43
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1	ZINC000872249176	GH	On-Demand	Bother	COLA	79	35
Cc1nccnc1[C@@H](C)NC[C@H](O)COC(C)C	ZINC000872249210	CD	On-Demand	Anodyne	ADRB2	19	50
Cc1nccnc1[C@H](C)NC[C@@H](O)COC(C)C	ZINC000872249211	CD	On-Demand	Anodyne	ADRB2	19	50
Cc1nccnc1[C@H](C)NC[C@H](O)COC(C)C	ZINC000872249212	CD	On-Demand	Anodyne	ADRB2	19	50
Cc1nccnc1[C@@H](C)NC[C@@H](O)COC(C)C	ZINC000872249213	CD	On-Demand	Anodyne	ADRB2	19	50
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249214	FG	On-Demand	Anodyne	ADRB2	31	47
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249214	FG	On-Demand	Anodyne	ADRB1	28	43
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249214	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249215	FG	On-Demand	Anodyne	ADRB2	31	47
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249215	FG	On-Demand	Anodyne	ADRB1	28	43
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249215	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000872249241	DG	On-Demand	Bother	COLA	94	34
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249250	EF	On-Demand	Anodyne	ADRB2	28	49
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249250	EF	On-Demand	Anodyne	ADRB1	25	44
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249251	EF	On-Demand	Anodyne	ADRB2	28	49
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249251	EF	On-Demand	Anodyne	ADRB1	25	44
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249252	EF	On-Demand	Anodyne	ADRB2	28	49
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249252	EF	On-Demand	Anodyne	ADRB1	25	44
CSc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249253	EF	On-Demand	Anodyne	ADRB2	28	49
CSc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249253	EF	On-Demand	Anodyne	ADRB1	25	44
C[C@H](NC[C@H](O)COCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249254	FG	On-Demand	Anodyne	ADRB2	17	41
C[C@@H](NC[C@@H](O)COCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249256	FG	On-Demand	Anodyne	ADRB2	17	41
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249263	FG	On-Demand	Mild	ADRB2	23	61
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249263	FG	On-Demand	Mild	ADRB1	70	44
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249263	FG	On-Demand	Mild	CASR	43	45
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249263	FG	On-Demand	Mild	CYP2D6	20	46
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249265	FG	On-Demand	Mild	ADRB2	23	61
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249265	FG	On-Demand	Mild	ADRB1	70	44
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249265	FG	On-Demand	Mild	CASR	43	45
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(C(F)(F)F)nc1	ZINC000872249265	FG	On-Demand	Mild	CYP2D6	20	46
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249290	GG	On-Demand	Mild	ADRB2	29	43
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249290	GG	On-Demand	Mild	ADRB1	28	43
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249290	GG	On-Demand	Mild	ADRB3	18	41
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249292	GG	On-Demand	Mild	ADRB2	29	43
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249292	GG	On-Demand	Mild	ADRB1	28	43
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249292	GG	On-Demand	Mild	ADRB3	18	41
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249312	DD	On-Demand	Mild	ADRB2	32	69
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249312	DD	On-Demand	Mild	ADRB1	81	48
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249312	DD	On-Demand	Mild	CASR	45	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249312	DD	On-Demand	Mild	CYP2D6	21	48
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249313	DD	On-Demand	Mild	ADRB2	32	69
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249313	DD	On-Demand	Mild	ADRB1	81	48
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249313	DD	On-Demand	Mild	CASR	45	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249313	DD	On-Demand	Mild	CYP2D6	21	48
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249314	DD	On-Demand	Mild	ADRB2	32	69
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249314	DD	On-Demand	Mild	ADRB1	81	48
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249314	DD	On-Demand	Mild	CASR	45	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000872249314	DD	On-Demand	Mild	CYP2D6	21	48
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249315	DD	On-Demand	Mild	ADRB2	32	69
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249315	DD	On-Demand	Mild	ADRB1	81	48
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249315	DD	On-Demand	Mild	CASR	45	47
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000872249315	DD	On-Demand	Mild	CYP2D6	21	48
C[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)c1ccc(C(F)(F)F)nc1	ZINC000872249326	GF	On-Demand	Anodyne	TRPV1	75	35
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249328	GG	On-Demand	Anodyne	ADRB2	42	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249328	GG	On-Demand	Anodyne	ADRB1	64	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249328	GG	On-Demand	Anodyne	ADRB3	43	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249329	GG	On-Demand	Anodyne	ADRB2	42	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249329	GG	On-Demand	Anodyne	ADRB1	64	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249329	GG	On-Demand	Anodyne	ADRB3	43	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249330	GG	On-Demand	Anodyne	ADRB2	42	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249330	GG	On-Demand	Anodyne	ADRB1	64	60
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249330	GG	On-Demand	Anodyne	ADRB3	43	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249331	GG	On-Demand	Anodyne	ADRB2	42	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249331	GG	On-Demand	Anodyne	ADRB1	64	60
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249331	GG	On-Demand	Anodyne	ADRB3	43	45
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249332	DG	On-Demand	Anodyne	ADRB2	15	41
C[C@H](NC[C@H](O)c1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249333	DG	On-Demand	Anodyne	ADRB2	15	41
C[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(C(F)(F)F)nc1	ZINC000872249340	GG	On-Demand	Anodyne	TRPM8	16	44
C[C@@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1ccc(C(F)(F)F)nc1	ZINC000872249341	GG	On-Demand	Anodyne	TRPM8	16	44
C[C@@H](NCCC(N)=O)c1ccc(C(F)(F)F)nc1	ZINC000872249350	CD	On-Demand	Anodyne	TRPV1	75	35
C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249356	GF	On-Demand	Anodyne	PTGS2	28	41
C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249356	GF	On-Demand	Anodyne	TRPV1	47	31
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249357	GF	On-Demand	Anodyne	PTGS2	28	41
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249357	GF	On-Demand	Anodyne	TRPV1	47	31
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249373	EG	On-Demand	Anodyne	ADRB2	49	55
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249373	EG	On-Demand	Anodyne	ADRB1	49	42
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249373	EG	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249375	EG	On-Demand	Anodyne	ADRB2	49	55
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249375	EG	On-Demand	Anodyne	ADRB1	49	42
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000872249375	EG	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](NCCC(=O)Nc1ccccc1F)c1ccc(C(F)(F)F)nc1	ZINC000872249378	FH	On-Demand	Anodyne	TRPV1	76	34
C[C@@H](NCCS(=O)(=O)c1ccc(F)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249408	GG	On-Demand	Anodyne	TRPV1	54	35
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249410	GG	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249410	GG	On-Demand	Anodyne	ADRB1	30	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249411	GG	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249411	GG	On-Demand	Anodyne	ADRB1	30	45
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249412	GG	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249412	GG	On-Demand	Anodyne	ADRB1	30	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249413	GG	On-Demand	Anodyne	ADRB2	29	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249413	GG	On-Demand	Anodyne	ADRB1	30	45
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1	ZINC000872249414	GG	On-Demand	Bother	ADRB2	22	43
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1	ZINC000872249414	GG	On-Demand	Bother	ADRB1	48	34
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1	ZINC000872249415	GG	On-Demand	Bother	ADRB2	22	43
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1	ZINC000872249415	GG	On-Demand	Bother	ADRB1	48	34
C[C@@H](CN[C@H](C)c1ccc(C(F)(F)F)nc1)S(C)(=O)=O	ZINC000872249421	DE	On-Demand	Anodyne	TRPV1	43	32
C[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(C(F)(F)F)nc1	ZINC000872249422	DE	On-Demand	Anodyne	TRPV1	43	32
C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(C(F)(F)F)nc1	ZINC000872249423	DE	On-Demand	Anodyne	TRPV1	43	32
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249463	FG	On-Demand	Anodyne	ADRB2	31	56
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249463	FG	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249464	FG	On-Demand	Anodyne	ADRB2	31	56
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249464	FG	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249465	FG	On-Demand	Anodyne	ADRB2	31	56
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249465	FG	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249466	FG	On-Demand	Anodyne	ADRB2	31	56
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249466	FG	On-Demand	Anodyne	ADRB1	25	43
CON(C)C(=O)CCN[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872249481	DE	On-Demand	Anodyne	TRPV1	50	33
CON(C)C(=O)CCN[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872249482	DE	On-Demand	Anodyne	TRPV1	50	33
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249488	GF	On-Demand	Anodyne	ADRB2	36	51
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249488	GF	On-Demand	Anodyne	ADRB1	40	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249489	GF	On-Demand	Anodyne	ADRB2	36	51
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249489	GF	On-Demand	Anodyne	ADRB1	40	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249490	GF	On-Demand	Anodyne	ADRB2	36	51
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249490	GF	On-Demand	Anodyne	ADRB1	40	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249491	GF	On-Demand	Anodyne	ADRB2	36	51
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000872249491	GF	On-Demand	Anodyne	ADRB1	40	42
Cc1c(F)cccc1NC(=O)CCN[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872249496	FI	On-Demand	Anodyne	TRPV1	66	32
Cc1c(F)cccc1NC(=O)CCN[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000872249497	FI	On-Demand	Anodyne	TRPV1	66	32
COC[C@@H](C)OC[C@@H](O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872249512	DD	On-Demand	Bother	COLA	48	31
COC[C@@H](C)OC[C@H](O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872249513	DD	On-Demand	Bother	COLA	48	31
COC[C@@H](C)OC[C@H](O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872249514	DD	On-Demand	Bother	COLA	48	31
COC[C@@H](C)OC[C@@H](O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000872249515	DD	On-Demand	Bother	COLA	48	31
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249527	FG	On-Demand	Mild	ADRB2	21	45
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(C(F)(F)F)nc1	ZINC000872249529	FG	On-Demand	Mild	ADRB2	21	45
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)nc1	ZINC000872249535	GH	On-Demand	Anodyne	ADRB2	20	63
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)nc1	ZINC000872249535	GH	On-Demand	Anodyne	ADRB1	24	63
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)nc1	ZINC000872249537	GH	On-Demand	Anodyne	ADRB2	20	63
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)nc1	ZINC000872249537	GH	On-Demand	Anodyne	ADRB1	24	63
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249552	EI	On-Demand	Anodyne	ADRB1	30	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249552	EI	On-Demand	Anodyne	ADRB3	43	46
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249554	EI	On-Demand	Anodyne	ADRB1	30	46
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249554	EI	On-Demand	Anodyne	ADRB3	43	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249593	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249593	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249593	FE	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249594	FE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249594	FE	On-Demand	Anodyne	ADRB1	33	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000872249594	FE	On-Demand	Anodyne	ABCB1	15	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249599	FG	On-Demand	Anodyne	ADRB2	20	48
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249599	FG	On-Demand	Anodyne	ADRB1	15	42
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249600	FG	On-Demand	Anodyne	ADRB2	20	48
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249600	FG	On-Demand	Anodyne	ADRB1	15	42
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249601	FG	On-Demand	Anodyne	ADRB2	20	48
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249601	FG	On-Demand	Anodyne	ADRB1	15	42
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249602	FG	On-Demand	Anodyne	ADRB2	20	48
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000872249602	FG	On-Demand	Anodyne	ADRB1	15	42
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249604	GG	On-Demand	Bother	ADRB2	20	42
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249604	GG	On-Demand	Bother	ADRB1	19	42
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249604	GG	On-Demand	Bother	PDS	33	40
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249605	GG	On-Demand	Bother	ADRB2	20	42
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249605	GG	On-Demand	Bother	ADRB1	19	42
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1	ZINC000872249605	GG	On-Demand	Bother	PDS	33	40
Cc1nccnc1[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872249610	FE	On-Demand	Anodyne	GPR119	71	47
Cc1nccnc1[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872249611	FE	On-Demand	Anodyne	GPR119	71	47
Cc1nccnc1[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872249612	FE	On-Demand	Anodyne	GPR119	71	47
Cc1nccnc1[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872249613	FE	On-Demand	Anodyne	GPR119	71	47
C[C@H](NC[C@H](O)c1ccc(F)c(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249625	EH	On-Demand	Anodyne	TRPV1	54	32
C[C@@H](NC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000872249626	EH	On-Demand	Anodyne	TRPV1	54	32
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249637	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249637	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249637	GE	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249638	GE	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249638	GE	On-Demand	Anodyne	ADRB1	72	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000872249638	GE	On-Demand	Anodyne	ADRB3	47	48
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000872249646	FG	On-Demand	Anodyne	ADRB2	19	54
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000872249646	FG	On-Demand	Anodyne	ADRB3	23	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249647	EE	On-Demand	Anodyne	ADRB2	42	54
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249647	EE	On-Demand	Anodyne	ADRB1	54	50
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249647	EE	On-Demand	Anodyne	ADRB3	28	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249648	EE	On-Demand	Anodyne	ADRB2	42	54
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249648	EE	On-Demand	Anodyne	ADRB1	54	50
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249648	EE	On-Demand	Anodyne	ADRB3	28	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249649	EE	On-Demand	Anodyne	ADRB2	42	54
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249649	EE	On-Demand	Anodyne	ADRB1	54	50
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872249649	EE	On-Demand	Anodyne	ADRB3	28	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249650	EE	On-Demand	Anodyne	ADRB2	42	54
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249650	EE	On-Demand	Anodyne	ADRB1	54	50
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872249650	EE	On-Demand	Anodyne	ADRB3	28	44
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2ccccc2)c1	ZINC000872249692	FF	On-Demand	Anodyne	LTA4H	24	41
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2ccccc2)c1	ZINC000872249692	FF	On-Demand	Anodyne	MTNR1A	58	42
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2ccccc2)c1	ZINC000872249692	FF	On-Demand	Anodyne	MTNR1B	62	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COC2CCOCC2)c1	ZINC000872249696	FD	On-Demand	Anodyne	ADRB2	15	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COC2CCOCC2)c1	ZINC000872249696	FD	On-Demand	Anodyne	ADRB1	17	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COC2CCOCC2)c1	ZINC000872249697	FD	On-Demand	Anodyne	ADRB2	15	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COC2CCOCC2)c1	ZINC000872249697	FD	On-Demand	Anodyne	ADRB1	17	40
CC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249731	CD	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249731	CD	On-Demand	Anodyne	CASR	26	41
CC[C@@H](NC[C@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249731	CD	On-Demand	Anodyne	AOC3	17	43
CC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249732	CD	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249732	CD	On-Demand	Anodyne	CASR	26	41
CC[C@@H](NC[C@@H](O)COC(C)C)[C@H](O)c1ccccc1	ZINC000872249732	CD	On-Demand	Anodyne	AOC3	17	43
CC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249735	CD	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249735	CD	On-Demand	Anodyne	CASR	26	41
CC[C@@H](NC[C@@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249735	CD	On-Demand	Anodyne	AOC3	17	43
CC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249738	CD	On-Demand	Anodyne	ADRB2	28	49
CC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249738	CD	On-Demand	Anodyne	CASR	26	41
CC[C@@H](NC[C@H](O)COC(C)C)[C@@H](O)c1ccccc1	ZINC000872249738	CD	On-Demand	Anodyne	AOC3	17	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872249739	CE	On-Demand	Anodyne	ADRB2	52	46
CCOc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872249739	CE	On-Demand	Anodyne	ADRB1	61	46
CCOc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872249740	CE	On-Demand	Anodyne	ADRB2	52	46
CCOc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872249740	CE	On-Demand	Anodyne	ADRB1	61	46
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872249741	CE	On-Demand	Anodyne	ADRB2	52	46
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872249741	CE	On-Demand	Anodyne	ADRB1	61	46
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872249742	CE	On-Demand	Anodyne	ADRB2	52	46
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872249742	CE	On-Demand	Anodyne	ADRB1	61	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CC12CCC2	ZINC000872249763	CD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CC12CCC2	ZINC000872249763	CD	On-Demand	Bother	ADRB1	51	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CC12CCC2	ZINC000872249764	CD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CC12CCC2	ZINC000872249764	CD	On-Demand	Bother	ADRB1	51	33
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CC12CCC2	ZINC000872249765	CD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CC12CCC2	ZINC000872249765	CD	On-Demand	Bother	ADRB1	51	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CC12CCC2	ZINC000872249766	CD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CC12CCC2	ZINC000872249766	CD	On-Demand	Bother	ADRB1	51	33
Cc1nccnc1[C@@H](C)NCCC(=O)NC(=O)NCc1ccccc1	ZINC000872249775	ED	On-Demand	Anodyne	PDS	42	33
Cc1nccnc1[C@H](C)NCCC(=O)NC(=O)NCc1ccccc1	ZINC000872249776	ED	On-Demand	Anodyne	PDS	42	33
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249781	EG	On-Demand	Anodyne	ADRB2	37	50
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249781	EG	On-Demand	Anodyne	ADRB1	34	45
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249781	EG	On-Demand	Anodyne	ADRB3	16	45
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249783	EG	On-Demand	Anodyne	ADRB2	37	50
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249783	EG	On-Demand	Anodyne	ADRB1	34	45
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249783	EG	On-Demand	Anodyne	ADRB3	16	45
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249784	EG	On-Demand	Anodyne	ADRB2	37	50
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249784	EG	On-Demand	Anodyne	ADRB1	34	45
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872249784	EG	On-Demand	Anodyne	ADRB3	16	45
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000872249794	EF	On-Demand	Anodyne	ADRB2	16	54
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000872249795	EF	On-Demand	Anodyne	ADRB2	16	54
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872249809	FG	On-Demand	Anodyne	ADRB2	27	41
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872249809	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872249810	FG	On-Demand	Anodyne	ADRB2	27	41
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872249810	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1nccnc1[C@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872249811	FG	On-Demand	Anodyne	ADRB2	27	41
Cc1nccnc1[C@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872249811	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872249812	FG	On-Demand	Anodyne	ADRB2	27	41
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872249812	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000872249825	FG	On-Demand	Anodyne	EGFR	45	44
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000872249825	FG	On-Demand	Anodyne	HDAC10	18	42
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000872249826	FG	On-Demand	Anodyne	EGFR	45	44
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000872249826	FG	On-Demand	Anodyne	HDAC10	18	42
CCOC1CC2(C1)C[C@@H]2NCC1(O)CCC(c2ccccc2)CC1	ZINC000872249879	EH	On-Demand	Anodyne	TIMP3	54	32
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000872249884	EE	On-Demand	Mild	ADRB1	21	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000872249885	EE	On-Demand	Mild	ADRB1	21	41
Cc1nonc1CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000872249887	DC	On-Demand	Anodyne	CASP3	21	43
Cc1nonc1CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000872249887	DC	On-Demand	Anodyne	CASP8	20	43
Cc1nonc1CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000872249887	DC	On-Demand	Anodyne	CASP1	16	43
Cc1nonc1CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000872249887	DC	On-Demand	Anodyne	CASP7	21	43
Cc1nonc1CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872249891	DC	On-Demand	Anodyne	CASP3	21	43
Cc1nonc1CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872249891	DC	On-Demand	Anodyne	CASP8	20	43
Cc1nonc1CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872249891	DC	On-Demand	Anodyne	CASP1	16	43
Cc1nonc1CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872249891	DC	On-Demand	Anodyne	CASP7	21	43
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000872249893	CD	On-Demand	Anodyne	ADRB2	48	51
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000872249893	CD	On-Demand	Anodyne	ADRB1	59	39
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000872249893	CD	On-Demand	Anodyne	TIMP3	44	33
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000872249899	CD	On-Demand	Anodyne	ADRB2	48	51
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000872249899	CD	On-Demand	Anodyne	ADRB1	59	39
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000872249899	CD	On-Demand	Anodyne	TIMP3	44	33
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249902	DE	On-Demand	Mild	ADRB2	21	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249902	DE	On-Demand	Mild	ADRB1	20	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249902	DE	On-Demand	Mild	ADRB3	18	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249903	DE	On-Demand	Mild	ADRB2	21	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249903	DE	On-Demand	Mild	ADRB1	20	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000872249903	DE	On-Demand	Mild	ADRB3	18	41
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872249923	DD	On-Demand	Mild	ADRB2	29	49
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872249923	DD	On-Demand	Mild	ADRB1	51	40
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000872249926	DD	On-Demand	Mild	ADRB2	29	49
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000872249926	DD	On-Demand	Mild	ADRB1	51	40
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872249930	DD	On-Demand	Mild	ADRB2	29	49
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000872249930	DD	On-Demand	Mild	ADRB1	51	40
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000872249933	DD	On-Demand	Mild	ADRB2	29	49
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000872249933	DD	On-Demand	Mild	ADRB1	51	40
Cc1nonc1CNC[C@@H](O)COc1ccccc1	ZINC000872249946	CC	On-Demand	Anodyne	ADRB2	55	56
Cc1nonc1CNC[C@@H](O)COc1ccccc1	ZINC000872249946	CC	On-Demand	Anodyne	ADRB1	67	44
Cc1nonc1CNC[C@@H](O)COc1ccccc1	ZINC000872249946	CC	On-Demand	Anodyne	ADRB3	42	44
Cc1nonc1CNC[C@H](O)COc1ccccc1	ZINC000872249947	CC	On-Demand	Anodyne	ADRB2	55	56
Cc1nonc1CNC[C@H](O)COc1ccccc1	ZINC000872249947	CC	On-Demand	Anodyne	ADRB1	67	44
Cc1nonc1CNC[C@H](O)COc1ccccc1	ZINC000872249947	CC	On-Demand	Anodyne	ADRB3	42	44
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249954	ED	On-Demand	Anodyne	ADRB2	30	48
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249954	ED	On-Demand	Anodyne	ADRB1	48	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249954	ED	On-Demand	Anodyne	ADRB3	27	40
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1Cl	ZINC000872249956	DF	On-Demand	Anodyne	ADRB2	35	51
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1Cl	ZINC000872249956	DF	On-Demand	Anodyne	ADRB1	54	39
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249957	ED	On-Demand	Anodyne	ADRB2	30	48
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249957	ED	On-Demand	Anodyne	ADRB1	48	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000872249957	ED	On-Demand	Anodyne	ADRB3	27	40
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1Cl	ZINC000872249959	DF	On-Demand	Anodyne	ADRB2	35	51
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1Cl	ZINC000872249959	DF	On-Demand	Anodyne	ADRB1	54	39
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1Cl	ZINC000872249962	DF	On-Demand	Anodyne	ADRB2	35	51
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1Cl	ZINC000872249962	DF	On-Demand	Anodyne	ADRB1	54	39
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1Cl	ZINC000872249966	DF	On-Demand	Anodyne	ADRB2	35	51
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1Cl	ZINC000872249966	DF	On-Demand	Anodyne	ADRB1	54	39
Cc1nonc1CNC[C@H](O)COc1ccccc1F	ZINC000872249979	CD	On-Demand	Anodyne	ADRB2	24	46
Cc1nonc1CNC[C@H](O)COc1ccccc1F	ZINC000872249979	CD	On-Demand	Anodyne	ADRB1	57	38
Cc1nonc1CNC[C@@H](O)COc1ccccc1F	ZINC000872249980	CD	On-Demand	Anodyne	ADRB2	24	46
Cc1nonc1CNC[C@@H](O)COc1ccccc1F	ZINC000872249980	CD	On-Demand	Anodyne	ADRB1	57	38
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2cccc(F)c2C)c1	ZINC000872249992	GG	On-Demand	Anodyne	C5AR1	15	40
C#C[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872249996	CG	On-Demand	Mild	ADRB1	33	44
C#C[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000872249996	CG	On-Demand	Mild	ADRB3	49	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872249997	CG	On-Demand	Mild	ADRB1	33	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000872249997	CG	On-Demand	Mild	ADRB3	49	48
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCc2ccccc2)c1	ZINC000872249998	FF	On-Demand	Anodyne	ADRB2	29	53
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCc2ccccc2)c1	ZINC000872249998	FF	On-Demand	Anodyne	ADRB1	23	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCc2ccccc2)c1	ZINC000872249998	FF	On-Demand	Anodyne	ADRB3	21	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCc2ccccc2)c1	ZINC000872249998	FF	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCc2ccccc2)c1	ZINC000872249998	FF	On-Demand	Anodyne	MTNR1B	22	40
Cc1nonc1CNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872249999	EF	On-Demand	Anodyne	KIT	15	40
Cc1nonc1CNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872249999	EF	On-Demand	Anodyne	LCK	25	40
Cc1nonc1CNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872249999	EF	On-Demand	Anodyne	BTK	19	40
Cc1ccc(OC[C@H](O)CNCc2nonc2C)c(C)c1	ZINC000872250002	CD	On-Demand	Anodyne	ADRB2	17	45
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCc2ccccc2)c1	ZINC000872250003	FF	On-Demand	Anodyne	ADRB2	29	53
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCc2ccccc2)c1	ZINC000872250003	FF	On-Demand	Anodyne	ADRB1	23	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCc2ccccc2)c1	ZINC000872250003	FF	On-Demand	Anodyne	ADRB3	21	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCc2ccccc2)c1	ZINC000872250003	FF	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCc2ccccc2)c1	ZINC000872250003	FF	On-Demand	Anodyne	MTNR1B	22	40
Cc1ccc(OC[C@@H](O)CNCc2nonc2C)c(C)c1	ZINC000872250004	CD	On-Demand	Anodyne	ADRB2	17	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250021	DF	On-Demand	Mild	ADRB2	21	78
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250021	DF	On-Demand	Mild	ADRB1	28	78
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250021	DF	On-Demand	Mild	HTR1A	15	78
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250021	DF	On-Demand	Mild	SLC6A4	16	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250021	DF	On-Demand	Mild	ADRB3	17	57
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250022	DF	On-Demand	Mild	ADRB2	21	78
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250022	DF	On-Demand	Mild	ADRB1	28	78
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250022	DF	On-Demand	Mild	HTR1A	15	78
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250022	DF	On-Demand	Mild	SLC6A4	16	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000872250022	DF	On-Demand	Mild	ADRB3	17	57
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)CN(C)Cc1ccccc1	ZINC000872250030	DE	On-Demand	Anodyne	TIMP3	51	32
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)CN(C)Cc1ccccc1	ZINC000872250031	DE	On-Demand	Anodyne	TIMP3	51	32
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)Cc2ccccc2)c1	ZINC000872250032	EE	On-Demand	Anodyne	ADRB2	30	54
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)Cc2ccccc2)c1	ZINC000872250032	EE	On-Demand	Anodyne	ADRB1	20	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)Cc2ccccc2)c1	ZINC000872250032	EE	On-Demand	Anodyne	ADRB3	25	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)Cc2ccccc2)c1	ZINC000872250039	EE	On-Demand	Anodyne	ADRB2	30	54
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)Cc2ccccc2)c1	ZINC000872250039	EE	On-Demand	Anodyne	ADRB1	20	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)Cc2ccccc2)c1	ZINC000872250039	EE	On-Demand	Anodyne	ADRB3	25	43
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250048	CE	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250048	CE	On-Demand	Mild	ADRB1	61	43
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250048	CE	On-Demand	Mild	ADRB3	38	42
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250049	CE	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250049	CE	On-Demand	Mild	ADRB1	61	43
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250049	CE	On-Demand	Mild	ADRB3	38	42
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250050	CE	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250050	CE	On-Demand	Mild	ADRB1	61	43
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250050	CE	On-Demand	Mild	ADRB3	38	42
N#CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250051	CE	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250051	CE	On-Demand	Mild	ADRB1	61	43
N#CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250051	CE	On-Demand	Mild	ADRB3	38	42
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250060	CG	On-Demand	Anodyne	ADRB2	35	60
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250060	CG	On-Demand	Anodyne	ADRB1	52	40
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250060	CG	On-Demand	Anodyne	ADRB3	15	60
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250060	CG	On-Demand	Anodyne	CYP2D6	19	46
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250060	CG	On-Demand	Anodyne	ABCB1	23	40
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250061	CG	On-Demand	Anodyne	ADRB2	35	60
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250061	CG	On-Demand	Anodyne	ADRB1	52	40
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250061	CG	On-Demand	Anodyne	ADRB3	15	60
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250061	CG	On-Demand	Anodyne	CYP2D6	19	46
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250061	CG	On-Demand	Anodyne	ABCB1	23	40
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250062	CG	On-Demand	Anodyne	ADRB2	35	60
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250062	CG	On-Demand	Anodyne	ADRB1	52	40
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250062	CG	On-Demand	Anodyne	ADRB3	15	60
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250062	CG	On-Demand	Anodyne	CYP2D6	19	46
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250062	CG	On-Demand	Anodyne	ABCB1	23	40
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250063	CG	On-Demand	Anodyne	ADRB2	35	60
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250063	CG	On-Demand	Anodyne	ADRB1	52	40
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250063	CG	On-Demand	Anodyne	ADRB3	15	60
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250063	CG	On-Demand	Anodyne	CYP2D6	19	46
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2ccccc12	ZINC000872250063	CG	On-Demand	Anodyne	ABCB1	23	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250064	DD	On-Demand	Anodyne	ADRB2	56	49
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250064	DD	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250064	DD	On-Demand	Anodyne	ADRB3	51	44
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250065	DD	On-Demand	Anodyne	ADRB2	56	49
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250065	DD	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250065	DD	On-Demand	Anodyne	ADRB3	51	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250066	DD	On-Demand	Anodyne	ADRB2	56	49
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250066	DD	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250066	DD	On-Demand	Anodyne	ADRB3	51	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250067	DD	On-Demand	Anodyne	ADRB2	56	49
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250067	DD	On-Demand	Anodyne	ADRB1	73	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250067	DD	On-Demand	Anodyne	ADRB3	51	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872250078	CE	On-Demand	Bother	CACNA1D	40	32
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872250079	CE	On-Demand	Bother	CACNA1D	40	32
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872250080	CE	On-Demand	Bother	CACNA1D	40	32
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872250081	CE	On-Demand	Bother	CACNA1D	40	32
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cc(C)ccc1C	ZINC000872250088	DF	On-Demand	Anodyne	ADRB2	15	44
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cc(C)ccc1C	ZINC000872250089	DF	On-Demand	Anodyne	ADRB2	15	44
Cc1nonc1CNC[C@H](O)COc1ccccc1Cl	ZINC000872250099	CD	On-Demand	Anodyne	ADRB2	26	55
Cc1nonc1CNC[C@H](O)COc1ccccc1Cl	ZINC000872250099	CD	On-Demand	Anodyne	ADRB1	46	34
Cc1nonc1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872250100	CD	On-Demand	Anodyne	ADRB2	26	55
Cc1nonc1CNC[C@@H](O)COc1ccccc1Cl	ZINC000872250100	CD	On-Demand	Anodyne	ADRB1	46	34
C#C[C@@H]1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250102	DE	On-Demand	Mild	SIGMAR1	55	40
C#C[C@@H]1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250102	DE	On-Demand	Mild	MCHR2	42	33
C#C[C@@H]1CC[C@@H](NC[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250102	DE	On-Demand	Mild	NPFFR1	41	38
C#C[C@@H]1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250103	DE	On-Demand	Mild	SIGMAR1	55	40
C#C[C@@H]1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250103	DE	On-Demand	Mild	MCHR2	42	33
C#C[C@@H]1CC[C@@H](NC[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000872250103	DE	On-Demand	Mild	NPFFR1	41	38
CCOc1ccc(OC[C@@H](O)CN[C@H]2CC23CC(OCC)C3)cc1	ZINC000872250104	EE	On-Demand	Anodyne	ADRB2	29	41
CCOc1ccc(OC[C@@H](O)CN[C@H]2CC23CC(OCC)C3)cc1	ZINC000872250104	EE	On-Demand	Anodyne	ADRB1	38	42
CCOc1ccc(OC[C@H](O)CN[C@H]2CC23CC(OCC)C3)cc1	ZINC000872250105	EE	On-Demand	Anodyne	ADRB2	29	41
CCOc1ccc(OC[C@H](O)CN[C@H]2CC23CC(OCC)C3)cc1	ZINC000872250105	EE	On-Demand	Anodyne	ADRB1	38	42
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC23CC(OCC)C3)cc1	ZINC000872250106	EE	On-Demand	Anodyne	ADRB2	29	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CC23CC(OCC)C3)cc1	ZINC000872250106	EE	On-Demand	Anodyne	ADRB1	38	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC23CC(OCC)C3)cc1	ZINC000872250107	EE	On-Demand	Anodyne	ADRB2	29	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC23CC(OCC)C3)cc1	ZINC000872250107	EE	On-Demand	Anodyne	ADRB1	38	42
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872250125	EE	On-Demand	Anodyne	ADRB2	29	42
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872250125	EE	On-Demand	Anodyne	GRIN1	28	46
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872250126	EE	On-Demand	Anodyne	ADRB2	29	42
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872250126	EE	On-Demand	Anodyne	GRIN1	28	46
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250127	FF	On-Demand	Anodyne	ADRB1	33	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250130	FF	On-Demand	Anodyne	ADRB1	33	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000872250131	CE	On-Demand	Mild	ADRB2	15	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872250132	EE	On-Demand	Anodyne	ADRB2	20	64
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872250132	EE	On-Demand	Anodyne	ADRB1	25	64
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872250132	EE	On-Demand	Anodyne	SLC6A4	15	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872250134	EE	On-Demand	Anodyne	ADRB2	20	64
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872250134	EE	On-Demand	Anodyne	ADRB1	25	64
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872250134	EE	On-Demand	Anodyne	SLC6A4	15	42
CCOC1CC2(C1)C[C@@H]2NCCC(=O)Nc1cccc(Cl)c1	ZINC000872250136	DG	On-Demand	Anodyne	TIMP3	47	32
Cc1nonc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250140	FF	On-Demand	Anodyne	ADRB2	51	51
Cc1nonc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250140	FF	On-Demand	Anodyne	ADRB1	63	44
Cc1nonc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250140	FF	On-Demand	Anodyne	ADRB3	40	44
Cc1nonc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250141	FF	On-Demand	Anodyne	ADRB2	51	51
Cc1nonc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250141	FF	On-Demand	Anodyne	ADRB1	63	44
Cc1nonc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000872250141	FF	On-Demand	Anodyne	ADRB3	40	44
CC(=O)c1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250145	DD	On-Demand	Anodyne	ADRB2	38	46
CC(=O)c1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250145	DD	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250145	DD	On-Demand	Anodyne	ADRB3	31	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250146	DD	On-Demand	Anodyne	ADRB2	38	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250146	DD	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250146	DD	On-Demand	Anodyne	ADRB3	31	40
Cc1nonc1CNC[C@@H](O)COc1ccccc1C(C)C	ZINC000872250167	DE	On-Demand	Anodyne	ADRB2	27	47
Cc1nonc1CNC[C@@H](O)COc1ccccc1C(C)C	ZINC000872250167	DE	On-Demand	Anodyne	ADRB1	43	34
Cc1nonc1CNC[C@@H](O)COc1ccccc1C(C)C	ZINC000872250167	DE	On-Demand	Anodyne	ABCB1	17	42
Cc1nonc1CNC[C@H](O)COc1ccccc1C(C)C	ZINC000872250168	DE	On-Demand	Anodyne	ADRB2	27	47
Cc1nonc1CNC[C@H](O)COc1ccccc1C(C)C	ZINC000872250168	DE	On-Demand	Anodyne	ADRB1	43	34
Cc1nonc1CNC[C@H](O)COc1ccccc1C(C)C	ZINC000872250168	DE	On-Demand	Anodyne	ABCB1	17	42
Cc1nonc1CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000872250175	EE	On-Demand	Anodyne	CYNT	41	46
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1C	ZINC000872250180	DE	On-Demand	Anodyne	ADRB2	26	54
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1C	ZINC000872250181	DE	On-Demand	Anodyne	ADRB2	26	54
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250202	FF	On-Demand	Anodyne	ADRB2	29	52
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250202	FF	On-Demand	Anodyne	ADRB1	26	52
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250202	FF	On-Demand	Anodyne	PDS	28	40
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250203	FF	On-Demand	Anodyne	ADRB2	29	52
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250203	FF	On-Demand	Anodyne	ADRB1	26	52
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250203	FF	On-Demand	Anodyne	PDS	28	40
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250204	FF	On-Demand	Anodyne	ADRB2	29	52
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250204	FF	On-Demand	Anodyne	ADRB1	26	52
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cccc(Br)c1	ZINC000872250204	FF	On-Demand	Anodyne	PDS	28	40
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250205	FF	On-Demand	Anodyne	ADRB2	29	52
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250205	FF	On-Demand	Anodyne	ADRB1	26	52
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250205	FF	On-Demand	Anodyne	PDS	28	40
CSc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250206	CF	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250206	CF	On-Demand	Anodyne	ADRB1	48	40
CSc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250207	CF	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250207	CF	On-Demand	Anodyne	ADRB1	48	40
CSc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250208	CF	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250208	CF	On-Demand	Anodyne	ADRB1	48	40
CSc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250209	CF	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250209	CF	On-Demand	Anodyne	ADRB1	48	40
CC[C@@H](NC[C@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250237	CF	On-Demand	Anodyne	ADRB2	18	42
CC[C@@H](NC[C@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250237	CF	On-Demand	Anodyne	ADRB3	26	43
CC[C@@H](NC[C@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250237	CF	On-Demand	Anodyne	AOC3	25	55
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250239	CF	On-Demand	Anodyne	ADRB2	18	42
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250239	CF	On-Demand	Anodyne	ADRB3	26	43
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250239	CF	On-Demand	Anodyne	AOC3	25	55
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250240	CF	On-Demand	Anodyne	ADRB2	18	42
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250240	CF	On-Demand	Anodyne	ADRB3	26	43
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872250240	CF	On-Demand	Anodyne	AOC3	25	55
CC[C@@H](NC[C@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250243	CF	On-Demand	Anodyne	ADRB2	18	42
CC[C@@H](NC[C@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250243	CF	On-Demand	Anodyne	ADRB3	26	43
CC[C@@H](NC[C@H](O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872250243	CF	On-Demand	Anodyne	AOC3	25	55
CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1)[C@H](O)c1ccccc1	ZINC000872250245	DG	On-Demand	Anodyne	AOC3	22	46
CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1)[C@@H](O)c1ccccc1	ZINC000872250247	DG	On-Demand	Anodyne	AOC3	22	46
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000872250257	FG	On-Demand	Anodyne	ADRB2	24	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000872250257	FG	On-Demand	Anodyne	ADRB1	34	50
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000872250257	FG	On-Demand	Anodyne	ADRB3	56	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000872250258	FG	On-Demand	Anodyne	ADRB2	24	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000872250258	FG	On-Demand	Anodyne	ADRB1	34	50
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000872250258	FG	On-Demand	Anodyne	ADRB3	56	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000872250266	GF	On-Demand	Anodyne	ADRB2	36	49
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000872250266	GF	On-Demand	Anodyne	ADRB1	30	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000872250266	GF	On-Demand	Anodyne	ADRB3	15	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2Cl)c1	ZINC000872250267	GF	On-Demand	Anodyne	ADRB2	36	49
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2Cl)c1	ZINC000872250267	GF	On-Demand	Anodyne	ADRB1	30	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2Cl)c1	ZINC000872250267	GF	On-Demand	Anodyne	ADRB3	15	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CCC(C)C)c1	ZINC000872250269	EF	On-Demand	Anodyne	ADRB2	15	61
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CCC(C)C)c1	ZINC000872250271	EF	On-Demand	Anodyne	ADRB2	15	61
COc1ccccc1COC[C@H](O)CN[C@H](C)c1nccnc1C	ZINC000872250278	EE	On-Demand	Anodyne	ADRB2	24	42
COc1ccccc1COC[C@H](O)CN[C@@H](C)c1nccnc1C	ZINC000872250279	EE	On-Demand	Anodyne	ADRB2	24	42
COc1ccccc1COC[C@@H](O)CN[C@@H](C)c1nccnc1C	ZINC000872250280	EE	On-Demand	Anodyne	ADRB2	24	42
COc1ccccc1COC[C@@H](O)CN[C@H](C)c1nccnc1C	ZINC000872250281	EE	On-Demand	Anodyne	ADRB2	24	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250286	FF	On-Demand	Anodyne	ADRB2	19	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(Br)c1	ZINC000872250286	FF	On-Demand	Anodyne	ADRB1	21	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(Br)c1	ZINC000872250289	FF	On-Demand	Anodyne	ADRB2	19	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(Br)c1	ZINC000872250289	FF	On-Demand	Anodyne	ADRB1	21	40
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250309	ED	On-Demand	Anodyne	ADRB2	47	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250309	ED	On-Demand	Anodyne	ADRB1	70	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250309	ED	On-Demand	Anodyne	GRIN1	19	40
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250309	ED	On-Demand	Anodyne	ADRB3	48	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250309	ED	On-Demand	Anodyne	ABCB1	17	41
CC(=O)CCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250310	ED	On-Demand	Anodyne	ADRB2	47	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250310	ED	On-Demand	Anodyne	ADRB1	70	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250310	ED	On-Demand	Anodyne	GRIN1	19	40
CC(=O)CCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250310	ED	On-Demand	Anodyne	ADRB3	48	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250310	ED	On-Demand	Anodyne	ABCB1	17	41
Cc1nonc1CNC[C@H](O)COc1cccc2ccccc12	ZINC000872250311	DE	On-Demand	Anodyne	ADRB2	31	60
Cc1nonc1CNC[C@H](O)COc1cccc2ccccc12	ZINC000872250311	DE	On-Demand	Anodyne	ADRB1	50	38
Cc1nonc1CNC[C@H](O)COc1cccc2ccccc12	ZINC000872250311	DE	On-Demand	Anodyne	CYP2D6	16	43
Cc1nonc1CNC[C@@H](O)COc1cccc2ccccc12	ZINC000872250312	DE	On-Demand	Anodyne	ADRB2	31	60
Cc1nonc1CNC[C@@H](O)COc1cccc2ccccc12	ZINC000872250312	DE	On-Demand	Anodyne	ADRB1	50	38
Cc1nonc1CNC[C@@H](O)COc1cccc2ccccc12	ZINC000872250312	DE	On-Demand	Anodyne	CYP2D6	16	43
CCOC1CC2(C1)C[C@@H]2NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000872250332	EF	On-Demand	Anodyne	TIMP3	50	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000872250348	CE	On-Demand	Anodyne	TIMP3	86	39
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000872250351	CE	On-Demand	Anodyne	TIMP3	86	39
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)Cc1ccc(F)cc1	ZINC000872250358	CE	On-Demand	Anodyne	TIMP3	59	39
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)Cc1ccc(F)cc1	ZINC000872250361	CE	On-Demand	Anodyne	TIMP3	59	39
CC(=O)c1cccc(OC[C@H](O)CNCc2nonc2C)c1	ZINC000872250370	DD	On-Demand	Anodyne	ADRB2	31	46
CC(=O)c1cccc(OC[C@H](O)CNCc2nonc2C)c1	ZINC000872250370	DD	On-Demand	Anodyne	ADRB1	43	41
CC(=O)c1cccc(OC[C@H](O)CNCc2nonc2C)c1	ZINC000872250370	DD	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2nonc2C)c1	ZINC000872250371	DD	On-Demand	Anodyne	ADRB2	31	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2nonc2C)c1	ZINC000872250371	DD	On-Demand	Anodyne	ADRB1	43	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2nonc2C)c1	ZINC000872250371	DD	On-Demand	Anodyne	ABCB1	17	46
Cc1nonc1CNC[C@@H](O)Cn1cccn1	ZINC000872250374	BB	On-Demand	Anodyne	CASP3	48	36
Cc1nonc1CNC[C@@H](O)Cn1cccn1	ZINC000872250374	BB	On-Demand	Anodyne	CASP7	51	36
Cc1nonc1CNC[C@H](O)Cn1cccn1	ZINC000872250375	BB	On-Demand	Anodyne	CASP3	48	36
Cc1nonc1CNC[C@H](O)Cn1cccn1	ZINC000872250375	BB	On-Demand	Anodyne	CASP7	51	36
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000872250376	DE	On-Demand	Anodyne	ADRB2	30	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000872250376	DE	On-Demand	Anodyne	ADRB1	40	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000872250379	DE	On-Demand	Anodyne	ADRB2	30	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000872250379	DE	On-Demand	Anodyne	ADRB1	40	41
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250394	DD	On-Demand	Anodyne	ADRB2	56	63
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250394	DD	On-Demand	Anodyne	ADRB1	86	63
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250394	DD	On-Demand	Anodyne	ADRB3	56	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250395	DD	On-Demand	Anodyne	ADRB2	56	63
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250395	DD	On-Demand	Anodyne	ADRB1	86	63
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872250395	DD	On-Demand	Anodyne	ADRB3	56	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250396	DD	On-Demand	Anodyne	ADRB2	56	63
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250396	DD	On-Demand	Anodyne	ADRB1	86	63
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250396	DD	On-Demand	Anodyne	ADRB3	56	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250397	DD	On-Demand	Anodyne	ADRB2	56	63
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250397	DD	On-Demand	Anodyne	ADRB1	86	63
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872250397	DD	On-Demand	Anodyne	ADRB3	56	54
Cc1nccnc1[C@H](C)NC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872250408	GH	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@@H](C)NC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872250409	GH	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@H](C)NC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872250410	GH	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@@H](C)NC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000872250411	GH	On-Demand	Anodyne	ADRB2	20	42
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c(C)c1	ZINC000872250416	DE	On-Demand	Anodyne	ADRB2	24	55
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c(C)c1	ZINC000872250416	DE	On-Demand	Anodyne	ADRB1	15	43
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c(C)c1	ZINC000872250417	DE	On-Demand	Anodyne	ADRB2	24	55
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c(C)c1	ZINC000872250417	DE	On-Demand	Anodyne	ADRB1	15	43
Cc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(C)c1	ZINC000872250418	DE	On-Demand	Anodyne	ADRB2	24	55
Cc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(C)c1	ZINC000872250418	DE	On-Demand	Anodyne	ADRB1	15	43
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(C)c1	ZINC000872250419	DE	On-Demand	Anodyne	ADRB2	24	55
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(C)c1	ZINC000872250419	DE	On-Demand	Anodyne	ADRB1	15	43
O[C@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250420	CG	On-Demand	Anodyne	ADRB2	49	60
O[C@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250420	CG	On-Demand	Anodyne	ADRB1	52	39
O[C@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250420	CG	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250421	CG	On-Demand	Anodyne	ADRB2	49	60
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250421	CG	On-Demand	Anodyne	ADRB1	52	39
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250421	CG	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250422	CG	On-Demand	Anodyne	ADRB2	49	60
O[C@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250422	CG	On-Demand	Anodyne	ADRB1	52	39
O[C@H](CN[C@@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250422	CG	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250423	CG	On-Demand	Anodyne	ADRB2	49	60
O[C@@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250423	CG	On-Demand	Anodyne	ADRB1	52	39
O[C@@H](CN[C@H]1CC12CCC2)COc1ccc2ccccc2c1	ZINC000872250423	CG	On-Demand	Anodyne	ADRB3	33	40
Cc1nccnc1[C@H](C)NC[C@H](O)CO[C@H]1CCCc2ccccc21	ZINC000872250428	EF	On-Demand	Anodyne	ADRB2	17	41
Cc1nccnc1[C@H](C)NC[C@@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000872250429	EF	On-Demand	Anodyne	ADRB2	17	41
Cc1nccnc1[C@H](C)NC[C@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000872250430	EF	On-Demand	Anodyne	ADRB2	17	41
Cc1nccnc1[C@H](C)NC[C@@H](O)CO[C@H]1CCCc2ccccc21	ZINC000872250431	EF	On-Demand	Anodyne	ADRB2	17	41
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)N(C)c2ccccc2)c1	ZINC000872250443	FF	On-Demand	Anodyne	C5AR1	16	41
CCOC[C@H](O)CN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872250449	DD	On-Demand	Anodyne	ADRB2	20	55
Cc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250452	CD	On-Demand	Anodyne	ADRB2	39	52
Cc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250452	CD	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872250452	CD	On-Demand	Anodyne	ADRB3	28	41
Cc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250453	CD	On-Demand	Anodyne	ADRB2	39	52
Cc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250453	CD	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872250453	CD	On-Demand	Anodyne	ADRB3	28	41
CCOC1CC2(C1)C[C@@H]2NCCC(=O)Nc1ccccc1	ZINC000872250454	CF	On-Demand	Anodyne	TIMP3	76	38
CCOC[C@H](O)CN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872250456	DD	On-Demand	Anodyne	ADRB2	20	55
CCOC[C@H](O)CN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872250457	DD	On-Demand	Anodyne	ADRB2	20	55
CCOC[C@H](O)CN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872250458	DD	On-Demand	Anodyne	ADRB2	20	55
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC23CCC3)CC1	ZINC000872250459	DF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC23CCC3)CC1	ZINC000872250462	DF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC23CCC3)CC1	ZINC000872250465	DF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC23CCC3)CC1	ZINC000872250469	DF	On-Demand	Anodyne	GPR119	25	40
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000872250481	FG	On-Demand	Anodyne	ADRB2	20	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000872250482	FG	On-Demand	Anodyne	ADRB2	20	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000872250483	FG	On-Demand	Anodyne	ADRB2	20	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000872250484	FG	On-Demand	Anodyne	ADRB2	20	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250489	FF	On-Demand	Anodyne	ADRB2	38	51
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250489	FF	On-Demand	Anodyne	ADRB1	35	46
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250489	FF	On-Demand	Anodyne	ADRB3	17	46
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250490	FF	On-Demand	Anodyne	ADRB2	38	51
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250490	FF	On-Demand	Anodyne	ADRB1	35	46
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250490	FF	On-Demand	Anodyne	ADRB3	17	46
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250491	FF	On-Demand	Anodyne	ADRB2	38	51
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250491	FF	On-Demand	Anodyne	ADRB1	35	46
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Br)cc1	ZINC000872250491	FF	On-Demand	Anodyne	ADRB3	17	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250492	FF	On-Demand	Anodyne	ADRB2	38	51
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250492	FF	On-Demand	Anodyne	ADRB1	35	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Br)cc1	ZINC000872250492	FF	On-Demand	Anodyne	ADRB3	17	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250501	EE	On-Demand	Anodyne	ADRB2	33	53
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250501	EE	On-Demand	Anodyne	ADRB1	58	49
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250501	EE	On-Demand	Anodyne	ABCB1	19	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250503	EE	On-Demand	Anodyne	ADRB2	33	53
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250503	EE	On-Demand	Anodyne	ADRB1	58	49
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250503	EE	On-Demand	Anodyne	ABCB1	19	47
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250505	EE	On-Demand	Anodyne	ADRB2	33	53
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250505	EE	On-Demand	Anodyne	ADRB1	58	49
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c1	ZINC000872250505	EE	On-Demand	Anodyne	ABCB1	19	47
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872250506	CD	On-Demand	Anodyne	ADRB2	36	41
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872250506	CD	On-Demand	Anodyne	ADRB1	47	40
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872250506	CD	On-Demand	Anodyne	GRIN1	16	44
Cc1nonc1CNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872250506	CD	On-Demand	Anodyne	ADRB3	27	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250507	EE	On-Demand	Anodyne	ADRB2	33	53
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250507	EE	On-Demand	Anodyne	ADRB1	58	49
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c1	ZINC000872250507	EE	On-Demand	Anodyne	ABCB1	19	47
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872250508	CD	On-Demand	Anodyne	ADRB2	36	41
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872250508	CD	On-Demand	Anodyne	ADRB1	47	40
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872250508	CD	On-Demand	Anodyne	GRIN1	16	44
Cc1nonc1CNC[C@H](O)COc1ccc(Cl)cc1	ZINC000872250508	CD	On-Demand	Anodyne	ADRB3	27	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1Cl	ZINC000872250530	EF	On-Demand	Anodyne	ADRB2	22	49
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1Cl	ZINC000872250532	EF	On-Demand	Anodyne	ADRB2	22	49
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000872250547	DE	On-Demand	Bother	SLC27A4	44	36
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000872250551	DE	On-Demand	Bother	SLC27A4	44	36
CCOC1CC2(C1)C[C@@H]2NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872250572	EE	On-Demand	Anodyne	SIGMAR1	34	41
CCOC1CC2(C1)C[C@@H]2NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872250572	EE	On-Demand	Anodyne	TIMP3	50	32
CCOC1CC2(C1)C[C@@H]2NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872250573	EE	On-Demand	Anodyne	SIGMAR1	34	41
CCOC1CC2(C1)C[C@@H]2NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872250573	EE	On-Demand	Anodyne	TIMP3	50	32
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000872250582	EG	On-Demand	Anodyne	ADRB2	30	56
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000872250582	EG	On-Demand	Anodyne	CYP2D6	18	45
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000872250583	EG	On-Demand	Anodyne	ADRB2	30	56
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000872250583	EG	On-Demand	Anodyne	CYP2D6	18	45
Cc1nonc1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872250604	DD	On-Demand	Anodyne	ADRB2	20	59
Cc1nonc1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872250604	DD	On-Demand	Anodyne	ADRB1	34	59
Cc1nonc1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872250608	DD	On-Demand	Anodyne	ADRB2	20	59
Cc1nonc1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872250608	DD	On-Demand	Anodyne	ADRB1	34	59
Cc1nonc1CNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000872250619	EE	On-Demand	Anodyne	ADRB2	16	41
Cc1nonc1CNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000872250620	EE	On-Demand	Anodyne	ADRB2	16	41
O[C@H](CN[C@@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250649	CF	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CN[C@@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250649	CF	On-Demand	Anodyne	ADRB3	46	46
O[C@H](CN[C@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250650	CF	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CN[C@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250650	CF	On-Demand	Anodyne	ADRB3	46	46
O[C@@H](CN[C@@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250651	CF	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CN[C@@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250651	CF	On-Demand	Anodyne	ADRB3	46	46
O[C@@H](CN[C@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250652	CF	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CN[C@H]1CC12CCC2)c1cccc(Cl)c1	ZINC000872250652	CF	On-Demand	Anodyne	ADRB3	46	46
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C#N)c1	ZINC000872250687	DE	On-Demand	Mild	KISS1R	41	34
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C#N)c1	ZINC000872250688	DE	On-Demand	Mild	KISS1R	41	34
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC12CCC2	ZINC000872250689	DD	On-Demand	Anodyne	ADRB2	32	43
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC12CCC2	ZINC000872250689	DD	On-Demand	Anodyne	ADRB1	31	43
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC12CCC2	ZINC000872250690	DD	On-Demand	Anodyne	ADRB2	32	43
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC12CCC2	ZINC000872250690	DD	On-Demand	Anodyne	ADRB1	31	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CC12CCC2	ZINC000872250691	DD	On-Demand	Anodyne	ADRB2	32	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CC12CCC2	ZINC000872250691	DD	On-Demand	Anodyne	ADRB1	31	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CC12CCC2	ZINC000872250692	DD	On-Demand	Anodyne	ADRB2	32	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CC12CCC2	ZINC000872250692	DD	On-Demand	Anodyne	ADRB1	31	43
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250699	DF	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250699	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250699	DF	On-Demand	Anodyne	PDS	46	40
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250700	DF	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250700	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250700	DF	On-Demand	Anodyne	PDS	46	40
O[C@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250701	DF	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250701	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CN[C@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250701	DF	On-Demand	Anodyne	PDS	46	40
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250702	DF	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250702	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc(C(F)(F)F)c1	ZINC000872250702	DF	On-Demand	Anodyne	PDS	46	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COC(C)C)c1	ZINC000872250709	ED	On-Demand	Anodyne	ADRB2	21	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COC(C)C)c1	ZINC000872250712	ED	On-Demand	Anodyne	ADRB2	21	56
C=CCc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872250719	FF	On-Demand	Mild	ADRB2	21	46
C=CCc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872250719	FF	On-Demand	Mild	ADRB1	16	44
C=CCc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872250720	FF	On-Demand	Mild	ADRB2	21	46
C=CCc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872250720	FF	On-Demand	Mild	ADRB1	16	44
C=CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872250721	FF	On-Demand	Mild	ADRB2	21	46
C=CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872250721	FF	On-Demand	Mild	ADRB1	16	44
C=CCc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872250726	FF	On-Demand	Mild	ADRB2	21	46
C=CCc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872250726	FF	On-Demand	Mild	ADRB1	16	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2cccc(C)c2)c1	ZINC000872250734	GE	On-Demand	Anodyne	ADRB2	35	61
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2cccc(C)c2)c1	ZINC000872250734	GE	On-Demand	Anodyne	ADRB1	28	61
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2cccc(C)c2)c1	ZINC000872250734	GE	On-Demand	Anodyne	ADRB3	16	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2cccc(C)c2)c1	ZINC000872250735	GE	On-Demand	Anodyne	ADRB2	35	61
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2cccc(C)c2)c1	ZINC000872250735	GE	On-Demand	Anodyne	ADRB1	28	61
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2cccc(C)c2)c1	ZINC000872250735	GE	On-Demand	Anodyne	ADRB3	16	41
Cc1nccnc1[C@@H](C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872250752	DG	On-Demand	Anodyne	ADRB2	22	46
Cc1nccnc1[C@@H](C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872250753	DG	On-Demand	Anodyne	ADRB2	22	46
Cc1nccnc1[C@H](C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872250754	DG	On-Demand	Anodyne	ADRB2	22	46
Cc1nccnc1[C@H](C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872250755	DG	On-Demand	Anodyne	ADRB2	22	46
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(CC)c1	ZINC000872250794	DF	On-Demand	Anodyne	ADRB2	26	43
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(CC)c1	ZINC000872250794	DF	On-Demand	Anodyne	ADRB1	35	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(CC)c1	ZINC000872250794	DF	On-Demand	Anodyne	ADRB3	18	43
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(CC)c1	ZINC000872250795	DF	On-Demand	Anodyne	ADRB2	26	43
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(CC)c1	ZINC000872250795	DF	On-Demand	Anodyne	ADRB1	35	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(CC)c1	ZINC000872250795	DF	On-Demand	Anodyne	ADRB3	18	43
O=C(c1cc2c(C3CC3)cccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872250799	GE	On-Demand	Anodyne	GRIN2B	22	41
COc1cccc(OC)c1OC[C@H](O)CNCc1nonc1C	ZINC000872250800	DC	On-Demand	Anodyne	ADRB2	24	41
COc1cccc(OC)c1OC[C@@H](O)CNCc1nonc1C	ZINC000872250801	DC	On-Demand	Anodyne	ADRB2	24	41
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1C#N	ZINC000872250820	DD	On-Demand	Mild	ADRB2	19	56
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1C#N	ZINC000872250820	DD	On-Demand	Mild	ADRB1	68	44
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1C#N	ZINC000872250820	DD	On-Demand	Mild	CASR	43	45
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1C#N	ZINC000872250820	DD	On-Demand	Mild	CYP2D6	20	45
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1C#N	ZINC000872250821	DD	On-Demand	Mild	ADRB2	19	56
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1C#N	ZINC000872250821	DD	On-Demand	Mild	ADRB1	68	44
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1C#N	ZINC000872250821	DD	On-Demand	Mild	CASR	43	45
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1C#N	ZINC000872250821	DD	On-Demand	Mild	CYP2D6	20	45
CC(=O)N1CCN(c2ccccc2CN[C@H]2CCNCC(C)(C)C2)CC1	ZINC000872250823	FE	On-Demand	Anodyne	MC4R	45	45
CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCNCC(C)(C)C2)CC1	ZINC000872250825	FE	On-Demand	Anodyne	MC4R	45	45
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872250833	ED	On-Demand	Bother	CACNA1C	42	35
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872250833	ED	On-Demand	Bother	CACNA1D	67	33
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872250836	ED	On-Demand	Bother	CACNA1C	42	35
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000872250836	ED	On-Demand	Bother	CACNA1D	67	33
O=C(Nc1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)NC1CC1	ZINC000872250851	GI	On-Demand	Anodyne	EPHX2	47	40
O=C(Nc1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)NC1CC1	ZINC000872250851	GI	On-Demand	Anodyne	NR2E3	69	39
O=C(Nc1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)NC1CC1	ZINC000872250851	GI	On-Demand	Anodyne	SMO	25	44
O=C(Nc1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)NC1CC1	ZINC000872250851	GI	On-Demand	Anodyne	TNKS	58	34
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250866	DF	On-Demand	Mild	ADRB2	31	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250866	DF	On-Demand	Mild	ADRB1	40	47
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250866	DF	On-Demand	Mild	ADRB3	25	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250868	DF	On-Demand	Mild	ADRB2	31	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250868	DF	On-Demand	Mild	ADRB1	40	47
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000872250868	DF	On-Demand	Mild	ADRB3	25	42
O=C(c1ccc(C(F)F)o1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872250875	FD	On-Demand	Anodyne	L3MBTL3	18	41
Cc1nonc1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250876	ED	On-Demand	Anodyne	ADRB2	20	42
Cc1nonc1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250876	ED	On-Demand	Anodyne	ADRB1	15	41
Cc1nonc1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250876	ED	On-Demand	Anodyne	PDS	51	42
Cc1nonc1CNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250877	ED	On-Demand	Anodyne	ADRB2	20	42
Cc1nonc1CNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250877	ED	On-Demand	Anodyne	ADRB1	15	41
Cc1nonc1CNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250877	ED	On-Demand	Anodyne	PDS	51	42
O=C(c1ccc(C2CCOCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872250898	GD	On-Demand	Anodyne	L3MBTL3	66	38
Cn1cc(-c2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc2)cn1	ZINC000872250899	GD	On-Demand	Anodyne	L3MBTL3	58	35
CCOC1CC2(C1)C[C@@H]2NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000872250904	FG	On-Demand	Anodyne	CYNT	24	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250908	ED	On-Demand	Mild	ADRB2	42	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250908	ED	On-Demand	Mild	ADRB1	62	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250908	ED	On-Demand	Mild	ADRB3	42	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250909	ED	On-Demand	Mild	ADRB2	42	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250909	ED	On-Demand	Mild	ADRB1	62	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)CC1	ZINC000872250909	ED	On-Demand	Mild	ADRB3	42	46
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250922	FF	On-Demand	Anodyne	PDS	47	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872250927	FF	On-Demand	Anodyne	PDS	47	41
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000872250975	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000872250976	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000872250977	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000872250978	FG	On-Demand	Anodyne	ADRB2	20	42
CC[C@@H](NC[C@H](O)COC)[C@H](O)c1ccccc1	ZINC000872250995	CD	On-Demand	Anodyne	ADRB2	28	43
CC[C@@H](NC[C@H](O)COC)[C@H](O)c1ccccc1	ZINC000872250995	CD	On-Demand	Anodyne	AOC3	18	45
CC[C@@H](NC[C@@H](O)COC)[C@@H](O)c1ccccc1	ZINC000872250998	CD	On-Demand	Anodyne	ADRB2	28	43
CC[C@@H](NC[C@@H](O)COC)[C@@H](O)c1ccccc1	ZINC000872250998	CD	On-Demand	Anodyne	AOC3	18	45
CC[C@@H](NC[C@@H](O)COC)[C@H](O)c1ccccc1	ZINC000872251000	CD	On-Demand	Anodyne	ADRB2	28	43
CC[C@@H](NC[C@@H](O)COC)[C@H](O)c1ccccc1	ZINC000872251000	CD	On-Demand	Anodyne	AOC3	18	45
CC[C@@H](NC[C@H](O)COC)[C@@H](O)c1ccccc1	ZINC000872251001	CD	On-Demand	Anodyne	ADRB2	28	43
CC[C@@H](NC[C@H](O)COC)[C@@H](O)c1ccccc1	ZINC000872251001	CD	On-Demand	Anodyne	AOC3	18	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251031	CD	On-Demand	Bother	ADRB2	23	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251031	CD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251031	CD	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251031	CD	On-Demand	Bother	CACNA1D	58	33
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251032	CD	On-Demand	Bother	ADRB2	23	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251032	CD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251032	CD	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251032	CD	On-Demand	Bother	CACNA1D	58	33
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251033	CD	On-Demand	Bother	ADRB2	23	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251033	CD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251033	CD	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251033	CD	On-Demand	Bother	CACNA1D	58	33
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251034	CD	On-Demand	Bother	ADRB2	23	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251034	CD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251034	CD	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251034	CD	On-Demand	Bother	CACNA1D	58	33
COC[C@@H](O)CN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251037	CC	On-Demand	Anodyne	ADRB2	24	59
COC[C@@H](O)CN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251037	CC	On-Demand	Anodyne	ADRB1	20	42
COC[C@@H](O)CN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251039	CC	On-Demand	Anodyne	ADRB2	24	59
COC[C@@H](O)CN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251039	CC	On-Demand	Anodyne	ADRB1	20	42
COC[C@@H](O)CN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251045	CC	On-Demand	Anodyne	ADRB2	24	59
COC[C@@H](O)CN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251045	CC	On-Demand	Anodyne	ADRB1	20	42
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000872251046	EG	On-Demand	Anodyne	TIMP3	65	32
COC[C@@H](O)CN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251047	CC	On-Demand	Anodyne	ADRB2	24	59
COC[C@@H](O)CN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251047	CC	On-Demand	Anodyne	ADRB1	20	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000872251048	EG	On-Demand	Anodyne	TIMP3	65	32
CC[C@@H](NC[C@H](C)O)[C@H](O)c1ccccc1	ZINC000872251049	BD	On-Demand	Anodyne	AOC3	21	47
CC[C@@H](NC[C@H](C)O)[C@@H](O)c1ccccc1	ZINC000872251050	BD	On-Demand	Anodyne	AOC3	21	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251052	DF	On-Demand	Anodyne	ADRB2	39	51
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251052	DF	On-Demand	Anodyne	ADRB1	39	46
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251052	DF	On-Demand	Anodyne	GRIN1	23	43
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251052	DF	On-Demand	Anodyne	ADRB3	21	46
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251052	DF	On-Demand	Anodyne	CDK4	15	40
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251066	DF	On-Demand	Anodyne	ADRB2	39	51
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251066	DF	On-Demand	Anodyne	ADRB1	39	46
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251066	DF	On-Demand	Anodyne	GRIN1	23	43
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251066	DF	On-Demand	Anodyne	ADRB3	21	46
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251066	DF	On-Demand	Anodyne	CDK4	15	40
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251069	DF	On-Demand	Anodyne	ADRB2	39	51
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251069	DF	On-Demand	Anodyne	ADRB1	39	46
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251069	DF	On-Demand	Anodyne	GRIN1	23	43
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251069	DF	On-Demand	Anodyne	ADRB3	21	46
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251069	DF	On-Demand	Anodyne	CDK4	15	40
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251071	DF	On-Demand	Anodyne	ADRB2	39	51
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251071	DF	On-Demand	Anodyne	ADRB1	39	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251071	DF	On-Demand	Anodyne	GRIN1	23	43
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251071	DF	On-Demand	Anodyne	ADRB3	21	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251071	DF	On-Demand	Anodyne	CDK4	15	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000872251081	EE	On-Demand	Anodyne	ADRB2	20	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000872251083	EE	On-Demand	Anodyne	ADRB2	20	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872251088	DD	On-Demand	Mild	ADRB3	17	40
C#C[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872251089	DD	On-Demand	Mild	ADRB3	17	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)CCc1ccccc1	ZINC000872251090	CF	On-Demand	Anodyne	TIMP3	77	37
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)CCc1ccccc1	ZINC000872251095	CF	On-Demand	Anodyne	TIMP3	77	37
COCCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251113	DD	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251113	DD	On-Demand	Anodyne	ADRB1	65	57
COCCc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251113	DD	On-Demand	Anodyne	ADRB3	43	47
COCCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251118	DD	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251118	DD	On-Demand	Anodyne	ADRB1	65	57
COCCc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251118	DD	On-Demand	Anodyne	ADRB3	43	47
Cc1nonc1CNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872251120	DE	On-Demand	Anodyne	ADRB2	34	41
Cc1nonc1CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000872251121	DE	On-Demand	Anodyne	ADRB2	34	41
CCOC1CC2(C1)C[C@@H]2NCCC(=O)Nc1cccnc1	ZINC000872251122	CD	On-Demand	Anodyne	TIMP3	38	42
Cc1nonc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872251126	CD	On-Demand	Anodyne	ADRB1	28	42
Cc1nonc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000872251126	CD	On-Demand	Anodyne	ADRB3	42	42
Cc1nonc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872251127	CD	On-Demand	Anodyne	ADRB1	28	42
Cc1nonc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000872251127	CD	On-Demand	Anodyne	ADRB3	42	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251132	EE	On-Demand	Mild	ADRB2	46	56
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251132	EE	On-Demand	Mild	ADRB1	81	56
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251132	EE	On-Demand	Mild	ADRB3	54	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251133	EE	On-Demand	Mild	ADRB2	46	56
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251133	EE	On-Demand	Mild	ADRB1	81	56
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000872251133	EE	On-Demand	Mild	ADRB3	54	48
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000872251141	CF	On-Demand	Anodyne	ADRB3	42	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000872251145	CF	On-Demand	Anodyne	ADRB3	42	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251150	DE	On-Demand	Mild	ADRB2	24	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251150	DE	On-Demand	Mild	ADRB1	47	32
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251150	DE	On-Demand	Mild	ADRB3	16	40
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251151	DE	On-Demand	Mild	ADRB2	24	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251151	DE	On-Demand	Mild	ADRB1	47	32
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000872251151	DE	On-Demand	Mild	ADRB3	16	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)Cc1cccc(Cl)c1	ZINC000872251157	DF	On-Demand	Anodyne	TIMP3	51	34
Nc1cc(F)ccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251159	EC	On-Demand	Anodyne	L3MBTL3	30	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000872251161	DF	On-Demand	Anodyne	TIMP3	51	34
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251166	EE	On-Demand	Mild	ADRB2	43	57
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251166	EE	On-Demand	Mild	ADRB1	68	60
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251166	EE	On-Demand	Mild	ADRB3	47	43
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872251179	HF	On-Demand	Anodyne	EPHX2	46	38
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251181	EE	On-Demand	Mild	ADRB2	43	57
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251181	EE	On-Demand	Mild	ADRB1	68	60
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCOC)cc2)CC1	ZINC000872251181	EE	On-Demand	Mild	ADRB3	47	43
Cc1nonc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251206	EF	On-Demand	Anodyne	ADRB2	53	48
Cc1nonc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251206	EF	On-Demand	Anodyne	ADRB1	66	41
Cc1nonc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251206	EF	On-Demand	Anodyne	ADRB3	44	41
Cc1nonc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251207	EF	On-Demand	Anodyne	ADRB2	53	48
Cc1nonc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251207	EF	On-Demand	Anodyne	ADRB1	66	41
Cc1nonc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872251207	EF	On-Demand	Anodyne	ADRB3	44	41
O=C(O)c1ccc(/C=C\C(=O)N2CCO[C@H](C(F)F)CC2)o1	ZINC000872251212	DD	On-Demand	Anodyne	ITGAL	79	36
O=C(O)c1ccc(/C=C\C(=O)N2CCO[C@@H](C(F)F)CC2)o1	ZINC000872251214	DD	On-Demand	Anodyne	ITGAL	79	36
O=C(O)c1ccc(/C=C/C(=O)N2CCO[C@@H](C(F)F)CC2)o1	ZINC000872251216	DD	On-Demand	Anodyne	ITGAL	79	36
O=C(O)c1ccc(/C=C/C(=O)N2CCO[C@H](C(F)F)CC2)o1	ZINC000872251218	DD	On-Demand	Anodyne	ITGAL	79	36
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)n(C)c1	ZINC000872251233	IF	On-Demand	Anodyne	EPHX2	45	42
COc1ccccc1-c1nc(CN2CCC(=O)N(C)CC2)co1	ZINC000872251236	DE	On-Demand	Anodyne	DRD2	24	55
COc1ccccc1-c1nc(CN2CCC(=O)N(C)CC2)co1	ZINC000872251236	DE	On-Demand	Anodyne	DRD3	22	53
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000872251249	EF	On-Demand	Anodyne	ADRB2	20	55
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000872251250	EF	On-Demand	Anodyne	ADRB2	20	55
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251253	CE	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251253	CE	On-Demand	Anodyne	ADRB1	53	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251253	CE	On-Demand	Anodyne	ABCB1	20	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251254	CE	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251254	CE	On-Demand	Anodyne	ADRB1	53	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)c1	ZINC000872251254	CE	On-Demand	Anodyne	ABCB1	20	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251255	CE	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251255	CE	On-Demand	Anodyne	ADRB1	53	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251255	CE	On-Demand	Anodyne	ABCB1	20	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251256	CE	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251256	CE	On-Demand	Anodyne	ADRB1	53	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC23CCC3)c1	ZINC000872251256	CE	On-Demand	Anodyne	ABCB1	20	46
CC[C@@H](NCCC(=O)Nc1ccccc1)[C@H](O)c1ccccc1	ZINC000872251276	DG	On-Demand	Anodyne	LTA4H	21	41
CC[C@@H](NCCC(=O)Nc1ccccc1)[C@@H](O)c1ccccc1	ZINC000872251277	DG	On-Demand	Anodyne	LTA4H	21	41
CC[C@@H](NCCC(N)=O)[C@H](O)c1ccccc1	ZINC000872251294	BC	On-Demand	Anodyne	AOC3	15	45
CC[C@@H](NCCC(N)=O)[C@@H](O)c1ccccc1	ZINC000872251296	BC	On-Demand	Anodyne	AOC3	15	45
CC[C@@H](NCC(C)(C)O)[C@H](O)c1ccccc1	ZINC000872251301	BD	On-Demand	Anodyne	AOC3	15	41
CC[C@@H](NCC(C)(C)O)[C@@H](O)c1ccccc1	ZINC000872251302	BD	On-Demand	Anodyne	AOC3	15	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251311	CE	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251311	CE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251311	CE	On-Demand	Anodyne	ADRB3	40	39
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251312	CE	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251312	CE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251312	CE	On-Demand	Anodyne	ADRB3	40	39
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251313	CE	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251313	CE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251313	CE	On-Demand	Anodyne	ADRB3	40	39
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251314	CE	On-Demand	Anodyne	ADRB2	45	46
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251314	CE	On-Demand	Anodyne	ADRB1	64	45
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251314	CE	On-Demand	Anodyne	ADRB3	40	39
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251321	EG	On-Demand	Anodyne	ADRB2	44	66
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251321	EG	On-Demand	Anodyne	ADRB1	33	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251321	EG	On-Demand	Anodyne	ADRB3	20	42
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251321	EG	On-Demand	Anodyne	ACOX1	42	38
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251322	EG	On-Demand	Anodyne	ADRB2	44	66
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251322	EG	On-Demand	Anodyne	ADRB1	33	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251322	EG	On-Demand	Anodyne	ADRB3	20	42
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251322	EG	On-Demand	Anodyne	ACOX1	42	38
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251323	EG	On-Demand	Anodyne	ADRB2	44	66
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251323	EG	On-Demand	Anodyne	ADRB1	33	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251323	EG	On-Demand	Anodyne	ADRB3	20	42
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251323	EG	On-Demand	Anodyne	ACOX1	42	38
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251324	EG	On-Demand	Anodyne	ADRB2	44	66
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251324	EG	On-Demand	Anodyne	ADRB1	33	47
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251324	EG	On-Demand	Anodyne	ADRB3	20	42
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251324	EG	On-Demand	Anodyne	ACOX1	42	38
C#CCNC(=O)CCN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251329	DC	On-Demand	Mild	MTNR1A	58	39
C#CCNC(=O)CCN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251329	DC	On-Demand	Mild	MTNR1B	48	39
C#CCNC(=O)CCN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251330	DC	On-Demand	Mild	MTNR1A	58	39
C#CCNC(=O)CCN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251330	DC	On-Demand	Mild	MTNR1B	48	39
C#CCNC(=O)CCN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251331	DC	On-Demand	Mild	MTNR1A	58	39
C#CCNC(=O)CCN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251331	DC	On-Demand	Mild	MTNR1B	48	39
C#CCNC(=O)CCN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251332	DC	On-Demand	Mild	MTNR1A	58	39
C#CCNC(=O)CCN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251332	DC	On-Demand	Mild	MTNR1B	48	39
CCOC[C@H](O)CN[C@@H](CC)[C@@H](O)c1ccccc1	ZINC000872251341	CD	On-Demand	Anodyne	ADRB2	22	43
CCOC[C@H](O)CN[C@@H](CC)[C@@H](O)c1ccccc1	ZINC000872251341	CD	On-Demand	Anodyne	AOC3	15	44
CCOC[C@H](O)CN[C@H](CC)[C@@H](O)c1ccccc1	ZINC000872251342	CD	On-Demand	Anodyne	ADRB2	22	43
CCOC[C@H](O)CN[C@H](CC)[C@@H](O)c1ccccc1	ZINC000872251342	CD	On-Demand	Anodyne	AOC3	15	44
CCOC[C@H](O)CN[C@@H](CC)[C@H](O)c1ccccc1	ZINC000872251343	CD	On-Demand	Anodyne	ADRB2	22	43
CCOC[C@H](O)CN[C@@H](CC)[C@H](O)c1ccccc1	ZINC000872251343	CD	On-Demand	Anodyne	AOC3	15	44
CCOC[C@H](O)CN[C@H](CC)[C@H](O)c1ccccc1	ZINC000872251344	CD	On-Demand	Anodyne	ADRB2	22	43
CCOC[C@H](O)CN[C@H](CC)[C@H](O)c1ccccc1	ZINC000872251344	CD	On-Demand	Anodyne	AOC3	15	44
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251353	EE	On-Demand	Mild	ADRB2	31	47
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251353	EE	On-Demand	Mild	ADRB1	36	40
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251353	EE	On-Demand	Mild	ADRB3	29	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251353	EE	On-Demand	Mild	PDS	20	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251354	EE	On-Demand	Mild	ADRB2	31	47
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251354	EE	On-Demand	Mild	ADRB1	36	40
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251354	EE	On-Demand	Mild	ADRB3	29	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(=O)OCC)c2)CC1	ZINC000872251354	EE	On-Demand	Mild	PDS	20	44
Cc1nonc1CNC[C@@H](O)c1cccnc1	ZINC000872251359	BC	On-Demand	Anodyne	ADRB2	20	44
Cc1nonc1CNC[C@@H](O)c1cccnc1	ZINC000872251359	BC	On-Demand	Anodyne	ADRB1	21	44
Cc1nonc1CNC[C@@H](O)c1cccnc1	ZINC000872251359	BC	On-Demand	Anodyne	ADRB3	87	44
Cc1nonc1CNC[C@H](O)c1cccnc1	ZINC000872251360	BC	On-Demand	Anodyne	ADRB2	20	44
Cc1nonc1CNC[C@H](O)c1cccnc1	ZINC000872251360	BC	On-Demand	Anodyne	ADRB1	21	44
Cc1nonc1CNC[C@H](O)c1cccnc1	ZINC000872251360	BC	On-Demand	Anodyne	ADRB3	87	44
C#C[C@@H]1CC[C@@H](NCCC(=O)Nc2ccccc2)CC1	ZINC000872251382	CF	On-Demand	Mild	HDAC11	16	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251383	ED	On-Demand	Anodyne	ADRB2	36	55
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251383	ED	On-Demand	Anodyne	ADRB1	67	55
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251383	ED	On-Demand	Anodyne	ADRB3	41	48
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251383	ED	On-Demand	Anodyne	TIMP3	60	37
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251384	ED	On-Demand	Anodyne	ADRB2	36	55
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251384	ED	On-Demand	Anodyne	ADRB1	67	55
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251384	ED	On-Demand	Anodyne	ADRB3	41	48
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000872251384	ED	On-Demand	Anodyne	TIMP3	60	37
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C)cc1	ZINC000872251393	DE	On-Demand	Anodyne	ADRB2	30	50
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C)cc1	ZINC000872251393	DE	On-Demand	Anodyne	ADRB1	36	41
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C)cc1	ZINC000872251394	DE	On-Demand	Anodyne	ADRB2	30	50
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C)cc1	ZINC000872251394	DE	On-Demand	Anodyne	ADRB1	36	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000872251399	EE	On-Demand	Anodyne	ADRB2	23	46
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000872251400	EE	On-Demand	Anodyne	ADRB2	23	46
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000872251414	EF	On-Demand	Anodyne	ADRB1	33	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(Cl)cc1	ZINC000872251417	EF	On-Demand	Anodyne	ADRB1	33	41
Cc1nonc1CNC[C@@H](O)COc1cccc(Br)c1	ZINC000872251454	ED	On-Demand	Anodyne	ADRB2	26	44
Cc1nonc1CNC[C@@H](O)COc1cccc(Br)c1	ZINC000872251454	ED	On-Demand	Anodyne	ADRB1	23	43
Cc1nonc1CNC[C@H](O)COc1cccc(Br)c1	ZINC000872251458	ED	On-Demand	Anodyne	ADRB2	26	44
Cc1nonc1CNC[C@H](O)COc1cccc(Br)c1	ZINC000872251458	ED	On-Demand	Anodyne	ADRB1	23	43
O=C(c1cnn(CC2CC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251484	FC	On-Demand	Anodyne	L3MBTL3	44	33
O=C([C@@H]1CCN(Cc2ccccc2)C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251500	GD	On-Demand	Anodyne	SIGMAR1	30	42
O=C([C@@H]1CCN(Cc2ccccc2)C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251500	GD	On-Demand	Anodyne	SLC18A3	21	40
O=C([C@H]1CCN(Cc2ccccc2)C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251501	GD	On-Demand	Anodyne	SIGMAR1	30	42
O=C([C@H]1CCN(Cc2ccccc2)C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251501	GD	On-Demand	Anodyne	SLC18A3	21	40
O=C(c1ccc2cccnc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872251521	FD	On-Demand	Anodyne	L3MBTL3	55	39
Cc1nc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2o1	ZINC000872251522	FD	On-Demand	Anodyne	L3MBTL3	57	36
CN1CCCC[C@H]1CCC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872251530	DE	On-Demand	Anodyne	ACKR3	42	32
CN1CCCC[C@@H]1CCC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872251531	DE	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2F)c1	ZINC000872251544	GE	On-Demand	Anodyne	ADRB2	36	49
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2F)c1	ZINC000872251545	GE	On-Demand	Anodyne	ADRB2	36	49
O[C@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251546	DF	On-Demand	Anodyne	ADRB2	26	43
O[C@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251546	DF	On-Demand	Anodyne	ADRB1	45	33
O[C@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251546	DF	On-Demand	Anodyne	ABCB1	15	41
O[C@@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251547	DF	On-Demand	Anodyne	ADRB2	26	43
O[C@@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251547	DF	On-Demand	Anodyne	ADRB1	45	33
O[C@@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251547	DF	On-Demand	Anodyne	ABCB1	15	41
O[C@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251549	DF	On-Demand	Anodyne	ADRB2	26	43
O[C@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251549	DF	On-Demand	Anodyne	ADRB1	45	33
O[C@H](CN[C@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251549	DF	On-Demand	Anodyne	ABCB1	15	41
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251551	DF	On-Demand	Anodyne	ADRB2	26	43
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251551	DF	On-Demand	Anodyne	ADRB1	45	33
O[C@@H](CN[C@@H]1CC12CCC2)COc1ccccc1C(F)(F)F	ZINC000872251551	DF	On-Demand	Anodyne	ABCB1	15	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251583	ED	On-Demand	Anodyne	ADRB2	46	56
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251583	ED	On-Demand	Anodyne	ADRB1	61	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251583	ED	On-Demand	Anodyne	ADRB3	36	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251584	ED	On-Demand	Anodyne	ADRB2	46	56
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251584	ED	On-Demand	Anodyne	ADRB1	61	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251584	ED	On-Demand	Anodyne	ADRB3	36	44
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251585	ED	On-Demand	Anodyne	ADRB2	46	56
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251585	ED	On-Demand	Anodyne	ADRB1	61	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251585	ED	On-Demand	Anodyne	ADRB3	36	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251586	ED	On-Demand	Anodyne	ADRB2	46	56
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251586	ED	On-Demand	Anodyne	ADRB1	61	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251586	ED	On-Demand	Anodyne	ADRB3	36	44
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251599	EE	On-Demand	Anodyne	ADRB2	43	52
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251599	EE	On-Demand	Anodyne	ADRB1	38	50
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251599	EE	On-Demand	Anodyne	ADRB3	19	47
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251600	EE	On-Demand	Anodyne	ADRB2	43	52
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251600	EE	On-Demand	Anodyne	ADRB1	38	50
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251600	EE	On-Demand	Anodyne	ADRB3	19	47
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251601	EE	On-Demand	Anodyne	ADRB2	43	52
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251601	EE	On-Demand	Anodyne	ADRB1	38	50
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251601	EE	On-Demand	Anodyne	ADRB3	19	47
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251602	EE	On-Demand	Anodyne	ADRB2	43	52
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251602	EE	On-Demand	Anodyne	ADRB1	38	50
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251602	EE	On-Demand	Anodyne	ADRB3	19	47
O[C@]1(CN[C@@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251611	CE	On-Demand	Anodyne	SIGMAR1	48	38
O[C@]1(CN[C@@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251611	CE	On-Demand	Anodyne	NPFFR1	41	38
O[C@@]1(CN[C@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251612	CE	On-Demand	Anodyne	SIGMAR1	48	38
O[C@@]1(CN[C@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251612	CE	On-Demand	Anodyne	NPFFR1	41	38
O[C@@]1(CN[C@@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251613	CE	On-Demand	Anodyne	SIGMAR1	48	38
O[C@@]1(CN[C@@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251613	CE	On-Demand	Anodyne	NPFFR1	41	38
O[C@]1(CN[C@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251614	CE	On-Demand	Anodyne	SIGMAR1	48	38
O[C@]1(CN[C@H]2CC23CCC3)CCN(Cc2ccccc2)C1	ZINC000872251614	CE	On-Demand	Anodyne	NPFFR1	41	38
CC[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)[C@H](O)c1ccccc1	ZINC000872251623	GG	On-Demand	Anodyne	KCNQ2	24	42
CC[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)[C@@H](O)c1ccccc1	ZINC000872251625	GG	On-Demand	Anodyne	KCNQ2	24	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251631	DE	On-Demand	Anodyne	ADRB2	52	46
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251631	DE	On-Demand	Anodyne	ADRB1	79	52
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251631	DE	On-Demand	Anodyne	ADRB3	57	46
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251631	DE	On-Demand	Anodyne	ABCB1	25	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251632	DE	On-Demand	Anodyne	ADRB2	52	46
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251632	DE	On-Demand	Anodyne	ADRB1	79	52
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251632	DE	On-Demand	Anodyne	ADRB3	57	46
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251632	DE	On-Demand	Anodyne	ABCB1	25	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251633	DE	On-Demand	Anodyne	ADRB2	52	46
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251633	DE	On-Demand	Anodyne	ADRB1	79	52
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251633	DE	On-Demand	Anodyne	ADRB3	57	46
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872251633	DE	On-Demand	Anodyne	ABCB1	25	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251634	DE	On-Demand	Anodyne	ADRB2	52	46
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251634	DE	On-Demand	Anodyne	ADRB1	79	52
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251634	DE	On-Demand	Anodyne	ADRB3	57	46
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872251634	DE	On-Demand	Anodyne	ABCB1	25	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872251649	FG	On-Demand	Anodyne	GRIN1	22	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872251651	FG	On-Demand	Anodyne	GRIN1	22	40
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872251659	CE	On-Demand	Mild	ADRB2	29	56
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872251659	CE	On-Demand	Mild	ADRB1	70	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872251659	CE	On-Demand	Mild	ADRB3	19	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872251659	CE	On-Demand	Mild	CASR	42	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C#N)CC1	ZINC000872251659	CE	On-Demand	Mild	CYP2D6	18	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872251660	CE	On-Demand	Mild	ADRB2	29	56
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872251660	CE	On-Demand	Mild	ADRB1	70	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872251660	CE	On-Demand	Mild	ADRB3	19	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872251660	CE	On-Demand	Mild	CASR	42	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C#N)CC1	ZINC000872251660	CE	On-Demand	Mild	CYP2D6	18	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872251668	CG	On-Demand	Mild	ADRB3	17	44
Cc1nonc1CNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872251683	ED	On-Demand	Anodyne	ADRB2	36	41
Cc1nonc1CNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872251683	ED	On-Demand	Anodyne	ADRB1	44	40
Cc1nonc1CNC[C@@H](O)COc1ccc(Br)cc1	ZINC000872251683	ED	On-Demand	Anodyne	ADRB3	24	40
Cc1nonc1CNC[C@H](O)COc1ccc(Br)cc1	ZINC000872251684	ED	On-Demand	Anodyne	ADRB2	36	41
Cc1nonc1CNC[C@H](O)COc1ccc(Br)cc1	ZINC000872251684	ED	On-Demand	Anodyne	ADRB1	44	40
Cc1nonc1CNC[C@H](O)COc1ccc(Br)cc1	ZINC000872251684	ED	On-Demand	Anodyne	ADRB3	24	40
Cc1nonc1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872251693	CD	On-Demand	Anodyne	ADRB2	39	41
Cc1nonc1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872251693	CD	On-Demand	Anodyne	ADRB1	51	40
Cc1nonc1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000872251693	CD	On-Demand	Anodyne	ADRB3	27	40
Cc1nonc1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872251694	CD	On-Demand	Anodyne	ADRB2	39	41
Cc1nonc1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872251694	CD	On-Demand	Anodyne	ADRB1	51	40
Cc1nonc1CNC[C@H](O)COc1ccc(F)cc1	ZINC000872251694	CD	On-Demand	Anodyne	ADRB3	27	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000872251711	FD	On-Demand	Anodyne	ADRB2	21	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000872251711	FD	On-Demand	Anodyne	ADRB1	20	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1c(OC)cccc1OC	ZINC000872251713	FD	On-Demand	Anodyne	ADRB2	21	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1c(OC)cccc1OC	ZINC000872251713	FD	On-Demand	Anodyne	ADRB1	20	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251733	EG	On-Demand	Anodyne	ADRB2	33	54
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251735	EG	On-Demand	Anodyne	ADRB2	33	54
Cc1nonc1CNC[C@H](O)COc1ccc2ccccc2c1	ZINC000872251744	DE	On-Demand	Anodyne	ADRB2	41	55
Cc1nonc1CNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000872251745	DE	On-Demand	Anodyne	ADRB2	41	55
COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(NC(=O)NC4CC4)cc3)c2C)cc1	ZINC000872251783	HJ	On-Demand	Clean	CA1	17	41
COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(NC(=O)NC4CC4)cc3)c2C)cc1	ZINC000872251783	HJ	On-Demand	Clean	EPHX2	50	40
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872251821	HE	On-Demand	Mild	EPHX2	47	40
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872251821	HE	On-Demand	Mild	KCNK3	59	33
O=C(O)CCCC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872251836	CE	On-Demand	Anodyne	PREP	19	48
O=C(O)CCCC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872251837	CE	On-Demand	Anodyne	PREP	19	48
CC[C@@H](NC[C@@H](O)COCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000872251889	EF	On-Demand	Anodyne	ADRB2	24	46
Cc1nonc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000872251897	EE	On-Demand	Anodyne	EGFR	30	42
Cc1nonc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000872251897	EE	On-Demand	Anodyne	HDAC10	18	42
Cc1nonc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000872251897	EE	On-Demand	Anodyne	HDAC3	15	43
CC[C@@H](NC[C@@H](O)COCc1ccccc1)[C@H](O)c1ccccc1	ZINC000872251905	EF	On-Demand	Anodyne	ADRB2	24	46
CC[C@@H](NC[C@H](O)COCc1ccccc1)[C@H](O)c1ccccc1	ZINC000872251906	EF	On-Demand	Anodyne	ADRB2	24	46
CC[C@@H](NC[C@H](O)COCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000872251908	EF	On-Demand	Anodyne	ADRB2	24	46
CC[C@H](O)CN[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251911	CD	On-Demand	Anodyne	ADRB2	18	60
CC[C@H](O)CN[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251912	CD	On-Demand	Anodyne	ADRB2	18	60
CC[C@H](O)CN[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000872251915	CD	On-Demand	Anodyne	ADRB2	18	60
CC[C@H](O)CN[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000872251919	CD	On-Demand	Anodyne	ADRB2	18	60
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1F	ZINC000872251921	DE	On-Demand	Anodyne	ADRB2	33	51
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1F	ZINC000872251921	DE	On-Demand	Anodyne	ADRB1	62	39
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1F	ZINC000872251922	DE	On-Demand	Anodyne	ADRB2	33	51
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1F	ZINC000872251922	DE	On-Demand	Anodyne	ADRB1	62	39
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1F	ZINC000872251923	DE	On-Demand	Anodyne	ADRB2	33	51
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1F	ZINC000872251923	DE	On-Demand	Anodyne	ADRB1	62	39
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1F	ZINC000872251924	DE	On-Demand	Anodyne	ADRB2	33	51
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1F	ZINC000872251924	DE	On-Demand	Anodyne	ADRB1	62	39
CCOc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251936	DD	On-Demand	Anodyne	ADRB2	42	44
CCOc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251936	DD	On-Demand	Anodyne	ADRB1	51	44
CCOc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872251936	DD	On-Demand	Anodyne	ADRB3	29	40
CCOc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251937	DD	On-Demand	Anodyne	ADRB2	42	44
CCOc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251937	DD	On-Demand	Anodyne	ADRB1	51	44
CCOc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872251937	DD	On-Demand	Anodyne	ADRB3	29	40
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251941	DE	On-Demand	Anodyne	ADRB2	42	64
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251941	DE	On-Demand	Anodyne	ADRB1	39	48
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251941	DE	On-Demand	Anodyne	ADRB3	20	48
CCOC1CC2(C1)C[C@@H]2NCCC(=O)Nc1cccc(Br)c1	ZINC000872251943	FG	On-Demand	Anodyne	TIMP3	47	32
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251954	DE	On-Demand	Anodyne	ADRB2	42	64
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251954	DE	On-Demand	Anodyne	ADRB1	39	48
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251954	DE	On-Demand	Anodyne	ADRB3	20	48
Cc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251959	DE	On-Demand	Anodyne	ADRB2	42	64
Cc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251959	DE	On-Demand	Anodyne	ADRB1	39	48
Cc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872251959	DE	On-Demand	Anodyne	ADRB3	20	48
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251961	DE	On-Demand	Anodyne	ADRB2	42	64
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251961	DE	On-Demand	Anodyne	ADRB1	39	48
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872251961	DE	On-Demand	Anodyne	ADRB3	20	48
Cc1nonc1CNCCC(=O)N(C)c1ccccc1	ZINC000872251963	CD	On-Demand	Anodyne	CASP3	45	32
Cc1nonc1CNCCC(=O)N(C)c1ccccc1	ZINC000872251963	CD	On-Demand	Anodyne	CASP7	48	32
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872251965	EE	On-Demand	Mild	ADRB2	21	41
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872251965	EE	On-Demand	Mild	ADRB1	36	42
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872251967	EE	On-Demand	Mild	ADRB2	21	41
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872251967	EE	On-Demand	Mild	ADRB1	36	42
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccc(C)cc2)c1	ZINC000872251973	GE	On-Demand	Anodyne	ADRB2	35	57
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccc(C)cc2)c1	ZINC000872251973	GE	On-Demand	Anodyne	ADRB1	31	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000872251974	GE	On-Demand	Anodyne	ADRB2	35	57
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000872251974	GE	On-Demand	Anodyne	ADRB1	31	47
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(C)c1	ZINC000872251990	DE	On-Demand	Anodyne	ADRB2	29	54
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1cccc(C)c1	ZINC000872251990	DE	On-Demand	Anodyne	ADRB1	26	54
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(C)c1	ZINC000872251991	DE	On-Demand	Anodyne	ADRB2	29	54
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1cccc(C)c1	ZINC000872251991	DE	On-Demand	Anodyne	ADRB1	26	54
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872252003	DE	On-Demand	Bother	CACNA1C	54	37
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872252003	DE	On-Demand	Bother	CACNA1D	86	34
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872252007	DE	On-Demand	Bother	CACNA1C	54	37
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000872252007	DE	On-Demand	Bother	CACNA1D	86	34
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2)c1	ZINC000872252038	FE	On-Demand	Anodyne	ADRB2	55	55
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2)c1	ZINC000872252038	FE	On-Demand	Anodyne	ADRB1	55	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2)c1	ZINC000872252038	FE	On-Demand	Anodyne	ADRB3	37	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2)c1	ZINC000872252039	FE	On-Demand	Anodyne	ADRB2	55	55
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2)c1	ZINC000872252039	FE	On-Demand	Anodyne	ADRB1	55	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2)c1	ZINC000872252039	FE	On-Demand	Anodyne	ADRB3	37	47
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000872252062	EE	On-Demand	Anodyne	ADRB2	32	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000872252062	EE	On-Demand	Anodyne	ADRB1	26	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000872252062	EE	On-Demand	Anodyne	ADRB3	47	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000872252062	EE	On-Demand	Anodyne	AOC3	17	44
O=C(Nc1ccc(NC(=O)c2cccnc2SC(F)F)cc1)NC1CC1	ZINC000872252135	GH	On-Demand	Anodyne	EPHX2	45	40
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252141	HE	On-Demand	Mild	EPHX2	50	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252141	HE	On-Demand	Mild	CA12	19	42
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252141	HE	On-Demand	Mild	CA9	18	47
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252141	HE	On-Demand	Mild	MTCA1	31	47
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252141	HE	On-Demand	Mild	P96878_MYCTU	39	47
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252185	EE	On-Demand	Mild	ADRB2	32	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252185	EE	On-Demand	Mild	ADRB1	29	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252185	EE	On-Demand	Mild	ADRB3	20	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252186	EE	On-Demand	Mild	ADRB2	32	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252186	EE	On-Demand	Mild	ADRB1	29	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000872252186	EE	On-Demand	Mild	ADRB3	20	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000872252189	FF	On-Demand	Mild	GPR119	26	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000872252190	FF	On-Demand	Mild	GPR119	26	41
Cc1nonc1CNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252208	ED	On-Demand	Anodyne	ADRB2	22	44
Cc1nonc1CNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252208	ED	On-Demand	Anodyne	ADRB1	57	33
Cc1nonc1CNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252209	ED	On-Demand	Anodyne	ADRB2	22	44
Cc1nonc1CNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252209	ED	On-Demand	Anodyne	ADRB1	57	33
CSc1ccc(OC[C@H](O)CNCc2nonc2C)cc1	ZINC000872252216	DD	On-Demand	Anodyne	ADRB2	29	40
CSc1ccc(OC[C@@H](O)CNCc2nonc2C)cc1	ZINC000872252217	DD	On-Demand	Anodyne	ADRB2	29	40
CCOC1CC2(C1)C[C@@H]2NC[C@@H](O)COc1ccccc1F	ZINC000872252229	DE	On-Demand	Anodyne	ADRB2	22	40
CCOC1CC2(C1)C[C@@H]2NC[C@H](O)COc1ccccc1F	ZINC000872252231	DE	On-Demand	Anodyne	ADRB2	22	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000872252267	EE	On-Demand	Anodyne	ADRB2	32	56
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000872252267	EE	On-Demand	Anodyne	ADRB1	26	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000872252267	EE	On-Demand	Anodyne	ADRB3	47	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000872252267	EE	On-Demand	Anodyne	AOC3	17	44
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252304	CE	On-Demand	Anodyne	ADRB2	23	73
O[C@@H](CN[C@@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252304	CE	On-Demand	Anodyne	ADRB1	29	73
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252305	CE	On-Demand	Anodyne	ADRB2	23	73
O[C@@H](CN[C@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252305	CE	On-Demand	Anodyne	ADRB1	29	73
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252306	CE	On-Demand	Anodyne	ADRB2	23	73
O[C@H](CN[C@@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252306	CE	On-Demand	Anodyne	ADRB1	29	73
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252308	CE	On-Demand	Anodyne	ADRB2	23	73
O[C@H](CN[C@H]1CC12CCC2)COc1cccc2[nH]ccc12	ZINC000872252308	CE	On-Demand	Anodyne	ADRB1	29	73
C/C=C/c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872252317	FF	On-Demand	Anodyne	ADRB2	18	70
C/C=C\c1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)c(OC)c1	ZINC000872252319	FF	On-Demand	Anodyne	ADRB2	18	70
C/C=C\c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872252321	FF	On-Demand	Anodyne	ADRB2	18	70
C/C=C/c1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)c(OC)c1	ZINC000872252322	FF	On-Demand	Anodyne	ADRB2	18	70
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252335	ED	On-Demand	Mild	ADRB2	39	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252335	ED	On-Demand	Mild	ADRB1	43	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252335	ED	On-Demand	Mild	ADRB3	25	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252336	ED	On-Demand	Mild	ADRB2	39	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252336	ED	On-Demand	Mild	ADRB1	43	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000872252336	ED	On-Demand	Mild	ADRB3	25	47
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872252337	EB	On-Demand	Anodyne	ADRB2	32	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872252337	EB	On-Demand	Anodyne	ADRB1	51	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872252337	EB	On-Demand	Anodyne	ADRB3	31	40
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252338	ED	On-Demand	Mild	ADRB2	39	47
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252338	ED	On-Demand	Mild	ADRB1	43	47
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252338	ED	On-Demand	Mild	ADRB3	25	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252339	ED	On-Demand	Mild	ADRB2	39	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252339	ED	On-Demand	Mild	ADRB1	43	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000872252339	ED	On-Demand	Mild	ADRB3	25	47
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252342	GG	On-Demand	Anodyne	MAOA	33	40
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252342	GG	On-Demand	Anodyne	MAOB	17	45
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252342	GG	On-Demand	Anodyne	EPHX2	49	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2ccccc12	ZINC000872252345	DD	On-Demand	Anodyne	ADRB2	29	52
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2ccccc12	ZINC000872252345	DD	On-Demand	Anodyne	ADRB1	26	52
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2ccccc12	ZINC000872252345	DD	On-Demand	Anodyne	ADRB3	16	52
CC(=O)N/C(=C/c1ccccc1)C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252347	GG	On-Demand	Anodyne	EPHX2	49	43
CC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252348	GG	On-Demand	Anodyne	EPHX2	49	43
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(F)cc1	ZINC000872252354	CC	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(F)cc1	ZINC000872252354	CC	On-Demand	Anodyne	ADRB1	36	41
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(F)cc1	ZINC000872252354	CC	On-Demand	Anodyne	ADRB3	18	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252368	DF	On-Demand	Mild	ADRB2	36	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252368	DF	On-Demand	Mild	ADRB1	45	49
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252368	DF	On-Demand	Mild	ADRB3	27	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252369	FE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252369	FE	On-Demand	Anodyne	ADRB1	69	55
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252369	FE	On-Demand	Anodyne	ADRB3	47	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252370	FE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252370	FE	On-Demand	Anodyne	ADRB1	69	55
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252370	FE	On-Demand	Anodyne	ADRB3	47	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252371	FE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252371	FE	On-Demand	Anodyne	ADRB1	69	55
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872252371	FE	On-Demand	Anodyne	ADRB3	47	47
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252372	DF	On-Demand	Mild	ADRB2	36	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252372	DF	On-Demand	Mild	ADRB1	45	49
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)CC1	ZINC000872252372	DF	On-Demand	Mild	ADRB3	27	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252373	FE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252373	FE	On-Demand	Anodyne	ADRB1	69	55
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872252373	FE	On-Demand	Anodyne	ADRB3	47	47
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(Cl)cc1	ZINC000872252375	DC	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)c1	ZINC000872252387	DC	On-Demand	Anodyne	ADRB2	22	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)c1	ZINC000872252387	DC	On-Demand	Anodyne	ABCB1	15	43
O=C(Nc1ccc(NC(=O)c2ccc(C3SCCS3)cc2)cc1)NC1CC1	ZINC000872252391	GJ	On-Demand	Anodyne	EPHX2	55	43
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	LPL	33	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	NR1H4	17	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	MTOR	24	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	EPHX2	67	52
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	TGM2	66	38
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	F13A1	67	37
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	MERTK	39	49
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	P96878_MYCTU	16	42
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1)NC1CC1	ZINC000872252394	JE	On-Demand	Anodyne	NAMPT	27	44
CC(=O)N[C@@H](CC(=O)Nc1ccc(N2CCCC2)cc1)c1ccc(Br)cc1	ZINC000872252395	II	On-Demand	Anodyne	KCNQ2	26	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000872252398	DF	On-Demand	Mild	ADRB2	25	52
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000872252398	DF	On-Demand	Mild	ADRB1	24	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000872252399	DF	On-Demand	Mild	ADRB2	25	52
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000872252399	DF	On-Demand	Mild	ADRB1	24	42
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252411	IK	On-Demand	Anodyne	EPHX2	85	42
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252411	IK	On-Demand	Anodyne	BOTA	29	41
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872252412	FH	On-Demand	Bother	MAOB	18	40
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872252412	FH	On-Demand	Bother	EPHX2	46	44
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872252412	FH	On-Demand	Bother	TAAR1	29	54
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872252412	FH	On-Demand	Bother	IMDH_CRYPV	18	40
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872252416	IK	On-Demand	Anodyne	DHODH	17	42
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872252416	IK	On-Demand	Anodyne	TACR3	24	46
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872252416	IK	On-Demand	Anodyne	MST1R	41	36
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872252416	IK	On-Demand	Anodyne	MET	15	43
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872252416	IK	On-Demand	Anodyne	CYP2C9	16	59
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC1	ZINC000872252418	CE	On-Demand	Mild	ADRB2	47	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC1	ZINC000872252418	CE	On-Demand	Mild	ADRB1	65	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC1	ZINC000872252418	CE	On-Demand	Mild	ADRB3	47	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)CC1	ZINC000872252419	CE	On-Demand	Mild	ADRB2	47	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)CC1	ZINC000872252419	CE	On-Demand	Mild	ADRB1	65	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)CC1	ZINC000872252419	CE	On-Demand	Mild	ADRB3	47	48
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872252423	HH	On-Demand	Anodyne	MTOR	32	51
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872252423	HH	On-Demand	Anodyne	EPHX2	94	53
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872252423	HH	On-Demand	Anodyne	TGM2	20	43
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872252423	HH	On-Demand	Anodyne	F13A1	29	43
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872252423	HH	On-Demand	Anodyne	GPR119	48	47
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)CC1	ZINC000872252425	DE	On-Demand	Mild	ADRB1	19	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000872252426	DE	On-Demand	Mild	ADRB1	19	44
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	CNR1	16	60
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	LPL	49	43
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	CNR2	22	73
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	CPT1A	67	41
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	CPT2	47	36
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	EPHX2	77	50
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	TGM2	40	34
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	CPT1B	41	36
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1)NC1CC1	ZINC000872252427	JI	On-Demand	Anodyne	LIPG	20	43
O=C(Nc1ccc(NC(=O)C(F)F)cc1)NC1CC1	ZINC000872252429	CE	On-Demand	Anodyne	EPHX2	72	51
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252430	JF	On-Demand	Anodyne	EPHX2	49	43
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252430	JF	On-Demand	Anodyne	MTCA1	15	42
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252430	JF	On-Demand	Anodyne	P96878_MYCTU	20	42
O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252431	FI	On-Demand	Anodyne	MMP2	15	64
O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252431	FI	On-Demand	Anodyne	EPHX2	48	52
O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252431	FI	On-Demand	Anodyne	MCHR1	16	48
O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252432	FI	On-Demand	Anodyne	MMP2	15	64
O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252432	FI	On-Demand	Anodyne	EPHX2	48	52
O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252432	FI	On-Demand	Anodyne	MCHR1	16	48
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252434	CC	On-Demand	Mild	ADRB2	21	54
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252434	CC	On-Demand	Mild	ADRB1	65	45
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252434	CC	On-Demand	Mild	CASR	41	43
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252434	CC	On-Demand	Mild	CYP2D6	19	44
C=CCOc1ccc(/C=C\C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1OC	ZINC000872252436	HI	On-Demand	Mild	EPHX2	41	37
C=CCOc1ccc(/C=C\C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1OC	ZINC000872252436	HI	On-Demand	Mild	PDGFRA	23	42
C=CCOc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1OC	ZINC000872252437	HI	On-Demand	Mild	EPHX2	41	37
C=CCOc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1OC	ZINC000872252437	HI	On-Demand	Mild	PDGFRA	23	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000872252438	CE	On-Demand	Mild	ADRB2	15	40
O[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872252441	CD	On-Demand	Anodyne	ADRB1	28	42
O[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872252441	CD	On-Demand	Anodyne	ADRB3	43	45
O[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000872252441	CD	On-Demand	Anodyne	CYP3A4	48	38
C[C@@](O)(C[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872252443	FF	On-Demand	Anodyne	CHEK2	45	33
C[C@@](O)(C[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872252443	FF	On-Demand	Anodyne	NR2E3	69	38
C[C@@](O)(C[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872252444	FF	On-Demand	Anodyne	CHEK2	45	33
C[C@@](O)(C[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872252444	FF	On-Demand	Anodyne	NR2E3	69	38
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	LPL	48	42
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	CNR2	19	71
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	CPT1A	69	41
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	CPT2	48	37
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	EPHX2	77	48
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	TGM2	42	34
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	CPT1B	43	36
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1)NC1CC1	ZINC000872252446	JH	On-Demand	Anodyne	LIPG	19	42
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA2	76	63
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA1	72	63
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA7	48	41
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA4	59	45
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA5A	42	35
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	EPHX2	52	43
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA12	69	63
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CA9	68	63
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	CYNT	16	40
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	NCE103	34	49
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	MTCA1	56	63
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252447	JF	On-Demand	Anodyne	P96878_MYCTU	70	63
O=C(c1csc(NC2CC2)n1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872252455	GD	On-Demand	Anodyne	TRPC6	52	39
O=C(c1csc(NC2CC2)n1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872252455	GD	On-Demand	Anodyne	TRPC3	46	39
CC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252463	EG	On-Demand	Anodyne	KCNQ2	52	47
CC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252463	EG	On-Demand	Anodyne	PRNP	44	40
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252465	DE	On-Demand	Mild	ADRB2	34	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252465	DE	On-Demand	Mild	ADRB1	50	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252465	DE	On-Demand	Mild	ADRB3	32	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252467	DE	On-Demand	Mild	ADRB2	34	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252467	DE	On-Demand	Mild	ADRB1	50	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000872252467	DE	On-Demand	Mild	ADRB3	32	44
O=C(/C=C\c1ccco1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252478	DG	On-Demand	Anodyne	EPHX2	47	41
O=C(/C=C/c1ccco1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252479	DG	On-Demand	Anodyne	EPHX2	47	41
O=C(c1cnn(CC2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872252496	GD	On-Demand	Anodyne	L3MBTL3	54	34
CSCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872252499	DE	On-Demand	Anodyne	DPP7	82	43
CSCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872252500	DE	On-Demand	Anodyne	DPP7	82	43
CSCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872252501	DE	On-Demand	Anodyne	DPP7	82	43
CSCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872252502	DE	On-Demand	Anodyne	DPP7	82	43
Cc1nc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc2o1	ZINC000872252540	FD	On-Demand	Anodyne	L3MBTL3	60	36
Cn1cc(/C=C\C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c(=O)n(C)c1=O	ZINC000872252543	GD	On-Demand	Anodyne	EPHX2	41	37
Cn1cc(/C=C/C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c(=O)n(C)c1=O	ZINC000872252544	GD	On-Demand	Anodyne	EPHX2	41	37
O=C(Nc1ccc(NC(=O)C23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)cc1)NC1CC1	ZINC000872252552	IJ	On-Demand	Anodyne	EPHX2	79	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CN2CCCC2)c1	ZINC000872252572	ED	On-Demand	Anodyne	ADRB2	15	55
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CN2CCCC2)c1	ZINC000872252572	ED	On-Demand	Anodyne	ABCB1	19	41
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CN2CCCC2)c1	ZINC000872252575	ED	On-Demand	Anodyne	ADRB2	15	55
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CN2CCCC2)c1	ZINC000872252575	ED	On-Demand	Anodyne	ABCB1	19	41
O=C(/C=C\c1ccc(Cl)s1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252598	FI	On-Demand	Anodyne	EPHX2	49	44
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252624	FF	On-Demand	Anodyne	ADRB2	32	49
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252624	FF	On-Demand	Anodyne	ADRB1	59	38
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252625	FF	On-Demand	Anodyne	ADRB2	32	49
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252625	FF	On-Demand	Anodyne	ADRB1	59	38
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252626	FF	On-Demand	Anodyne	ADRB2	32	49
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000872252626	FF	On-Demand	Anodyne	ADRB1	59	38
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252627	FF	On-Demand	Anodyne	ADRB2	32	49
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000872252627	FF	On-Demand	Anodyne	ADRB1	59	38
CC[C@@H](NCCC(=O)N(C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000872252664	EG	On-Demand	Anodyne	NPY5R	20	40
CC[C@@H](NCCC(=O)N(C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000872252665	EG	On-Demand	Anodyne	NPY5R	20	40
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252683	DF	On-Demand	Mild	ADRB2	32	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252683	DF	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252683	DF	On-Demand	Mild	ADRB3	29	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252684	DF	On-Demand	Mild	ADRB2	32	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252684	DF	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000872252684	DF	On-Demand	Mild	ADRB3	29	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252685	EF	On-Demand	Mild	ADRB2	46	43
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252685	EF	On-Demand	Mild	ADRB1	75	52
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252685	EF	On-Demand	Mild	ADRB3	54	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252685	EF	On-Demand	Mild	ABCB1	18	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252686	EF	On-Demand	Mild	ADRB2	46	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252686	EF	On-Demand	Mild	ADRB1	75	52
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252686	EF	On-Demand	Mild	ADRB3	54	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)CC1	ZINC000872252686	EF	On-Demand	Mild	ABCB1	18	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872252688	CE	On-Demand	Mild	ADRB2	32	53
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872252688	CE	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000872252688	CE	On-Demand	Mild	ADRB3	28	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872252689	CE	On-Demand	Mild	ADRB2	32	53
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872252689	CE	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000872252689	CE	On-Demand	Mild	ADRB3	28	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C)CC1	ZINC000872252691	CF	On-Demand	Mild	ADRB2	40	53
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C)CC1	ZINC000872252691	CF	On-Demand	Mild	ADRB1	40	33
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C)CC1	ZINC000872252691	CF	On-Demand	Mild	ADRB3	20	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2C)CC1	ZINC000872252691	CF	On-Demand	Mild	ABCB1	25	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C)CC1	ZINC000872252692	CF	On-Demand	Mild	ADRB2	40	53
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C)CC1	ZINC000872252692	CF	On-Demand	Mild	ADRB1	40	33
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C)CC1	ZINC000872252692	CF	On-Demand	Mild	ADRB3	20	43
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2C)CC1	ZINC000872252692	CF	On-Demand	Mild	ABCB1	25	45
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872252693	CC	On-Demand	Mild	ADRB1	27	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000872252694	DF	On-Demand	Mild	ADRB2	23	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000872252694	DF	On-Demand	Mild	ADRB1	15	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000872252695	DF	On-Demand	Mild	ADRB2	23	44
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000872252695	DF	On-Demand	Mild	ADRB1	15	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(CC)c2)CC1	ZINC000872252699	DF	On-Demand	Mild	ADRB2	34	50
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(CC)c2)CC1	ZINC000872252699	DF	On-Demand	Mild	ADRB1	45	50
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(CC)c2)CC1	ZINC000872252699	DF	On-Demand	Mild	ADRB3	34	50
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(CC)c2)CC1	ZINC000872252699	DF	On-Demand	Mild	PDS	41	32
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(CC)c2)CC1	ZINC000872252700	DF	On-Demand	Mild	ADRB2	34	50
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(CC)c2)CC1	ZINC000872252700	DF	On-Demand	Mild	ADRB1	45	50
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(CC)c2)CC1	ZINC000872252700	DF	On-Demand	Mild	ADRB3	34	50
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(CC)c2)CC1	ZINC000872252700	DF	On-Demand	Mild	PDS	41	32
O=C(Nc1ccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1)NC1CC1	ZINC000872252702	GJ	On-Demand	Anodyne	MAPK14	24	45
O=C(Nc1ccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1)NC1CC1	ZINC000872252702	GJ	On-Demand	Anodyne	EPHX2	48	39
NC(=O)NCC(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252703	CC	On-Demand	Anodyne	KCNQ2	28	46
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252704	HI	On-Demand	Anodyne	EPHX2	52	45
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252704	HI	On-Demand	Anodyne	GIPR	45	38
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872252704	HI	On-Demand	Anodyne	NOD2	40	33
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C)cc2C)CC1	ZINC000872252706	DF	On-Demand	Mild	ADRB2	20	44
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C)cc2C)CC1	ZINC000872252707	DF	On-Demand	Mild	ADRB2	20	44
O=C(/C=C\c1ccccc1Cl)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252708	FI	On-Demand	Anodyne	EPHX2	50	43
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)cc1)NC1CC1	ZINC000872252710	JH	On-Demand	Anodyne	EPHX2	46	43
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)cc1)NC1CC1	ZINC000872252710	JH	On-Demand	Anodyne	CCR8	63	33
O=C(/C=C\c1ccc(Br)o1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252711	GH	On-Demand	Anodyne	EPHX2	43	44
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)cc1	ZINC000872252716	IK	On-Demand	Anodyne	HDAC1	21	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)cc1	ZINC000872252716	IK	On-Demand	Anodyne	HDAC2	21	41
N#Cc1ccccc1/C=C\C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252723	EG	On-Demand	Mild	EPHX2	42	39
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252725	JI	On-Demand	Anodyne	CA1	27	41
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252725	JI	On-Demand	Anodyne	SSTR5	34	46
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252725	JI	On-Demand	Anodyne	EPHX2	48	40
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252725	JI	On-Demand	Anodyne	KCNK3	74	45
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252725	JI	On-Demand	Anodyne	KCNK9	53	45
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA2	77	62
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA1	71	62
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA7	49	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA4	63	49
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA5A	42	36
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA14	36	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	EPHX2	58	47
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA12	68	62
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	CA9	66	62
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	IDO1	16	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	NCE103	33	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	MTCA1	54	62
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872252736	GE	On-Demand	Anodyne	P96878_MYCTU	67	62
O=C(/C=C\c1cnc2ccccc2n1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252745	FH	On-Demand	Anodyne	EPHX2	41	38
O=C(/C=C/c1cnc2ccccc2n1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252746	FH	On-Demand	Anodyne	EPHX2	41	38
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252750	EC	On-Demand	Anodyne	ADRB2	21	43
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCOC[C@H]1O	ZINC000872252750	EC	On-Demand	Anodyne	ADRB1	23	43
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	CHRNA7	24	42
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	TACR3	31	45
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	CYP2C9	19	59
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	NR2E3	52	33
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	SMO	24	40
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	MT-CO2	50	39
O=C(Nc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)NC1CC1	ZINC000872252752	HJ	On-Demand	Anodyne	NAMPT	42	39
C[C@@](O)(CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C(F)(F)F	ZINC000872252754	EG	On-Demand	Anodyne	CHEK2	52	35
C[C@@](O)(CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C(F)(F)F	ZINC000872252754	EG	On-Demand	Anodyne	HPSE	17	42
C[C@@](O)(CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C(F)(F)F	ZINC000872252754	EG	On-Demand	Anodyne	NR2E3	73	39
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)CC1	ZINC000872252755	HI	On-Demand	Anodyne	EPHX2	22	40
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)CC1	ZINC000872252755	HI	On-Demand	Anodyne	GPR119	53	46
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)CC1	ZINC000872252755	HI	On-Demand	Anodyne	SFRP1	32	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	LPL	50	44
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	GRM4	22	42
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	EPHX2	71	48
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	TGM2	74	41
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	F13A1	80	45
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	NR2E3	44	34
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	MERTK	27	43
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	LIPG	20	44
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	P96878_MYCTU	24	48
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1)NC1CC1	ZINC000872252762	JI	On-Demand	Anodyne	NAMPT	38	47
Cn1cc(/C=C\C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cn1	ZINC000872252765	EE	On-Demand	Anodyne	EPHX2	46	40
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	AVPR2	45	40
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	MAPK14	22	48
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	CA1	21	42
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	TRPV1	15	46
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	PRNP	75	60
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	HDAC1	19	48
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	HDAC2	15	48
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	MTOR	34	50
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	EPHX2	64	49
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	MCHR1	23	56
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	LUCI_LUCLA	32	41
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	SMO	38	43
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	DGAT1	45	50
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	P96878_MYCTU	15	45
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	KDM1A	16	46
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	Q25615_ONCVO	17	40
O=C(Nc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)NC1CC1	ZINC000872252767	FJ	On-Demand	Anodyne	KCNK3	57	40
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252772	JG	On-Demand	Mild	EPHX2	28	40
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252776	JG	On-Demand	Mild	EPHX2	28	40
O=C(Nc1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)NC1CC1	ZINC000872252788	FH	On-Demand	Anodyne	EPHX2	52	49
O=C(Nc1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)NC1CC1	ZINC000872252788	FH	On-Demand	Anodyne	TYK2	48	35
CCOC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872252792	DE	On-Demand	Anodyne	CHEK2	46	39
CCOC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872252792	DE	On-Demand	Anodyne	HPSE	15	40
CCOC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872252792	DE	On-Demand	Anodyne	NR2E3	69	39
Cc1cc(OCC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)no1	ZINC000872252794	EE	On-Demand	Anodyne	KIT	15	40
Cc1cc(OCC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)no1	ZINC000872252794	EE	On-Demand	Anodyne	ADORA2B	29	41
Cc1cc(OCC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)no1	ZINC000872252794	EE	On-Demand	Anodyne	EPHX2	55	43
Cc1cc(OCC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)no1	ZINC000872252794	EE	On-Demand	Anodyne	MCHR1	17	42
O=C(/C=C/Sc1ccccc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252804	FI	On-Demand	Anodyne	EPHX2	52	43
O=C(/C=C\Sc1ccccc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252808	FI	On-Demand	Anodyne	EPHX2	52	43
O=C(c1cnc2ccccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872252815	FD	On-Demand	Anodyne	L3MBTL3	50	37
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCCC3)cc2)cc1	ZINC000872252820	GG	On-Demand	Anodyne	HDAC8	23	45
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCCC3)cc2)cc1	ZINC000872252820	GG	On-Demand	Anodyne	HDAC1	26	47
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCCC3)cc2)cc1	ZINC000872252820	GG	On-Demand	Anodyne	MCHR1	15	41
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCCC3)cc2)cc1	ZINC000872252820	GG	On-Demand	Anodyne	F13A1	39	41
CC[C@H](O)CN[C@H](CC)[C@H](O)c1ccccc1	ZINC000872252823	BD	On-Demand	Anodyne	AOC3	20	47
CC[C@H](O)CN[C@@H](CC)[C@@H](O)c1ccccc1	ZINC000872252826	BD	On-Demand	Anodyne	AOC3	20	47
CC[C@H](O)CN[C@@H](CC)[C@H](O)c1ccccc1	ZINC000872252828	BD	On-Demand	Anodyne	AOC3	20	47
CC[C@H](O)CN[C@H](CC)[C@@H](O)c1ccccc1	ZINC000872252829	BD	On-Demand	Anodyne	AOC3	20	47
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252831	DE	On-Demand	Anodyne	ADRB2	52	63
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252831	DE	On-Demand	Anodyne	ADRB1	75	63
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252831	DE	On-Demand	Anodyne	ADRB3	50	46
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252833	DE	On-Demand	Anodyne	ADRB2	52	63
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252833	DE	On-Demand	Anodyne	ADRB1	75	63
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC23CCC3)cc1	ZINC000872252833	DE	On-Demand	Anodyne	ADRB3	50	46
COCCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252834	DE	On-Demand	Anodyne	ADRB2	52	63
COCCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252834	DE	On-Demand	Anodyne	ADRB1	75	63
COCCc1ccc(OC[C@@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252834	DE	On-Demand	Anodyne	ADRB3	50	46
COCCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252836	DE	On-Demand	Anodyne	ADRB2	52	63
COCCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252836	DE	On-Demand	Anodyne	ADRB1	75	63
COCCc1ccc(OC[C@H](O)CN[C@H]2CC23CCC3)cc1	ZINC000872252836	DE	On-Demand	Anodyne	ADRB3	50	46
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252861	FH	On-Demand	Anodyne	ADRB2	58	54
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252861	FH	On-Demand	Anodyne	ADRB1	64	45
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252861	FH	On-Demand	Anodyne	ADRB3	42	45
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252862	FH	On-Demand	Anodyne	ADRB2	58	54
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252862	FH	On-Demand	Anodyne	ADRB1	64	45
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252862	FH	On-Demand	Anodyne	ADRB3	42	45
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252863	FH	On-Demand	Anodyne	ADRB2	58	54
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252863	FH	On-Demand	Anodyne	ADRB1	64	45
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252863	FH	On-Demand	Anodyne	ADRB3	42	45
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252864	FH	On-Demand	Anodyne	ADRB2	58	54
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252864	FH	On-Demand	Anodyne	ADRB1	64	45
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000872252864	FH	On-Demand	Anodyne	ADRB3	42	45
O=C(CCN[C@@H]1CC12CCC2)Nc1cccnc1	ZINC000872252871	BD	On-Demand	Anodyne	NAMPT	27	40
O=C(CCN[C@H]1CC12CCC2)Nc1cccnc1	ZINC000872252873	BD	On-Demand	Anodyne	NAMPT	27	40
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2[nH]ccc12	ZINC000872252879	DC	On-Demand	Anodyne	ADRB2	17	69
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2[nH]ccc12	ZINC000872252879	DC	On-Demand	Anodyne	ADRB1	24	69
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2[nH]ccc12	ZINC000872252879	DC	On-Demand	Anodyne	HTR1A	16	69
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc2[nH]ccc12	ZINC000872252879	DC	On-Demand	Anodyne	SLC6A4	18	42
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CC(F)(F)F	ZINC000872252882	EG	On-Demand	Anodyne	NR2E3	70	38
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CC(F)(F)F	ZINC000872252887	EG	On-Demand	Anodyne	NR2E3	70	38
NC(=O)CC[C@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252895	JD	On-Demand	Anodyne	TRY2_BOVIN	67	37
NC(=O)CC[C@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252895	JD	On-Demand	Anodyne	ST14	52	38
NC(=O)CC[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252898	JD	On-Demand	Anodyne	TRY2_BOVIN	67	37
NC(=O)CC[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000872252898	JD	On-Demand	Anodyne	ST14	52	38
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	LTA4H	56	46
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	ADORA2A	15	46
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	ADORA2B	46	46
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	CA1	36	45
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	S1PR4	30	43
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	HDAC8	16	41
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	ROCK2	15	40
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	FAAH	25	41
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	EPHX2	67	49
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	CA12	15	45
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	SLC1A2	21	41
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	CA9	17	45
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	MCHR1	30	41
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	NCE103	17	42
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	DGAT1	21	42
O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872252899	HJ	On-Demand	Anodyne	TNKS	56	32
C[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)S(C)(=O)=O	ZINC000872252902	EE	On-Demand	Anodyne	CHEK2	40	40
C[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)S(C)(=O)=O	ZINC000872252902	EE	On-Demand	Anodyne	HPSE	17	41
C[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)S(C)(=O)=O	ZINC000872252902	EE	On-Demand	Anodyne	NR2E3	72	42
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2ccccc2F)c1	ZINC000872252931	GF	On-Demand	Anodyne	MTNR1B	31	41
O=C(Nc1ccc(NC(=O)c2ccnc(Cl)c2)cc1)NC1CC1	ZINC000872252936	EG	On-Demand	Anodyne	RAF1	17	43
O=C(Nc1ccc(NC(=O)c2ccnc(Cl)c2)cc1)NC1CC1	ZINC000872252936	EG	On-Demand	Anodyne	EPHX2	52	47
O=C(Nc1ccc(NC(=O)c2ccnc(Cl)c2)cc1)NC1CC1	ZINC000872252936	EG	On-Demand	Anodyne	PDGFRA	15	41
O=C(Nc1ccc(NC(=O)c2ccnc(Cl)c2)cc1)NC1CC1	ZINC000872252936	EG	On-Demand	Anodyne	TYK2	63	37
O=C(Nc1ccc(NC(=O)c2ccnc(Cl)c2)cc1)NC1CC1	ZINC000872252936	EG	On-Demand	Anodyne	KDM4E	21	43
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCC1	ZINC000872252938	CF	On-Demand	Anodyne	CHEK2	80	38
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCC1	ZINC000872252938	CF	On-Demand	Anodyne	HPSE	15	40
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCC1	ZINC000872252938	CF	On-Demand	Anodyne	NR2E3	75	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000872252962	GE	On-Demand	Anodyne	ADRB2	35	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000872252962	GE	On-Demand	Anodyne	ADRB1	33	46
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000872252963	GE	On-Demand	Anodyne	ADRB2	35	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000872252963	GE	On-Demand	Anodyne	ADRB1	33	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252964	DE	On-Demand	Mild	ADRB2	34	46
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252964	DE	On-Demand	Mild	ADRB1	52	52
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252964	DE	On-Demand	Mild	ADRB3	34	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252966	DE	On-Demand	Mild	ADRB2	34	46
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252966	DE	On-Demand	Mild	ADRB1	52	52
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000872252966	DE	On-Demand	Mild	ADRB3	34	42
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)ccc1Br	ZINC000872252972	JG	On-Demand	Anodyne	EPHX2	46	39
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)ccc1Br	ZINC000872252972	JG	On-Demand	Anodyne	P96878_MYCTU	26	44
Cc1ccc(F)c2[nH]c(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc12	ZINC000872252986	GE	On-Demand	Anodyne	HRH4	18	47
COc1ccc2c(C)c(CCC(=O)Nc3ccc(NC(=O)NC4CC4)cc3)c(=O)oc2c1	ZINC000872252995	IH	On-Demand	Anodyne	MAOB	36	45
COc1ccc2c(C)c(CCC(=O)Nc3ccc(NC(=O)NC4CC4)cc3)c(=O)oc2c1	ZINC000872252995	IH	On-Demand	Anodyne	EPHX2	43	35
COc1ccc2c(C)c(CCC(=O)Nc3ccc(NC(=O)NC4CC4)cc3)c(=O)oc2c1	ZINC000872252995	IH	On-Demand	Anodyne	NQO1	23	44
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2C)c1	ZINC000872253037	GE	On-Demand	Anodyne	ADRB2	43	59
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2C)c1	ZINC000872253037	GE	On-Demand	Anodyne	ADRB1	31	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)COc2ccccc2C)c1	ZINC000872253037	GE	On-Demand	Anodyne	ABCB1	36	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2C)c1	ZINC000872253038	GE	On-Demand	Anodyne	ADRB2	43	59
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2C)c1	ZINC000872253038	GE	On-Demand	Anodyne	ADRB1	31	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)COc2ccccc2C)c1	ZINC000872253038	GE	On-Demand	Anodyne	ABCB1	36	40
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	KIT	15	42
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	LCK	27	42
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	KDR	18	42
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	SLC1A1	20	41
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	SLC1A3	18	41
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	CCR2	43	39
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	SLC1A2	32	41
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	BTK	19	42
Cc1nccnc1[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253065	FG	On-Demand	Anodyne	KCNK3	19	40
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	KIT	15	42
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	LCK	27	42
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	KDR	18	42
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	SLC1A1	20	41
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	SLC1A3	18	41
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	CCR2	43	39
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	SLC1A2	32	41
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	BTK	19	42
Cc1nccnc1[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000872253066	FG	On-Demand	Anodyne	KCNK3	19	40
O=C(c1ccc(-c2cnc[nH]2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253103	GD	On-Demand	Anodyne	L3MBTL3	58	36
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2cccc(F)c2)c1	ZINC000872253108	GF	On-Demand	Anodyne	MTNR1B	38	42
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2cccc(F)c2)c1	ZINC000872253108	GF	On-Demand	Anodyne	KCNK3	47	38
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(=O)Nc2cccc(F)c2)c1	ZINC000872253108	GF	On-Demand	Anodyne	KCNK9	41	38
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872253149	EE	On-Demand	Anodyne	ADRB2	27	69
Cc1nccnc1[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872253149	EE	On-Demand	Anodyne	ADRB1	37	69
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872253150	EE	On-Demand	Anodyne	ADRB2	27	69
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000872253150	EE	On-Demand	Anodyne	ADRB1	37	69
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872253151	EE	On-Demand	Anodyne	ADRB2	27	69
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872253151	EE	On-Demand	Anodyne	ADRB1	37	69
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872253152	EE	On-Demand	Anodyne	ADRB2	27	69
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000872253152	EE	On-Demand	Anodyne	ADRB1	37	69
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872253161	DF	On-Demand	Anodyne	ADRB3	29	42
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872253161	DF	On-Demand	Anodyne	KCNA5	17	41
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@@H](O)c1ccccc1	ZINC000872253161	DF	On-Demand	Anodyne	NAMPT	17	41
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@H](O)c1ccccc1	ZINC000872253163	DF	On-Demand	Anodyne	ADRB3	29	42
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@H](O)c1ccccc1	ZINC000872253163	DF	On-Demand	Anodyne	KCNA5	17	41
CC[C@@H](NCCC(=O)Nc1cccnc1)[C@H](O)c1ccccc1	ZINC000872253163	DF	On-Demand	Anodyne	NAMPT	17	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000872253210	CF	On-Demand	Mild	ADRB2	35	56
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000872253210	CF	On-Demand	Mild	ADRB1	36	56
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000872253210	CF	On-Demand	Mild	ADRB3	25	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000872253211	CF	On-Demand	Mild	ADRB2	35	56
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000872253211	CF	On-Demand	Mild	ADRB1	36	56
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000872253211	CF	On-Demand	Mild	ADRB3	25	41
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	CCKAR	22	40
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	PRS	37	45
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	TACR3	46	53
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	EPHX2	44	37
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	CYP2C9	17	63
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	NR2E3	64	36
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	SMO	28	43
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	TNKS	56	35
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1)NC1CC1	ZINC000872253215	HK	On-Demand	Anodyne	MT-CO2	57	45
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1cccc(C(F)(F)F)c1	ZINC000872253216	ED	On-Demand	Anodyne	PDS	44	38
O=C(Nc1ccc(NC(=O)c2cc(Cl)c3c(c2)OCCO3)cc1)NC1CC1	ZINC000872253217	GH	On-Demand	Anodyne	CPT1A	15	41
O=C(Nc1ccc(NC(=O)c2cc(Cl)c3c(c2)OCCO3)cc1)NC1CC1	ZINC000872253217	GH	On-Demand	Anodyne	EPHX2	44	43
O=C(CNS(=O)(=O)c1ccccc1F)Nc1ccc(N2CCCC2)cc1	ZINC000872253218	GE	On-Demand	Anodyne	KCNQ2	36	43
O=C(Nc1ccc(NC(=O)c2cc3c(F)cccc3s2)cc1)NC1CC1	ZINC000872253221	FJ	On-Demand	Anodyne	EPHX2	57	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc2ccccc2c1	ZINC000872253222	DD	On-Demand	Anodyne	ADRB2	30	52
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000872253225	DF	On-Demand	Mild	ADRB2	27	45
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000872253225	DF	On-Demand	Mild	ADRB1	23	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000872253226	DF	On-Demand	Mild	ADRB2	27	45
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000872253226	DF	On-Demand	Mild	ADRB1	23	45
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253229	CF	On-Demand	Anodyne	CHEK2	68	34
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253229	CF	On-Demand	Anodyne	NR2E3	79	44
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253230	CF	On-Demand	Anodyne	CHEK2	68	34
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253230	CF	On-Demand	Anodyne	NR2E3	79	44
CON=Cc1ccc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1	ZINC000872253232	FG	On-Demand	Mild	EPHX2	54	45
O=C(Nc1ccc(NC(=O)c2nc(Cl)ccc2Cl)cc1)NC1CC1	ZINC000872253236	FH	On-Demand	Anodyne	EPHX2	53	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA2	86	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA1	81	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA7	50	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA4	73	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA5A	42	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA14	44	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	EPHX2	55	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA12	74	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CA9	70	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	UREA_CANEN	27	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	CYNT	16	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	NCE103	34	49
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	SMO	20	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	MTCA1	54	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253239	HF	On-Demand	Anodyne	P96878_MYCTU	69	63
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	CA2	17	44
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	CA1	43	40
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	EPHX2	47	40
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	CA12	25	45
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	CA9	28	45
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	NCE103	17	44
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	MTCA1	16	45
O=C(Nc1ccc(NC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1)NC1CC1	ZINC000872253241	JH	On-Demand	Bother	P96878_MYCTU	17	45
N#CC1(C[C@H](O)CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CC1	ZINC000872253244	EG	On-Demand	Mild	NR2E3	67	36
N#CC1(C[C@@H](O)CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CC1	ZINC000872253245	EG	On-Demand	Mild	NR2E3	67	36
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253254	CC	On-Demand	Anodyne	ADRB2	29	50
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253254	CC	On-Demand	Anodyne	ADRB1	36	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253255	DC	On-Demand	Anodyne	ADRB2	25	43
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	CA1	15	50
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	EPHX2	56	48
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	CA12	18	50
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	CA9	18	50
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	IDO1	24	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	MTCA1	37	50
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253262	HF	On-Demand	Anodyne	P96878_MYCTU	45	50
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253264	DE	On-Demand	Mild	ADRB2	29	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253264	DE	On-Demand	Mild	ADRB1	44	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253264	DE	On-Demand	Mild	ADRB3	32	43
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253264	DE	On-Demand	Mild	ABCB1	15	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253265	DE	On-Demand	Mild	ADRB2	29	43
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253265	DE	On-Demand	Mild	ADRB1	44	41
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253265	DE	On-Demand	Mild	ADRB3	32	43
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000872253265	DE	On-Demand	Mild	ABCB1	15	44
CC(C)(O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253266	CF	On-Demand	Anodyne	CHEK2	69	37
CC(C)(O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253266	CF	On-Demand	Anodyne	HPSE	22	45
CC(C)(O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253266	CF	On-Demand	Anodyne	NR2E3	77	42
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)CC1	ZINC000872253267	CF	On-Demand	Mild	ADRB2	37	51
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)CC1	ZINC000872253267	CF	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)CC1	ZINC000872253267	CF	On-Demand	Mild	ADRB3	27	44
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C)cc2)CC1	ZINC000872253268	CF	On-Demand	Mild	ADRB2	37	51
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C)cc2)CC1	ZINC000872253268	CF	On-Demand	Mild	ADRB1	44	49
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C)cc2)CC1	ZINC000872253268	CF	On-Demand	Mild	ADRB3	27	44
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(Br)cc1	ZINC000872253271	EC	On-Demand	Anodyne	ADRB1	32	41
O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1)NC1CC1	ZINC000872253275	FH	On-Demand	Bother	EPHX2	45	45
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000872253276	EF	On-Demand	Anodyne	ADRB2	20	54
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000872253277	EF	On-Demand	Anodyne	ADRB2	20	54
CC(C)(C#N)C[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253280	EG	On-Demand	Mild	NR2E3	67	38
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253282	FG	On-Demand	Anodyne	ADRB2	33	47
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253282	FG	On-Demand	Anodyne	ADRB1	26	46
Cc1nccnc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253282	FG	On-Demand	Anodyne	GRIN1	29	45
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253283	FG	On-Demand	Anodyne	ADRB2	33	47
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253283	FG	On-Demand	Anodyne	ADRB1	26	46
Cc1nccnc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253283	FG	On-Demand	Anodyne	GRIN1	29	45
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253284	FG	On-Demand	Anodyne	ADRB2	33	47
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253284	FG	On-Demand	Anodyne	ADRB1	26	46
Cc1nccnc1[C@H](C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253284	FG	On-Demand	Anodyne	GRIN1	29	45
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253285	FG	On-Demand	Anodyne	ADRB2	33	47
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253285	FG	On-Demand	Anodyne	ADRB1	26	46
Cc1nccnc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000872253285	FG	On-Demand	Anodyne	GRIN1	29	45
CC(C)(C#N)C[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253286	EG	On-Demand	Mild	NR2E3	67	38
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CN1CCCC1	ZINC000872253291	EE	On-Demand	Anodyne	CHEK2	57	39
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CN1CCCC1	ZINC000872253291	EE	On-Demand	Anodyne	NR2E3	73	39
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CN1CCCC1	ZINC000872253296	EE	On-Demand	Anodyne	CHEK2	57	39
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)CN1CCCC1	ZINC000872253296	EE	On-Demand	Anodyne	NR2E3	73	39
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253309	ED	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253309	ED	On-Demand	Anodyne	ADRB1	78	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253309	ED	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253309	ED	On-Demand	Anodyne	ADRB3	47	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253311	ED	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253311	ED	On-Demand	Anodyne	ADRB1	78	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253311	ED	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253311	ED	On-Demand	Anodyne	ADRB3	47	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253312	ED	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253312	ED	On-Demand	Anodyne	ADRB1	78	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253312	ED	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2nccnc2C)cc1	ZINC000872253312	ED	On-Demand	Anodyne	ADRB3	47	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253313	ED	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253313	ED	On-Demand	Anodyne	ADRB1	78	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253313	ED	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2nccnc2C)cc1	ZINC000872253313	ED	On-Demand	Anodyne	ADRB3	47	49
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	MTTP	20	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	EPHX2	43	42
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	CA12	19	51
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	CA9	18	51
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	MTCA1	43	51
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)cc1)NC1CC1	ZINC000872253315	JG	On-Demand	Anodyne	P96878_MYCTU	53	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)Cc2ccc(F)cc2)c1	ZINC000872253323	FE	On-Demand	Anodyne	ADRB2	23	52
O=C(Nc1ccc(NC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)cc1)NC1CC1	ZINC000872253325	JH	On-Demand	Anodyne	EPHX2	68	45
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)Cc2ccc(F)cc2)c1	ZINC000872253327	FE	On-Demand	Anodyne	ADRB2	23	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000872253334	EF	On-Demand	Anodyne	ADRB2	16	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000872253335	EF	On-Demand	Anodyne	ADRB2	16	51
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CC2CCCC2)c1	ZINC000872253338	EF	On-Demand	Anodyne	ADRB2	15	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@H](O)CC2CCCC2)c1	ZINC000872253338	EF	On-Demand	Anodyne	ADRB1	16	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CC2CCCC2)c1	ZINC000872253339	EF	On-Demand	Anodyne	ADRB2	15	52
COc1ccc(OC)c([C@H](O)[C@H](C)NC[C@@H](O)CC2CCCC2)c1	ZINC000872253339	EF	On-Demand	Anodyne	ADRB1	16	40
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(N)=O)c1	ZINC000872253341	CC	On-Demand	Anodyne	MTNR1A	52	41
COc1ccc(OC)c([C@H](O)[C@H](C)NCCC(N)=O)c1	ZINC000872253341	CC	On-Demand	Anodyne	MTNR1B	46	41
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1	ZINC000872253348	CC	On-Demand	Anodyne	ADRB2	42	47
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1	ZINC000872253348	CC	On-Demand	Anodyne	ADRB1	56	41
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1	ZINC000872253348	CC	On-Demand	Anodyne	ADRB3	38	41
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000872253349	HG	On-Demand	Anodyne	CA2	15	44
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000872253349	HG	On-Demand	Anodyne	HTR7	24	52
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000872253349	HG	On-Demand	Anodyne	CA1	17	44
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000872253349	HG	On-Demand	Anodyne	F13A1	43	37
O=C(Nc1ccc(NC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1)NC1CC1	ZINC000872253354	HD	On-Demand	Anodyne	EPHX2	40	38
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253360	EC	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253360	EC	On-Demand	Anodyne	ADRB1	59	56
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253360	EC	On-Demand	Anodyne	ADRB3	37	41
COC[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253363	CE	On-Demand	Anodyne	CHEK2	64	37
COC[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253363	CE	On-Demand	Anodyne	HPSE	21	41
COC[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253363	CE	On-Demand	Anodyne	NR2E3	71	40
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253366	JK	On-Demand	Anodyne	TRPV1	15	47
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253366	JK	On-Demand	Anodyne	EPHX2	63	50
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253367	JK	On-Demand	Anodyne	TRPV1	15	47
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253367	JK	On-Demand	Anodyne	EPHX2	63	50
O=C(Nc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)NC1CC1	ZINC000872253373	FG	On-Demand	Anodyne	MAOB	19	69
O=C(Nc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)NC1CC1	ZINC000872253373	FG	On-Demand	Anodyne	EPHX2	45	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCOC[C@H]2O)CC1	ZINC000872253374	EC	On-Demand	Anodyne	GPR119	35	42
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	AVPR2	38	44
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	AVPR1A	15	44
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	KCNQ2	35	45
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	TRPV1	15	40
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	PRNP	86	52
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	FLT3	23	42
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	NOD1	18	43
O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(CO)cc1	ZINC000872253381	CG	On-Demand	Anodyne	NOD2	47	40
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253384	FH	On-Demand	Bother	EPHX2	41	40
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872253387	DF	On-Demand	Mild	ADRB2	35	50
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872253387	DF	On-Demand	Mild	ADRB1	42	32
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000872253387	DF	On-Demand	Mild	ADRB3	21	41
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872253388	DF	On-Demand	Mild	ADRB2	35	50
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872253388	DF	On-Demand	Mild	ADRB1	42	32
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000872253388	DF	On-Demand	Mild	ADRB3	21	41
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	LPL	49	35
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	CA1	43	38
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	GRM4	33	41
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	EPHX2	43	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	CA12	25	42
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	CA9	25	42
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	NR2E3	60	35
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	SHH	27	42
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	MTCA1	38	42
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253389	JJ	On-Demand	Anodyne	P96878_MYCTU	47	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000872253390	CE	On-Demand	Mild	ADRB2	33	49
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000872253390	CE	On-Demand	Mild	ADRB1	52	36
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000872253390	CE	On-Demand	Mild	ADRB3	21	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872253391	CE	On-Demand	Mild	ADRB2	33	49
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872253391	CE	On-Demand	Mild	ADRB1	52	36
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000872253391	CE	On-Demand	Mild	ADRB3	21	48
COC[C@@H](C)OC[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253395	FE	On-Demand	Anodyne	NR2E3	67	38
COC[C@@H](C)OC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253396	FE	On-Demand	Anodyne	NR2E3	67	38
CCCCCCn1nc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c2ccccc2c1=O	ZINC000872253406	IJ	On-Demand	Anodyne	CNR2	27	41
CCCCCCn1nc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c2ccccc2c1=O	ZINC000872253406	IJ	On-Demand	Anodyne	EPHX2	43	39
O=C(CNS(=O)(=O)c1c(F)cccc1F)Nc1ccc(N2CCCC2)cc1	ZINC000872253407	GE	On-Demand	Anodyne	KCNQ2	35	41
O=C(Nc1ccc(NC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)cc1)NC1CC1	ZINC000872253408	IH	On-Demand	Anodyne	ITGAL	40	36
O=C(Nc1ccc(NC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)cc1)NC1CC1	ZINC000872253408	IH	On-Demand	Anodyne	EPHX2	56	51
O=C(Nc1ccc(NC(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)cc1)NC1CC1	ZINC000872253409	IH	On-Demand	Anodyne	ITGAL	40	36
O=C(Nc1ccc(NC(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)cc1)NC1CC1	ZINC000872253409	IH	On-Demand	Anodyne	EPHX2	56	51
O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)NC1CC1	ZINC000872253415	FH	On-Demand	Bother	EPHX2	49	44
CCOC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872253416	FF	On-Demand	Anodyne	MTOR	29	40
CCOC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872253416	FF	On-Demand	Anodyne	EPHX2	94	57
CCOC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872253416	FF	On-Demand	Anodyne	TGM2	31	42
CCOC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872253416	FF	On-Demand	Anodyne	DPP7	15	40
CCOC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000872253416	FF	On-Demand	Anodyne	F13A1	55	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(Oc2ccccc2)cc1	ZINC000872253417	FD	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(Oc2ccccc2)cc1	ZINC000872253417	FD	On-Demand	Anodyne	ADRB1	52	40
Cn1nc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c2ccccc2c1=O	ZINC000872253419	GE	On-Demand	Anodyne	EPHX2	46	40
Cn1nc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c2ccccc2c1=O	ZINC000872253419	GE	On-Demand	Anodyne	IMDH_CRYPV	28	44
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)cc1)NC1CC1	ZINC000872253424	IK	On-Demand	Anodyne	F9	25	43
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)cc1)NC1CC1	ZINC000872253424	IK	On-Demand	Anodyne	F10	19	45
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)cc1)NC1CC1	ZINC000872253424	IK	On-Demand	Anodyne	PRNP	40	34
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)cc1)NC1CC1	ZINC000872253424	IK	On-Demand	Anodyne	EPHX2	48	42
O=C(Nc1ccc(NC(=O)c2ccc(Cl)nc2)cc1)NC1CC1	ZINC000872253430	EG	On-Demand	Anodyne	EPHX2	57	57
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253432	JG	On-Demand	Anodyne	TNKS	51	31
Cn1c2ccccc2c2cc(C(=O)Nc3ccc(NC(=O)NC4CC4)cc3)sc21	ZINC000872253433	HJ	On-Demand	Anodyne	EPHX2	42	37
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1)NC1CC1	ZINC000872253434	JG	On-Demand	Anodyne	EPHX2	35	40
O=C(Nc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1)NC1CC1	ZINC000872253435	JG	On-Demand	Anodyne	EPHX2	35	40
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	LPL	40	41
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	NR1H4	17	41
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	EPHX2	67	51
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	TGM2	69	39
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	F13A1	70	38
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	MERTK	40	51
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	P96878_MYCTU	20	44
O=C(Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1)NC1CC1	ZINC000872253436	JF	On-Demand	Anodyne	NAMPT	30	45
O=C(/C=C/c1ccc(I)o1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253438	IH	On-Demand	Anodyne	EPHX2	41	42
O=C(/C=C\c1ccc(I)o1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253439	IH	On-Demand	Anodyne	EPHX2	41	42
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253441	FG	On-Demand	Anodyne	EPHX2	44	38
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253442	FG	On-Demand	Anodyne	EPHX2	44	38
O=C(Nc1ccc(NC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)cc1)NC1CC1	ZINC000872253443	HK	On-Demand	Anodyne	EPHX2	50	46
O=C(Nc1ccc(NC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)cc1)NC1CC1	ZINC000872253444	HK	On-Demand	Anodyne	EPHX2	50	46
O=C(Nc1ccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1)NC1CC1	ZINC000872253445	HK	On-Demand	Anodyne	TACR3	20	52
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)COC1CCOCC1	ZINC000872253446	FF	On-Demand	Anodyne	CHEK2	47	32
O[C@@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)COC1CCOCC1	ZINC000872253446	FF	On-Demand	Anodyne	NR2E3	67	37
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)COC1CCOCC1	ZINC000872253447	FF	On-Demand	Anodyne	CHEK2	47	32
O[C@H](CNc1ccc2[nH]c(-c3ccncc3)nc2c1)COC1CCOCC1	ZINC000872253447	FF	On-Demand	Anodyne	NR2E3	67	37
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253448	CE	On-Demand	Mild	ADRB2	28	48
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253448	CE	On-Demand	Mild	ADRB1	40	51
C#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253448	CE	On-Demand	Mild	ADRB3	22	42
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253449	CE	On-Demand	Mild	ADRB2	28	48
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253449	CE	On-Demand	Mild	ADRB1	40	51
C#C[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000872253449	CE	On-Demand	Mild	ADRB3	22	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1F	ZINC000872253452	CC	On-Demand	Anodyne	ADRB2	23	43
CN(C[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253455	EE	On-Demand	Anodyne	CHEK2	40	32
CN(C[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253455	EE	On-Demand	Anodyne	NR2E3	70	38
CN(C[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253456	EE	On-Demand	Anodyne	CHEK2	40	32
CN(C[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872253456	EE	On-Demand	Anodyne	NR2E3	70	38
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253457	HF	On-Demand	Anodyne	CA1	25	40
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253457	HF	On-Demand	Anodyne	EPHX2	49	45
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253457	HF	On-Demand	Anodyne	CA12	24	46
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253457	HF	On-Demand	Anodyne	CA9	22	46
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000872253457	HF	On-Demand	Anodyne	P96878_MYCTU	41	46
CC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253465	CF	On-Demand	Anodyne	CHEK2	47	37
CC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253465	CF	On-Demand	Anodyne	HPSE	17	43
CC[C@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253465	CF	On-Demand	Anodyne	NR2E3	74	41
O=C(Nc1ccc(NC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1)NC1CC1	ZINC000872253467	JJ	On-Demand	Anodyne	EPHX2	42	41
O=C(Nc1ccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1)NC1CC1	ZINC000872253469	IH	On-Demand	Anodyne	EPHX2	41	42
O=C(Nc1ccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1)NC1CC1	ZINC000872253469	IH	On-Demand	Anodyne	P96878_MYCTU	19	43
COc1cccc(C[C@H](N)C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872253473	GC	On-Demand	Anodyne	DPP7	24	45
COc1cccc(C[C@@H](N)C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872253474	GC	On-Demand	Anodyne	DPP7	24	45
O=C(c1cc2cc(F)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253475	FD	On-Demand	Anodyne	GRIN2B	24	41
O=C(c1cc2cc(F)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253475	FD	On-Demand	Anodyne	HRH4	21	52
O=C(c1cc2cc(F)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253475	FD	On-Demand	Anodyne	PLD1	31	41
O=C(c1cc2cc(F)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253475	FD	On-Demand	Anodyne	PLD2	44	41
O=C(c1cc2cc(F)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253475	FD	On-Demand	Anodyne	AKR1C3	18	42
O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253478	GE	On-Demand	Anodyne	GRIN2B	26	41
O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253478	GE	On-Demand	Anodyne	HRH4	26	52
O=C(c1cc(C(F)F)ccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253485	GE	On-Demand	Anodyne	PARP1	41	38
CC(C)c1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253491	FE	On-Demand	Anodyne	L3MBTL3	46	40
CNc1ncc(C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)s1	ZINC000872253499	CD	On-Demand	Anodyne	TRPC6	45	32
O=C(c1cccc(N2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253501	GD	On-Demand	Anodyne	L3MBTL3	86	46
O=C(CCCc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253509	FD	On-Demand	Anodyne	PTAFR	15	40
O=C(CCCc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253509	FD	On-Demand	Anodyne	C3AR1	41	43
O=C(c1cccc(C2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253524	GF	On-Demand	Anodyne	L3MBTL3	81	46
O=C(c1cnccc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253530	GD	On-Demand	Anodyne	RBP4	17	52
CCn1c(O)nc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc21	ZINC000872253564	GD	On-Demand	Anodyne	L3MBTL3	47	34
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	METAP1	45	38
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	PRNP	41	35
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	TACR3	21	41
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	GRM4	40	34
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	SHH	22	40
O=C(Nc1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)NC1CC1	ZINC000872253584	HJ	On-Demand	Anodyne	MT-CO2	41	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253585	EC	On-Demand	Anodyne	ADRB2	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253585	EC	On-Demand	Anodyne	ADRB1	65	46
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253585	EC	On-Demand	Anodyne	ADRB3	44	41
O=C(/C=C/c1ccccc1F)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253586	EH	On-Demand	Anodyne	EPHX2	55	45
O=C(/C=C\c1ccccc1F)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253587	EH	On-Demand	Anodyne	EPHX2	55	45
O=C(Nc1ccc(NC(=O)c2ccc(SC(F)(F)F)cc2)cc1)NC1CC1	ZINC000872253589	GJ	On-Demand	Anodyne	EPHX2	64	50
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253590	JI	On-Demand	Anodyne	CA1	17	42
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253590	JI	On-Demand	Anodyne	EPHX2	46	39
O=C(Nc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872253595	HH	On-Demand	Bother	EPHX2	45	40
O=C(Nc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1)NC1CC1	ZINC000872253595	HH	On-Demand	Bother	TAAR1	26	54
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(N2CCCC2)cc1	ZINC000872253598	IJ	On-Demand	Anodyne	KCNQ2	17	41
O=C(/C=C\c1cccs1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253604	EH	On-Demand	Anodyne	EPHX2	56	41
O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253606	JI	On-Demand	Anodyne	CCKBR	41	36
O[C@@H]1CCCC[C@H]1Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253615	DG	On-Demand	Anodyne	CHEK2	72	38
O[C@@H]1CCCC[C@H]1Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253615	DG	On-Demand	Anodyne	HPSE	15	43
O[C@@H]1CCCC[C@H]1Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253615	DG	On-Demand	Anodyne	NR2E3	81	46
O=C(Nc1ccc(NC(=O)c2cc(-c3cccs3)nc3ccccc23)cc1)NC1CC1	ZINC000872253618	IK	On-Demand	Anodyne	TACR3	22	52
O=C(Nc1ccc(NC(=O)c2cc(-c3cccs3)nc3ccccc23)cc1)NC1CC1	ZINC000872253618	IK	On-Demand	Anodyne	TNKS	45	31
O=C(Nc1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)NC1CC1	ZINC000872253619	IH	On-Demand	Anodyne	P2RX7	27	51
O=C(Nc1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)NC1CC1	ZINC000872253619	IH	On-Demand	Anodyne	EPHX2	45	40
O=C(Nc1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)NC1CC1	ZINC000872253620	IH	On-Demand	Anodyne	P2RX7	27	51
O=C(Nc1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)NC1CC1	ZINC000872253620	IH	On-Demand	Anodyne	EPHX2	45	40
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253622	DC	On-Demand	Mild	ADRB1	33	43
CC(C)(C)[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253623	DG	On-Demand	Anodyne	CHEK2	55	35
CC(C)(C)[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253623	DG	On-Demand	Anodyne	HPSE	17	43
CC(C)(C)[C@@H](O)CNc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872253623	DG	On-Demand	Anodyne	NR2E3	73	41
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA2	80	49
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA1	73	49
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA7	43	41
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	PRNP	41	35
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA4	69	49
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA5A	42	36
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA12	56	38
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	CA9	59	49
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	MTCA1	49	42
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000872253625	FE	On-Demand	Anodyne	P96878_MYCTU	60	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(-c2ccccc2)cc1	ZINC000872253627	ED	On-Demand	Anodyne	ADRB2	37	42
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(-c2ccccc2)cc1	ZINC000872253627	ED	On-Demand	Anodyne	ADRB1	49	40
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccc(-c2ccccc2)cc1	ZINC000872253627	ED	On-Demand	Anodyne	ADRB3	33	40
O=C(COc1ccc(C2SCCCS2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253630	IJ	On-Demand	Anodyne	EPHX2	63	46
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1C(F)(F)F	ZINC000872253631	ED	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1C(F)(F)F	ZINC000872253631	ED	On-Demand	Anodyne	ADRB1	18	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	MAPK11	23	41
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	MAPK14	18	41
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	PRNP	52	45
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	EPHX2	57	45
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	F7	20	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	SLC1A2	21	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253632	II	On-Demand	Anodyne	DGAT1	27	47
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCCC1	ZINC000872253638	DG	On-Demand	Anodyne	CHEK2	80	38
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCCC1	ZINC000872253638	DG	On-Demand	Anodyne	HPSE	15	40
OC1(CNc2ccc3[nH]c(-c4ccncc4)nc3c2)CCCC1	ZINC000872253638	DG	On-Demand	Anodyne	NR2E3	75	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2cc(F)ccc2OCC(F)(F)F)C1	ZINC000872253645	HI	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2cc(F)ccc2OCC(F)(F)F)C1	ZINC000872253645	HI	On-Demand	Anodyne	SFRP1	49	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2cc(F)ccc2OCC(F)(F)F)C1	ZINC000872253645	HI	On-Demand	Anodyne	WNT3	41	35
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253650	FG	On-Demand	Anodyne	MCHR1	16	43
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253650	FG	On-Demand	Anodyne	DYRK2	54	34
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253651	FG	On-Demand	Anodyne	MCHR1	16	43
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872253651	FG	On-Demand	Anodyne	DYRK2	54	34
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(Cl)nc2ccccc12	ZINC000872253652	GK	On-Demand	Anodyne	ATF1	45	32
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(Cl)nc2ccccc12	ZINC000872253652	GK	On-Demand	Anodyne	TACR3	21	40
O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(Cl)nc2ccccc12	ZINC000872253652	GK	On-Demand	Anodyne	NFKB1	42	32
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253654	DC	On-Demand	Anodyne	ADRB2	28	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCOC[C@H]2O)cc1	ZINC000872253654	DC	On-Demand	Anodyne	ADRB1	36	41
N#CCc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872253664	FD	On-Demand	Mild	L3MBTL3	46	39
O=C(Nc1ccc(NC(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)cc1)NC1CC1	ZINC000872253665	JK	On-Demand	Anodyne	TACR3	21	41
O=C(Nc1ccc(NC(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)cc1)NC1CC1	ZINC000872253665	JK	On-Demand	Anodyne	NR2E3	59	33
O=C(Nc1ccc(NC(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)cc1)NC1CC1	ZINC000872253665	JK	On-Demand	Anodyne	SMO	22	47
O=C(Nc1ccc(NC(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)cc1)NC1CC1	ZINC000872253665	JK	On-Demand	Anodyne	MT-CO2	41	39
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1Cl	ZINC000872253668	DC	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CN[C@@H]1CCOC[C@H]1O)COc1ccccc1Cl	ZINC000872253668	DC	On-Demand	Anodyne	ADRB1	21	41
O=C(c1ccc2c(c1)CCOC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253689	FD	On-Demand	Anodyne	L3MBTL3	63	35
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253690	GE	On-Demand	Anodyne	HRH4	28	55
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253690	GE	On-Demand	Anodyne	PYGL	72	40
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253690	GE	On-Demand	Anodyne	AKR1C3	18	42
O=C(c1ccc(-n2ccnc2O)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253691	GC	On-Demand	Anodyne	L3MBTL3	56	35
CC(=O)c1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872253743	FD	On-Demand	Anodyne	L3MBTL3	74	45
O=C([C@@H]1C[C@H]1c1ccsc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253762	FD	On-Demand	Anodyne	NPBWR1	93	34
O=C(c1ccc(CF)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253793	ED	On-Demand	Anodyne	L3MBTL3	77	40
COc1ccc(Cn2cc(CN3CCO[C@H](C(F)F)CC3)nn2)cc1	ZINC000872253798	FE	On-Demand	Anodyne	DRD4	16	44
COc1ccc(Cn2cc(CN3CCO[C@H](C(F)F)CC3)nn2)cc1	ZINC000872253798	FE	On-Demand	Anodyne	SIGMAR1	16	42
COc1ccc(Cn2cc(CN3CCO[C@@H](C(F)F)CC3)nn2)cc1	ZINC000872253799	FE	On-Demand	Anodyne	DRD4	16	44
COc1ccc(Cn2cc(CN3CCO[C@@H](C(F)F)CC3)nn2)cc1	ZINC000872253799	FE	On-Demand	Anodyne	SIGMAR1	16	42
COc1ccc2[nH]cc(CC(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)c2c1	ZINC000872253813	GD	On-Demand	Anodyne	HTR1D	28	43
COc1ccc2[nH]cc(CC(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)c2c1	ZINC000872253813	GD	On-Demand	Anodyne	HTR1B	24	43
COc1ccc2[nH]cc(CC(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)c2c1	ZINC000872253813	GD	On-Demand	Anodyne	HTR6	15	40
COc1ccc2[nH]cc(CC(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)c2c1	ZINC000872253813	GD	On-Demand	Anodyne	MTNR1A	23	43
COc1ccc2[nH]cc(CC(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)c2c1	ZINC000872253813	GD	On-Demand	Anodyne	MTNR1B	19	43
O=C(c1ccc(C2CC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253816	FD	On-Demand	Anodyne	L3MBTL3	87	41
O=C(c1ccc2[nH]ccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253828	FD	On-Demand	Anodyne	L3MBTL3	70	40
Cc1nc(NC2CC2)sc1C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872253838	EF	On-Demand	Anodyne	TRPC6	46	33
O=C(c1cc2c(F)cccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253915	FD	On-Demand	Anodyne	GRIN2B	23	41
O=C(c1cc2c(F)cccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253915	FD	On-Demand	Anodyne	HRH4	18	52
O=C(c1ccc2cc[nH]c2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253924	FD	On-Demand	Anodyne	L3MBTL3	74	42
O=C(CCc1c[nH]c2ccccc12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872253946	GD	On-Demand	Anodyne	MC5R	31	46
Cc1ccc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)[nH]c2c1	ZINC000872253951	FD	On-Demand	Anodyne	GRIN2B	27	46
Cc1ccc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)[nH]c2c1	ZINC000872253951	FD	On-Demand	Anodyne	HRH4	24	43
Cc1ccc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)[nH]c2c1	ZINC000872253951	FD	On-Demand	Anodyne	AKR1C3	19	46
CCn1c(O)nc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872253971	GD	On-Demand	Anodyne	L3MBTL3	52	34
NC[C@H]1CCCc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc21	ZINC000872253982	GD	On-Demand	Anodyne	L3MBTL3	62	36
NC[C@@H]1CCCc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc21	ZINC000872253983	GD	On-Demand	Anodyne	L3MBTL3	62	36
O=C(c1cccc2cc[nH]c12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254022	FD	On-Demand	Anodyne	L3MBTL3	46	38
O=C(c1ccc(-n2cccc2)c(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254062	GE	On-Demand	Anodyne	L3MBTL3	55	34
O=C(c1ccc(CN2CCO[C@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254069	EF	On-Demand	Anodyne	HRH3	33	51
O=C(c1ccc(CN2CCO[C@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254069	EF	On-Demand	Anodyne	SIGMAR1	25	42
O=C(c1ccc(CN2CCO[C@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254069	EF	On-Demand	Anodyne	LSS	15	42
O=C(c1ccc(CN2CCO[C@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254069	EF	On-Demand	Anodyne	L3MBTL3	83	58
O=C(c1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254070	EF	On-Demand	Anodyne	HRH3	33	51
O=C(c1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254070	EF	On-Demand	Anodyne	SIGMAR1	25	42
O=C(c1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254070	EF	On-Demand	Anodyne	LSS	15	42
O=C(c1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1)N1CCCC1	ZINC000872254070	EF	On-Demand	Anodyne	L3MBTL3	83	58
C[C@@H]1Cc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2O1	ZINC000872254091	FD	On-Demand	Anodyne	L3MBTL3	65	35
C[C@H]1Cc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2O1	ZINC000872254092	FD	On-Demand	Anodyne	L3MBTL3	65	35
O=C(c1ccc(Cn2ccnn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254112	GC	On-Demand	Anodyne	L3MBTL3	51	41
CC(C)c1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872254143	FE	On-Demand	Anodyne	L3MBTL3	60	41
N#Cc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872254147	EC	On-Demand	Mild	L3MBTL3	58	41
O=C(c1ccc(-c2ccccn2)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254186	GD	On-Demand	Anodyne	L3MBTL3	50	40
O=C(CCCc1c[nH]c2ccccc12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254199	GE	On-Demand	Anodyne	MC5R	30	41
O=C(c1cccc(C2CC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254200	FD	On-Demand	Anodyne	L3MBTL3	76	45
O=C(c1ccc(F)s1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254259	ED	On-Demand	Anodyne	L3MBTL3	23	42
COC(=O)c1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1Br	ZINC000872254271	GG	On-Demand	Anodyne	SSTR5	42	32
COC(=O)c1ccc(CN2CCO[C@H](C(F)F)CC2)cc1Br	ZINC000872254272	GG	On-Demand	Anodyne	SSTR5	42	32
O=C(c1ccc2ccncc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254285	FD	On-Demand	Anodyne	L3MBTL3	64	40
CCOc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1OC(=O)CC	ZINC000872254288	FG	On-Demand	Anodyne	DRD4	18	44
CCOc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1OC(=O)CC	ZINC000872254288	FG	On-Demand	Anodyne	SSTR5	85	42
CCOc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1OC(=O)CC	ZINC000872254289	FG	On-Demand	Anodyne	DRD4	18	44
CCOc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1OC(=O)CC	ZINC000872254289	FG	On-Demand	Anodyne	SSTR5	85	42
O=C(c1ccc(-c2csnn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254292	GD	On-Demand	Anodyne	L3MBTL3	50	34
O=C(c1ccc(C(F)F)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254297	FD	On-Demand	Anodyne	L3MBTL3	53	41
CCn1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c2ccccc21	ZINC000872254315	GE	On-Demand	Anodyne	CNR1	17	46
CCn1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c2ccccc21	ZINC000872254315	GE	On-Demand	Anodyne	TPSAB1	27	49
O=C(c1cc2ccccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254328	FD	On-Demand	Anodyne	GRIN2B	31	42
O=C(c1cc2ccccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254328	FD	On-Demand	Anodyne	HRH4	24	53
O=C(c1cc2ccccc2[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254328	FD	On-Demand	Anodyne	AKR1C3	22	52
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)c3cn(CCC#N)c4ccccc34)[C@H]21	ZINC000872254369	FG	On-Demand	Mild	CNR1	17	45
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)c3cn(CCC#N)c4ccccc34)[C@H]21	ZINC000872254369	FG	On-Demand	Mild	CNR2	25	45
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c(O)c1	ZINC000872254377	FC	On-Demand	Anodyne	OXTR	22	43
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccccc3)[C@H]21	ZINC000872254382	CF	On-Demand	Anodyne	LTA4H	35	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccccc3)[C@H]21	ZINC000872254382	CF	On-Demand	Anodyne	HRH3	68	45
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccccc3)[C@H]21	ZINC000872254382	CF	On-Demand	Anodyne	CHRNA10	64	43
FC(F)[C@H]1CCN(Cc2cc3ccccc3nc2N2CCOCC2)CCO1	ZINC000872254386	GF	On-Demand	Anodyne	PIK3CD	45	39
FC(F)[C@@H]1CCN(Cc2cc3ccccc3nc2N2CCOCC2)CCO1	ZINC000872254387	GF	On-Demand	Anodyne	PIK3CD	45	39
O=C(Cc1ccc(F)cc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254392	GD	On-Demand	Anodyne	P2RX7	42	42
O=C(c1ccccc1O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254457	EC	On-Demand	Anodyne	L3MBTL3	58	42
O=C(c1cccc2c1CCCN2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254465	FD	On-Demand	Anodyne	L3MBTL3	51	35
FC(F)[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)CCO1	ZINC000872254468	EE	On-Demand	Clean	L3MBTL3	25	41
FC(F)[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)CCO1	ZINC000872254469	EE	On-Demand	Clean	L3MBTL3	25	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(C#N)cc3)[C@H]21	ZINC000872254494	DE	On-Demand	Mild	LTA4H	23	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(C#N)cc3)[C@H]21	ZINC000872254494	DE	On-Demand	Mild	HRH3	38	53
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(C#N)cc3)[C@H]21	ZINC000872254494	DE	On-Demand	Mild	MEN1	42	40
COc1ccc(O)c(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872254501	FC	On-Demand	Anodyne	OXTR	18	41
Nc1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254503	EC	On-Demand	Anodyne	L3MBTL3	45	41
O=C(c1ccc2c(c1)CCNCC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254528	GC	On-Demand	Anodyne	L3MBTL3	76	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N[C@@H]3CCCc4ccccc43)[C@H]21	ZINC000872254542	EF	On-Demand	Anodyne	BDKRB1	55	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N[C@@H]3CCCc4ccccc43)[C@H]21	ZINC000872254542	EF	On-Demand	Anodyne	BIRC2	41	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N[C@H]3CCCc4ccccc43)[C@H]21	ZINC000872254543	EF	On-Demand	Anodyne	BDKRB1	55	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N[C@H]3CCCc4ccccc43)[C@H]21	ZINC000872254543	EF	On-Demand	Anodyne	BIRC2	41	38
O=C(c1ccc2c(c1)CCCN2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254548	FD	On-Demand	Anodyne	L3MBTL3	75	37
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc(C(N)=O)c3)[C@H]21	ZINC000872254558	CD	On-Demand	Anodyne	KCNH2	40	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccccc3)[C@H]21	ZINC000872254560	CF	On-Demand	Anodyne	LTA4H	51	47
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccccc3)[C@H]21	ZINC000872254560	CF	On-Demand	Anodyne	HRH3	40	39
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccccc3)[C@H]21	ZINC000872254560	CF	On-Demand	Anodyne	CHRNA10	62	44
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccccc3)[C@H]21	ZINC000872254560	CF	On-Demand	Anodyne	PSMB1	41	38
O=C(c1ccc2nccnc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254561	FD	On-Demand	Anodyne	L3MBTL3	69	37
O=C(c1ccc(F)c(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254581	FD	On-Demand	Anodyne	L3MBTL3	69	37
O=C(c1cc(F)c(O)c(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254599	FD	On-Demand	Anodyne	L3MBTL3	48	32
Cc1cccc(C)c1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254623	ED	On-Demand	Anodyne	CCR5	30	46
Cc1cccc(C)c1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254623	ED	On-Demand	Anodyne	L3MBTL3	44	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872254733	FD	On-Demand	Anodyne	LTA4H	20	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872254733	FD	On-Demand	Anodyne	CA7	24	43
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872254733	FD	On-Demand	Anodyne	HRH3	35	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872254733	FD	On-Demand	Anodyne	CA9	17	46
CCOc1cc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC	ZINC000872254766	FD	On-Demand	Anodyne	SSTR5	71	41
CCOc1cc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC	ZINC000872254769	FD	On-Demand	Anodyne	SSTR5	71	41
N#Cc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872254803	EC	On-Demand	Mild	L3MBTL3	74	41
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C1	ZINC000872254805	GD	On-Demand	Anodyne	PDE11A	54	34
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C1	ZINC000872254807	GD	On-Demand	Anodyne	PDE11A	54	34
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc(Cl)c3)[C@H]21	ZINC000872254838	DF	On-Demand	Anodyne	GRM5	15	44
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc(Cl)c3)[C@H]21	ZINC000872254838	DF	On-Demand	Anodyne	MCHR1	30	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc(Cl)c3)[C@H]21	ZINC000872254838	DF	On-Demand	Anodyne	MDM2	45	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(F)cc3)[C@H]21	ZINC000872254839	CF	On-Demand	Anodyne	LTA4H	33	44
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(F)cc3)[C@H]21	ZINC000872254839	CF	On-Demand	Anodyne	HRH3	41	43
O=C(c1ccncc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254853	GD	On-Demand	Anodyne	RBP4	19	43
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3)[C@H]21	ZINC000872254863	CF	On-Demand	Bother	KCNJ1	25	41
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(Cc2cncc3ccccc23)C1	ZINC000872254885	ED	On-Demand	Anodyne	PDE11A	40	31
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(Cc2cncc3ccccc23)C1	ZINC000872254886	ED	On-Demand	Anodyne	PDE11A	40	31
O=C(NC1CC1)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872254887	GC	On-Demand	Anodyne	L3MBTL3	72	39
FC(F)[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)CCO1	ZINC000872254909	DH	On-Demand	Clean	HRH3	21	40
FC(F)[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)CCO1	ZINC000872254909	DH	On-Demand	Clean	L3MBTL3	36	40
FC(F)[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)CCO1	ZINC000872254910	DH	On-Demand	Clean	HRH3	21	40
FC(F)[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)CCO1	ZINC000872254910	DH	On-Demand	Clean	L3MBTL3	36	40
O=C(c1ccc2cncn2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254941	FC	On-Demand	Anodyne	L3MBTL3	52	35
O=C(CCCOc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254993	FD	On-Demand	Anodyne	CHRNA7	17	41
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)[C@H]21	ZINC000872254997	CF	On-Demand	Bother	CACNA1C	51	34
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)[C@H]21	ZINC000872254997	CF	On-Demand	Bother	CACNA1D	82	34
O=C(c1cccc(Cl)c1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872254998	FD	On-Demand	Anodyne	L3MBTL3	47	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCCc3nc(-c4cccs4)no3)[C@H]21	ZINC000872254999	EG	On-Demand	Anodyne	ETHR	30	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccccc3)[C@H]21	ZINC000872255007	DD	On-Demand	Anodyne	SIGMAR1	21	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccccc3)[C@H]21	ZINC000872255007	DD	On-Demand	Anodyne	PREP	40	40
O=C(c1cccc(C(F)F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255014	FE	On-Demand	Anodyne	L3MBTL3	58	41
O=C(c1ccc(C2CCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255016	FE	On-Demand	Anodyne	L3MBTL3	90	42
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccccc3F)[C@H]21	ZINC000872255020	DE	On-Demand	Anodyne	ABCB1	43	38
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccccc3F)[C@H]21	ZINC000872255021	DE	On-Demand	Anodyne	ABCB1	43	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)NC(=O)NCc3ccccc3)[C@H]21	ZINC000872255026	FD	On-Demand	Anodyne	TMPRSS11D	54	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccccc3)[C@H]21	ZINC000872255050	CF	On-Demand	Anodyne	OPRM1	20	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccccc3)[C@H]21	ZINC000872255050	CF	On-Demand	Anodyne	SLC18A2	45	39
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccccc3)[C@H]21	ZINC000872255050	CF	On-Demand	Anodyne	HRH3	32	46
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccccc3)[C@H]21	ZINC000872255050	CF	On-Demand	Anodyne	SIGMAR1	30	45
C#CCCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872255084	DF	On-Demand	Mild	HRH3	26	46
C#CCCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872255084	DF	On-Demand	Mild	SIGMAR1	15	41
C#CCCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872255085	DF	On-Demand	Mild	HRH3	26	46
C#CCCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872255085	DF	On-Demand	Mild	SIGMAR1	15	41
CCOc1cc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC(F)F	ZINC000872255108	GE	On-Demand	Anodyne	SSTR5	60	34
CCOc1cc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC(F)F	ZINC000872255109	GE	On-Demand	Anodyne	SSTR5	60	34
O=C(c1ccc2ccccc2c1O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255118	GD	On-Demand	Anodyne	L3MBTL3	30	40
O=C(c1ccc(Cl)c(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255124	FD	On-Demand	Anodyne	L3MBTL3	68	37
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc(F)cc3)[C@H]21	ZINC000872255139	CF	On-Demand	Anodyne	SLC18A3	16	42
COC(=O)c1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872255214	FC	On-Demand	Anodyne	L3MBTL3	60	43
O=C(NC1CC1)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255234	FC	On-Demand	Anodyne	DRD4	21	45
O=C(NC1CC1)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255234	FC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CC1)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255234	FC	On-Demand	Anodyne	SSTR5	40	35
O=C(NC1CC1)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255234	FC	On-Demand	Anodyne	MCHR1	25	41
O=C(NC1CC1)c1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255235	FC	On-Demand	Anodyne	DRD4	21	45
O=C(NC1CC1)c1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255235	FC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CC1)c1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255235	FC	On-Demand	Anodyne	SSTR5	40	35
O=C(NC1CC1)c1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872255235	FC	On-Demand	Anodyne	MCHR1	25	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccncc3)[C@H]21	ZINC000872255236	CE	On-Demand	Anodyne	HRH3	29	42
C[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872255245	ED	On-Demand	Anodyne	BIRC8	55	33
C[C@@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872255246	ED	On-Demand	Anodyne	BIRC8	55	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc(F)c3)[C@H]21	ZINC000872255258	CF	On-Demand	Anodyne	CHRNA10	71	50
CCOC(=O)N1CCC(NC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)CC1	ZINC000872255267	FD	On-Demand	Anodyne	CCR8	21	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255284	GC	On-Demand	Anodyne	KCNJ1	59	36
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCc4ccccc43)[C@H]21	ZINC000872255289	DE	On-Demand	Anodyne	DRD4	16	48
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3nc(-c4cccs4)no3)[C@H]21	ZINC000872255302	DF	On-Demand	Anodyne	ETHR	32	43
COc1cc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1C#N	ZINC000872255349	EC	On-Demand	Mild	KCNJ1	17	41
COc1cc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1C#N	ZINC000872255350	EC	On-Demand	Mild	KCNJ1	17	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3ccccc3)[C@H]21	ZINC000872255354	ED	On-Demand	Anodyne	LTA4H	21	42
CCOc1ccccc1NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872255373	EF	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872255373	EF	On-Demand	Anodyne	HCN4	45	35
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H]3COc4ccccc4O3)[C@H]21	ZINC000872255377	DE	On-Demand	Anodyne	ADRA2B	17	44
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H]3COc4ccccc4O3)[C@H]21	ZINC000872255378	DE	On-Demand	Anodyne	ADRA2B	17	44
COC(=O)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872255387	FC	On-Demand	Anodyne	L3MBTL3	80	39
NC(=O)COc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872255388	DD	On-Demand	Anodyne	HRH3	21	44
NC(=O)COc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872255388	DD	On-Demand	Anodyne	SIGMAR1	29	41
NC(=O)COc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872255389	DD	On-Demand	Anodyne	HRH3	21	44
NC(=O)COc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872255389	DD	On-Demand	Anodyne	SIGMAR1	29	41
CCCOc1cc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC	ZINC000872255390	GD	On-Demand	Anodyne	SSTR5	33	44
CCCOc1cc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1OC	ZINC000872255391	GD	On-Demand	Anodyne	SSTR5	33	44
CCCn1c(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)nc2ccccc21	ZINC000872255456	FD	On-Demand	Anodyne	GRM2	16	42
CCCn1c(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)nc2ccccc21	ZINC000872255458	FD	On-Demand	Anodyne	GRM2	16	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(CN4CCOCC4)cc3)[C@H]21	ZINC000872255471	GD	On-Demand	Anodyne	EPHX2	15	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccc(Cl)c3)[C@H]21	ZINC000872255477	EE	On-Demand	Anodyne	P2RX7	21	51
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccc(Cl)c3)[C@H]21	ZINC000872255477	EE	On-Demand	Anodyne	DPP7	26	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccc(Cl)c3)[C@H]21	ZINC000872255477	EE	On-Demand	Anodyne	MDM2	41	32
O=C(c1ccc2c(c1)CCN2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255548	FD	On-Demand	Anodyne	L3MBTL3	64	35
COc1ccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255574	DF	On-Demand	Anodyne	LTA4H	36	44
COc1ccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255574	DF	On-Demand	Anodyne	HRH3	47	42
COc1ccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255574	DF	On-Demand	Anodyne	PSMB1	40	33
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccc(Cl)cc3)[C@H]21	ZINC000872255581	EF	On-Demand	Anodyne	EBP	18	43
O=C(CNc1ccccc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255583	GD	On-Demand	Anodyne	SCD	18	43
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccc(Cl)cc3)[C@H]21	ZINC000872255584	EF	On-Demand	Anodyne	EBP	18	43
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccc(C#N)c3)[C@H]21	ZINC000872255587	ED	On-Demand	Mild	MCHR1	23	40
O=C(c1ccc(-n2ccnn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255592	GC	On-Demand	Anodyne	L3MBTL3	54	36
O=C(c1ccnc(C2CC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255669	FD	On-Demand	Anodyne	L3MBTL3	54	34
Cn1cnc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872255679	FC	On-Demand	Anodyne	L3MBTL3	56	34
Cn1cnc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872255679	FC	On-Demand	Anodyne	HPGD	50	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@H]21	ZINC000872255703	EF	On-Demand	Bother	HRH3	57	43
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccccc3C(F)(F)F)[C@H]21	ZINC000872255712	FG	On-Demand	Anodyne	RBP4	58	36
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(N2CCNCC2)cn1	ZINC000872255716	DD	On-Demand	Anodyne	CHRNA4	22	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(N2CCNCC2)cn1	ZINC000872255716	DD	On-Demand	Anodyne	PRKD1	40	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc(CN4CCCC4)cc3)[C@H]21	ZINC000872255719	GE	On-Demand	Anodyne	HRH3	19	43
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc(CN4CCCC4)cc3)[C@H]21	ZINC000872255719	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(CNC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc(OC)c1OC	ZINC000872255739	GD	On-Demand	Anodyne	DRD2	41	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)N3CCN(c4ccccn4)CC3)[C@H]21	ZINC000872255746	FD	On-Demand	Anodyne	SSTR1	48	35
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255748	FD	On-Demand	Anodyne	ADRB1	36	48
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255748	FD	On-Demand	Anodyne	ADRB3	18	40
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255749	FD	On-Demand	Anodyne	ADRB1	36	48
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872255749	FD	On-Demand	Anodyne	ADRB3	18	40
Cc1ccccc1CNC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872255769	DE	On-Demand	Anodyne	P2RX7	25	48
Cc1ccccc1CNC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872255769	DE	On-Demand	Anodyne	CCR8	49	32
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)[C@H]21	ZINC000872255806	DE	On-Demand	Bother	LTA4H	22	50
O=C(c1ccc(Cn2ccnc2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255810	GD	On-Demand	Anodyne	TBXAS1	22	41
O=C(c1ccc(Cn2ccnc2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255810	GD	On-Demand	Anodyne	L3MBTL3	49	39
NCCOc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872255828	CD	On-Demand	Anodyne	EPHX2	22	50
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccccc3CN3CCCC3=O)[C@H]21	ZINC000872255835	GD	On-Demand	Anodyne	P2RX7	29	40
O=C(c1ccc(N2CCCC2)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255836	GD	On-Demand	Anodyne	L3MBTL3	82	46
N#Cc1ccnc(N2CCN(C(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872255844	ED	On-Demand	Mild	PRKD1	30	40
Cc1ccccc1CN1CCC(NC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)CC1	ZINC000872255845	GF	On-Demand	Anodyne	DRD4	15	52
Cc1ccccc1CN1CCC(NC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)CC1	ZINC000872255845	GF	On-Demand	Anodyne	SIGMAR1	17	46
Cc1ccccc1CN1CCC(NC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)CC1	ZINC000872255845	GF	On-Demand	Anodyne	CCR8	44	32
O=C(OC[C@@H]1CCCN1)c1cccc(NC(=O)[C@]23CCC[C@H]2CNC3)c1	ZINC000872255851	FD	On-Demand	Anodyne	CHRNA10	29	43
O=C(OC[C@H]1CCCN1)c1cccc(NC(=O)[C@]23CCC[C@H]2CNC3)c1	ZINC000872255853	FD	On-Demand	Anodyne	CHRNA10	29	43
O=C(c1ccc(-n2ccnc2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872255859	GD	On-Demand	Anodyne	L3MBTL3	54	36
Cc1ccc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2n1	ZINC000872255870	GD	On-Demand	Anodyne	L3MBTL3	61	39
COc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255880	FF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255880	FF	On-Demand	Anodyne	SSTR5	58	39
COc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255880	FF	On-Demand	Anodyne	MCHR1	16	42
COc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255881	FF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255881	FF	On-Demand	Anodyne	SSTR5	58	39
COc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1OC(=O)C1CC1	ZINC000872255881	FF	On-Demand	Anodyne	MCHR1	16	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc(S(C)(=O)=O)cc3)[C@H]21	ZINC000872255907	FE	On-Demand	Anodyne	HRH3	62	44
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc(C(=O)N4CCCCC4)c3)[C@H]21	ZINC000872255992	FG	On-Demand	Anodyne	PREP	30	41
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc(C(=O)N4CCCCC4)c3)[C@H]21	ZINC000872255992	FG	On-Demand	Anodyne	L3MBTL3	54	41
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccc(C(=O)N4CCCCC4)c3)[C@H]21	ZINC000872255992	FG	On-Demand	Anodyne	HPGD	41	33
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCCC(F)(F)CC1	ZINC000872256003	FH	On-Demand	Bother	L3MBTL3	25	45
O=C(c1cncc(-c2ccccc2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256013	GE	On-Demand	Anodyne	L3MBTL3	60	37
CN(C)c1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)ccn1	ZINC000872256022	FC	On-Demand	Anodyne	L3MBTL3	46	36
O=C([C@H]1CCCN1Cc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256026	GD	On-Demand	Anodyne	PREP	48	39
O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256027	GD	On-Demand	Anodyne	PREP	48	39
O=C(c1ccc(NC2CC2)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256029	FD	On-Demand	Anodyne	L3MBTL3	62	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCCOc3ccccc3)[C@H]21	ZINC000872256031	DF	On-Demand	Anodyne	LTA4H	24	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCCOc3ccccc3)[C@H]21	ZINC000872256031	DF	On-Demand	Anodyne	CHRNA10	44	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCC3(c4ccccc4)CC3)[C@H]21	ZINC000872256033	EE	On-Demand	Anodyne	KCNA3	47	38
C[C@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)C(=O)N1CCCCC1	ZINC000872256040	FC	On-Demand	Anodyne	DPP7	42	34
C[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)C(=O)N1CCCCC1	ZINC000872256041	FC	On-Demand	Anodyne	DPP7	42	34
O=C(c1cccnc1N1CCCC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256046	GD	On-Demand	Anodyne	L3MBTL3	64	40
NCCOc1cccc(NC(=O)[C@]23CCC[C@H]2OCC3)c1	ZINC000872256057	CD	On-Demand	Anodyne	EPHX2	19	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)[C@H]21	ZINC000872256065	DE	On-Demand	Bother	CACNA1C	43	36
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)[C@H]21	ZINC000872256065	DE	On-Demand	Bother	CACNA1D	67	36
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)[C@H]21	ZINC000872256065	DE	On-Demand	Bother	CHRNA10	42	33
C[C@@H](CC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1cccnc1	ZINC000872256077	FD	On-Demand	Anodyne	PTAFR	15	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccccc3F)[C@H]21	ZINC000872256172	DD	On-Demand	Anodyne	P2RX7	28	40
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(Cc2nccc3ccccc23)C1	ZINC000872256188	ED	On-Demand	Anodyne	PDE11A	40	30
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(Cc2nccc3ccccc23)C1	ZINC000872256189	ED	On-Demand	Anodyne	PDE11A	40	30
COc1cccc(O)c1CN1CCO[C@@H](C(F)F)CC1	ZINC000872256199	CE	On-Demand	Clean	DRD4	16	40
COc1cccc(O)c1CN1CCO[C@H](C(F)F)CC1	ZINC000872256200	CE	On-Demand	Clean	DRD4	16	40
O=C(c1cccc(OC(F)(F)F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256218	GD	On-Demand	Anodyne	L3MBTL3	40	39
CN1CCCC[C@H](N(C)C(=O)c2cccc(OC(C)(C)C)c2)C1=O	ZINC000872256219	EF	On-Demand	Anodyne	DRD4	44	34
CN1CCCC[C@H](N(C)C(=O)c2cccc(OC(C)(C)C)c2)C1=O	ZINC000872256219	EF	On-Demand	Anodyne	ACKR3	56	32
CN1CCCC[C@@H](N(C)C(=O)c2cccc(OC(C)(C)C)c2)C1=O	ZINC000872256220	EF	On-Demand	Anodyne	DRD4	44	34
CN1CCCC[C@@H](N(C)C(=O)c2cccc(OC(C)(C)C)c2)C1=O	ZINC000872256220	EF	On-Demand	Anodyne	ACKR3	56	32
O=C(c1ccnc(-n2cccn2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256221	GC	On-Demand	Anodyne	L3MBTL3	41	34
O=C(c1ccc2ncccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256235	FD	On-Demand	Anodyne	L3MBTL3	60	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCC3(c4ccccc4)CCOCC3)[C@H]21	ZINC000872256236	GE	On-Demand	Anodyne	KCNA3	44	36
O=C(c1ccc(-c2cnco2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256306	GD	On-Demand	Anodyne	L3MBTL3	58	35
Cc1ccc(N2CCCC2)c(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872256319	GD	On-Demand	Anodyne	L3MBTL3	58	37
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256352	FD	On-Demand	Anodyne	FKBP1A	42	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3cccc(Cl)c3)[C@H]21	ZINC000872256378	EG	On-Demand	Anodyne	MDM2	51	35
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc(C(=O)N4CCCC4)cc3)[C@H]21	ZINC000872256418	GE	On-Demand	Anodyne	L3MBTL3	70	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCCc3ccccc3)[C@H]21	ZINC000872256421	EE	On-Demand	Anodyne	FKBP1A	37	46
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCCc3ccccc3)[C@H]21	ZINC000872256421	EE	On-Demand	Anodyne	PREP	57	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCCc3ccccc3)[C@H]21	ZINC000872256421	EE	On-Demand	Anodyne	MTNR1A	27	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCCc3ccccc3)[C@H]21	ZINC000872256421	EE	On-Demand	Anodyne	MTNR1B	28	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCCc3ccccc3)[C@H]21	ZINC000872256421	EE	On-Demand	Anodyne	DPP7	15	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc4c(c3)OCO4)[C@H]21	ZINC000872256422	EF	On-Demand	Anodyne	HRH3	44	44
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc4c(c3)OCO4)[C@H]21	ZINC000872256422	EF	On-Demand	Anodyne	CHRNA10	17	50
O=C(CSCc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256426	GD	On-Demand	Anodyne	CHRNA7	41	35
COC(=O)c1sccc1NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256429	FD	On-Demand	Anodyne	FAS	52	46
C#CCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872256432	CF	On-Demand	Mild	HRH3	19	45
C#CCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872256432	CF	On-Demand	Mild	SIGMAR1	17	43
C#CCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872256437	CF	On-Demand	Mild	HRH3	19	45
C#CCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872256437	CF	On-Demand	Mild	SIGMAR1	17	43
FC(F)[C@H]1CCN(Cc2nc3ccccc3[nH]2)CCO1	ZINC000872256439	CE	On-Demand	Anodyne	DRD4	16	58
FC(F)[C@@H]1CCN(Cc2nc3ccccc3[nH]2)CCO1	ZINC000872256440	CE	On-Demand	Anodyne	DRD4	16	58
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872256455	EE	On-Demand	Anodyne	ACOX1	43	31
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872256455	EE	On-Demand	Anodyne	ABCB1	35	50
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872256456	EE	On-Demand	Anodyne	ACOX1	43	31
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872256456	EE	On-Demand	Anodyne	ABCB1	35	50
Cc1cc(F)ccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256458	ED	On-Demand	Anodyne	L3MBTL3	50	39
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc(Cl)nc3)[C@H]21	ZINC000872256473	CF	On-Demand	Anodyne	Q8WSF8_APLCA	47	39
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc(Cl)nc3)[C@H]21	ZINC000872256473	CF	On-Demand	Anodyne	NACHRBETA2	53	39
O=C(c1ccc(N2CCCCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256475	GE	On-Demand	Anodyne	L3MBTL3	99	52
O=C(c1ccc2c(c1O)CCCC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256476	GD	On-Demand	Anodyne	L3MBTL3	61	34
CN1CCCC[C@H](N(C)C(=O)Cc2ccc3cccnc3c2)C1=O	ZINC000872256484	EE	On-Demand	Anodyne	OPRK1	18	42
CN1CCCC[C@@H](N(C)C(=O)Cc2ccc3cccnc3c2)C1=O	ZINC000872256485	EE	On-Demand	Anodyne	OPRK1	18	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc(C#N)c3)[C@H]21	ZINC000872256488	DE	On-Demand	Mild	HRH3	21	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc(C#N)c3)[C@H]21	ZINC000872256488	DE	On-Demand	Mild	CHRNA10	71	54
COc1cccc(S(=O)(=O)CCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872256497	FD	On-Demand	Anodyne	CHRNA10	33	40
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccccc3Cl)[C@H]21	ZINC000872256502	EF	On-Demand	Anodyne	ABCB1	46	36
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccccc3Cl)[C@H]21	ZINC000872256504	EF	On-Demand	Anodyne	ABCB1	46	36
O=C(COc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256506	EC	On-Demand	Anodyne	CHRNA7	22	40
O=C(COc1cccnc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256506	EC	On-Demand	Anodyne	CPT1A	41	36
O=C(c1cccc(CN2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256521	GD	On-Demand	Anodyne	PARP1	17	42
O=C(c1cccc(CN2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256521	GD	On-Demand	Anodyne	L3MBTL3	80	43
Cn1nnc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc21	ZINC000872256533	FC	On-Demand	Anodyne	L3MBTL3	58	34
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cccnc3)[C@H]21	ZINC000872256553	BE	On-Demand	Anodyne	ACHP_LYMST	23	41
CCCN(C)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872256578	GD	On-Demand	Anodyne	L3MBTL3	58	38
O=C(OC[C@H]1CCCN1)c1cccc(NC(=O)[C@]23CCC[C@H]2OCC3)c1	ZINC000872256593	FE	On-Demand	Anodyne	CHRNA10	29	43
O=C(OC[C@@H]1CCCN1)c1cccc(NC(=O)[C@]23CCC[C@H]2OCC3)c1	ZINC000872256594	FE	On-Demand	Anodyne	CHRNA10	29	43
O=C(c1ccc(Cl)cn1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256605	FD	On-Demand	Anodyne	L3MBTL3	15	42
NCc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872256615	CD	On-Demand	Anodyne	NOS1	24	48
O=C(c1ccc2nccn2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256655	FC	On-Demand	Anodyne	L3MBTL3	51	35
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCCc3ccccc3)[C@H]21	ZINC000872256671	DG	On-Demand	Anodyne	HRH3	25	45
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc(C#N)cc3)[C@H]21	ZINC000872256679	DF	On-Demand	Mild	HRH3	62	60
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3ccc(C#N)cc3)[C@H]21	ZINC000872256679	DF	On-Demand	Mild	MEN1	46	44
O=C(c1ccc(Br)cn1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256686	GD	On-Demand	Anodyne	L3MBTL3	17	42
Cc1cncc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872256692	EC	On-Demand	Anodyne	L3MBTL3	43	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(C(=O)OC[C@@H]3CCCN3)c2)C1	ZINC000872256701	ED	On-Demand	Anodyne	CHRNA10	33	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(C(=O)OC[C@H]3CCCN3)c2)C1	ZINC000872256703	ED	On-Demand	Anodyne	CHRNA10	33	45
C[C@@H](CCCc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256752	GE	On-Demand	Anodyne	GHRHR	44	35
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256760	GE	On-Demand	Anodyne	MC4R	26	41
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256760	GE	On-Demand	Anodyne	CCR1	25	41
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256760	GE	On-Demand	Anodyne	ST14	55	36
CSc1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)ccc1F	ZINC000872256794	GD	On-Demand	Anodyne	L3MBTL3	65	35
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3nc(-c4cccc(Cl)c4)no3)[C@H]21	ZINC000872256859	EG	On-Demand	Anodyne	GRM5	22	47
Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872256866	CF	On-Demand	Anodyne	HRH3	19	41
Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872256866	CF	On-Demand	Anodyne	SSTR5	27	41
Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872256867	CF	On-Demand	Anodyne	HRH3	19	41
Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872256867	CF	On-Demand	Anodyne	SSTR5	27	41
CC(=O)c1ccccc1OCCN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256880	DF	On-Demand	Anodyne	HCN1	66	33
CC(=O)c1ccccc1OCCN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256880	DF	On-Demand	Anodyne	HCN4	50	32
CCOc1cc(Cl)ccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256932	GE	On-Demand	Anodyne	OXTR	18	42
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256943	EH	On-Demand	Anodyne	PPARG	65	41
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256943	EH	On-Demand	Anodyne	PPARA	69	42
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256943	EH	On-Demand	Anodyne	PDE8B	67	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	ACE	53	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	OPRM1	55	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	MME	57	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CMA1	52	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CTRA_BOVIN	55	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	TRY1_BOVIN	43	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CYSP_TRYCR	42	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CTSG	44	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	NPFFR2	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	TIMP3	62	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CELA2A	53	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	CAPN1	41	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	ACE2	54	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	PSMB8	54	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256946	FD	On-Demand	Anodyne	BRCA1	65	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	ACE	53	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	OPRM1	55	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	MME	57	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CMA1	52	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CTRA_BOVIN	55	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	TRY1_BOVIN	43	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CYSP_TRYCR	42	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CTSG	44	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	NPFFR2	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	TIMP3	62	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CELA2A	53	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	CAPN1	41	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	ACE2	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	PSMB8	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256947	FD	On-Demand	Anodyne	BRCA1	65	34
O=C(CC1CC(c2ccccc2)C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872256957	GE	On-Demand	Anodyne	CALCRL	17	41
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256999	EE	On-Demand	Anodyne	DRD4	30	52
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872256999	EE	On-Demand	Anodyne	TPP2	56	34
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCc4ccccc4C3)[C@H]21	ZINC000872257042	EE	On-Demand	Anodyne	DPP8	15	46
CCCOc1cccc(CC(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872257064	GD	On-Demand	Anodyne	UPP1	43	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)[C@H]21	ZINC000872257069	GE	On-Demand	Anodyne	EPHX2	20	40
C[C@H](N)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872257080	FD	On-Demand	Anodyne	L3MBTL3	69	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCCc4ccccc43)[C@H]21	ZINC000872257081	EE	On-Demand	Anodyne	DRD4	15	48
O=C1O[C@H]2CNC[C@H]2N1[C@H]1CCN(Cc2ccc(OCCCCl)cc2)C1	ZINC000872257115	GE	On-Demand	Reactive	HRH3	15	41
O=C1O[C@H]2CNC[C@H]2N1[C@@H]1CCN(Cc2ccc(OCCCCl)cc2)C1	ZINC000872257116	GE	On-Demand	Reactive	HRH3	15	41
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cc(=O)c(O)co3)[C@H]21	ZINC000872257134	CD	On-Demand	Anodyne	PPO2	15	43
O=C(c1ccc2ncsc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257136	FD	On-Demand	Anodyne	L3MBTL3	53	34
FC(F)[C@@H]1CCN(Cc2ccc(OCCCCl)cc2)CCO1	ZINC000872257141	EH	On-Demand	Reactive	HRH3	32	50
FC(F)[C@@H]1CCN(Cc2ccc(OCCCCl)cc2)CCO1	ZINC000872257141	EH	On-Demand	Reactive	SIGMAR1	22	44
FC(F)[C@H]1CCN(Cc2ccc(OCCCCl)cc2)CCO1	ZINC000872257142	EH	On-Demand	Reactive	HRH3	32	50
FC(F)[C@H]1CCN(Cc2ccc(OCCCCl)cc2)CCO1	ZINC000872257142	EH	On-Demand	Reactive	SIGMAR1	22	44
CC(C)c1cccc(C(C)C)c1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872257158	DH	On-Demand	Anodyne	SOAT1	54	39
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257162	EE	On-Demand	Anodyne	ADRB1	21	50
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257162	EE	On-Demand	Anodyne	HTR1A	19	53
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257162	EE	On-Demand	Anodyne	SLC6A4	23	50
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257164	EE	On-Demand	Anodyne	ADRB1	21	50
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257164	EE	On-Demand	Anodyne	HTR1A	19	53
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3cccc4[nH]ccc34)[C@H]21	ZINC000872257164	EE	On-Demand	Anodyne	SLC6A4	23	50
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872257175	GD	On-Demand	Anodyne	HRH3	30	41
Cc1nc2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc2nc1C	ZINC000872257187	GD	On-Demand	Anodyne	L3MBTL3	69	38
Cn1cnc(-c2ccc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)cc2)n1	ZINC000872257238	GC	On-Demand	Anodyne	L3MBTL3	60	35
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccccc3F)[C@H]21	ZINC000872257246	CF	On-Demand	Anodyne	CHRNA10	29	47
O=C(c1cccnc1N1CCCCC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257250	GD	On-Demand	Anodyne	L3MBTL3	58	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCC3(N4CCOCC4)CCCCC3)[C@H]21	ZINC000872257257	GD	On-Demand	Anodyne	HCN1	54	33
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCC3(N4CCOCC4)CCCCC3)[C@H]21	ZINC000872257257	GD	On-Demand	Anodyne	HCN4	51	33
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(CCCCCOc2ccccc2)C1	ZINC000872257260	FE	On-Demand	Anodyne	HRH3	27	43
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(CCCCCOc2ccccc2)C1	ZINC000872257260	FE	On-Demand	Anodyne	SIGMAR1	15	42
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(CCCCCOc2ccccc2)C1	ZINC000872257261	FE	On-Demand	Anodyne	HRH3	27	43
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(CCCCCOc2ccccc2)C1	ZINC000872257261	FE	On-Demand	Anodyne	SIGMAR1	15	42
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(Cc2ccc(OCC3CC3)cc2)C1	ZINC000872257277	FD	On-Demand	Anodyne	SIGMAR1	16	47
O=C(c1ccc(Cn2cccn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257282	GD	On-Demand	Anodyne	L3MBTL3	55	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3ccc(F)cc3)[C@H]21	ZINC000872257289	FD	On-Demand	Anodyne	HRH3	17	41
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(Cc2ccc(OCC3CC3)cc2)C1	ZINC000872257323	FD	On-Demand	Anodyne	SIGMAR1	16	47
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(C[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000872257394	ED	On-Demand	Anodyne	CCR5	23	42
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(C[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000872257395	ED	On-Demand	Anodyne	CCR5	23	42
O=C(c1ccc(OC2CCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257432	GE	On-Demand	Anodyne	L3MBTL3	84	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCc3ccc(F)cc3)[C@H]21	ZINC000872257465	ED	On-Demand	Anodyne	GPBAR1	18	41
O=C(c1ccc(-n2cccn2)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257466	GC	On-Demand	Anodyne	L3MBTL3	42	39
CN1C(=O)CCc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872257472	GC	On-Demand	Anodyne	L3MBTL3	58	34
COc1ccccc1N1CC[C@@H](N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000872257504	EE	On-Demand	Anodyne	HTR1A	35	43
COc1ccccc1N1CC[C@@H](N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000872257504	EE	On-Demand	Anodyne	ADRA1A	21	42
COc1ccccc1N1CC[C@H](N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000872257505	EE	On-Demand	Anodyne	HTR1A	35	43
COc1ccccc1N1CC[C@H](N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000872257505	EE	On-Demand	Anodyne	ADRA1A	21	42
N[C@H]1CCCCC[C@H]1C(=O)NC[C@H](N)c1ccccc1	ZINC000872257521	CD	On-Demand	Anodyne	AMY2	44	30
N[C@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872257522	CD	On-Demand	Anodyne	AMY2	44	30
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccccc3N3CCCC3=O)[C@H]21	ZINC000872257575	FE	On-Demand	Anodyne	KCNQ2	41	35
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccccc3)[C@H]21	ZINC000872257646	BF	On-Demand	Anodyne	SIGMAR1	52	43
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccccc3[N+](=O)[O-])[C@H]21	ZINC000872257751	CF	On-Demand	Bother	COLA	63	31
CC(=O)c1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)ccc1C	ZINC000872257774	FD	On-Demand	Anodyne	L3MBTL3	75	39
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccccc3)[C@H]21	ZINC000872257778	DD	On-Demand	Anodyne	ADRB2	17	47
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccccc3)[C@H]21	ZINC000872257779	DD	On-Demand	Anodyne	ADRB2	17	47
O=C(c1cccc(-c2ccoc2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872257825	GE	On-Demand	Anodyne	L3MBTL3	48	40
O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(CCCc2ccc3c(c2)CCO3)C1	ZINC000872257842	FD	On-Demand	Anodyne	PDE11A	41	31
O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(CCCc2ccc3c(c2)CCO3)C1	ZINC000872257843	FD	On-Demand	Anodyne	PDE11A	41	31
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]21	ZINC000872257907	DF	On-Demand	Bother	HRH3	28	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]21	ZINC000872257907	DF	On-Demand	Bother	KCNJ1	33	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCCC1=O	ZINC000872257909	CD	On-Demand	Anodyne	TYRO3	20	41
C[C@H](N)c1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872257934	CE	On-Demand	Anodyne	F2	27	44
C[C@H](N)c1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872257934	CE	On-Demand	Anodyne	PROC	43	34
CC[C@H](C)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258003	FF	On-Demand	Anodyne	L3MBTL3	70	37
CC[C@@H](C)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258004	FF	On-Demand	Anodyne	L3MBTL3	70	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3cccc(F)c3)[C@H]21	ZINC000872258025	FD	On-Demand	Anodyne	CHRNA10	45	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3cccc(S(C)(=O)=O)c3)[C@H]21	ZINC000872258059	FD	On-Demand	Anodyne	CHRNA10	42	33
COc1cc(C)c(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1OC	ZINC000872258124	GD	On-Demand	Anodyne	L3MBTL3	19	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3nc(-c4ccccc4)no3)[C@H]21	ZINC000872258152	EF	On-Demand	Anodyne	SPHK1	31	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccnc3)[C@H]21	ZINC000872258164	DD	On-Demand	Anodyne	CHRNA7	45	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccnc3)[C@H]21	ZINC000872258164	DD	On-Demand	Anodyne	NAMPT	70	45
O=C(c1ccc(C(F)(F)F)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258169	GD	On-Demand	Anodyne	SFRP1	27	43
O=C(c1ccc(C(F)(F)F)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258169	GD	On-Demand	Anodyne	L3MBTL3	51	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(C)(=O)=O)cc3)[C@H]21	ZINC000872258184	FD	On-Demand	Anodyne	LTA4H	20	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOc3ccc(S(C)(=O)=O)cc3)[C@H]21	ZINC000872258184	FD	On-Demand	Anodyne	HRH3	39	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCNS(=O)(=O)c3ccccc3)[C@H]21	ZINC000872258233	ED	On-Demand	Anodyne	HTR7	15	44
CC1(C)[C@@H](O)[C@H]2CCCN(CCNS(=O)(=O)c3ccccc3)[C@H]21	ZINC000872258233	ED	On-Demand	Anodyne	SFRP1	49	34
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)OCc3ccccc3)[C@H]21	ZINC000872258249	DE	On-Demand	Anodyne	CTRA_BOVIN	66	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)OCc3ccccc3)[C@H]21	ZINC000872258249	DE	On-Demand	Anodyne	TRY1_BOVIN	43	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)OCc3ccccc3)[C@H]21	ZINC000872258249	DE	On-Demand	Anodyne	CTSG	47	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)OCc3ccccc3)[C@H]21	ZINC000872258249	DE	On-Demand	Anodyne	CELA2A	55	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)OCc3ccccc3)[C@H]21	ZINC000872258249	DE	On-Demand	Anodyne	SLC12A5	79	41
CCC(=O)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258267	FD	On-Demand	Anodyne	L3MBTL3	81	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258303	GD	On-Demand	Anodyne	EDNRB	56	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258303	GD	On-Demand	Anodyne	EDNRA	57	44
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCCOc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258303	GD	On-Demand	Anodyne	NOS2	55	34
O=C(c1ccccc1OC1CCC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258310	GE	On-Demand	Anodyne	L3MBTL3	44	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccnc3Cl)[C@H]21	ZINC000872258311	DE	On-Demand	Anodyne	G2YM83_BOTF4	72	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3ccc(N4CCOCC4)cc3)[C@H]21	ZINC000872258323	GE	On-Demand	Anodyne	MTOR	53	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(F)cc3Cl)[C@H]21	ZINC000872258338	EF	On-Demand	Anodyne	P2RX7	16	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(F)c(Cl)c3)[C@H]21	ZINC000872258344	EF	On-Demand	Anodyne	MCHR1	39	43
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NC(=O)NC3CCCCC3)[C@H]21	ZINC000872258358	ED	On-Demand	Anodyne	EPHX2	18	41
O=C(C[C@H]1CCc2ccccc2C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258376	GD	On-Demand	Anodyne	PREP	27	45
O=C(C[C@H]1CCc2ccccc2C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258376	GD	On-Demand	Anodyne	CALCRL	27	40
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258377	GD	On-Demand	Anodyne	PREP	27	45
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258377	GD	On-Demand	Anodyne	CALCRL	27	40
O=C(c1ccc2nc(S)oc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258387	GD	On-Demand	Anodyne	L3MBTL3	54	36
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc4ccccc34)[C@H]21	ZINC000872258412	EG	On-Demand	Anodyne	CCR8	45	35
COCCOc1ccc(CNC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872258417	GD	On-Demand	Anodyne	LTA4H	17	42
C=CC(=O)Nc1ccc(C(=O)N2CCCC(F)(F)CC2)cc1	ZINC000872258426	DG	On-Demand	Anodyne	EPHX2	22	41
C=CC(=O)Nc1ccc(C(=O)N2CCCC(F)(F)CC2)cc1	ZINC000872258426	DG	On-Demand	Anodyne	TGM2	70	56
C=CC(=O)Nc1ccc(C(=O)N2CCCC(F)(F)CC2)cc1	ZINC000872258426	DG	On-Demand	Anodyne	F13A1	102	56
C=CC(=O)Nc1ccc(C(=O)N2CCCC(F)(F)CC2)cc1	ZINC000872258426	DG	On-Demand	Anodyne	L3MBTL3	43	35
COc1ccc2c(CN3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)cc(=O)oc2c1	ZINC000872258450	EF	On-Demand	Anodyne	CYP11B1	16	41
COc1ccc2c(CN3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)cc(=O)oc2c1	ZINC000872258450	EF	On-Demand	Anodyne	MAOB	20	49
O=C(C[C@@H]1CCc2ccccc21)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258493	FD	On-Demand	Anodyne	CALCRL	22	40
O=C(C[C@H]1CCc2ccccc21)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258494	FD	On-Demand	Anodyne	CALCRL	22	40
CNc1nc(C(=O)N(C)[C@H]2CCCCN(C)C2=O)cs1	ZINC000872258495	CD	On-Demand	Anodyne	TRPC6	45	37
CNc1nc(C(=O)N(C)[C@@H]2CCCCN(C)C2=O)cs1	ZINC000872258496	CD	On-Demand	Anodyne	TRPC6	45	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc(Cl)cc3)[C@H]21	ZINC000872258504	EE	On-Demand	Anodyne	P2RX7	20	46
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc(Cl)cc3)[C@H]21	ZINC000872258504	EE	On-Demand	Anodyne	DPP7	37	43
O=C(Nc1n[nH]c2ccccc12)[C@]12CCC[C@H]1CNC2	ZINC000872258505	CD	On-Demand	Anodyne	GSK3A	29	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccco2)CC1	ZINC000872258511	DD	On-Demand	Anodyne	L3MBTL3	66	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872258526	FE	On-Demand	Anodyne	LPL	44	38
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872258526	FE	On-Demand	Anodyne	EPHX2	37	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872258526	FE	On-Demand	Anodyne	TGM2	52	38
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872258526	FE	On-Demand	Anodyne	F13A1	71	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872258526	FE	On-Demand	Anodyne	AKR1C3	55	44
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3cccc(C(=O)NC4CC4)c3)[C@H]21	ZINC000872258534	GD	On-Demand	Anodyne	MAPK14	25	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258548	ED	On-Demand	Anodyne	EDNRA	41	39
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258548	ED	On-Demand	Anodyne	NOS2	106	44
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NCc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258548	ED	On-Demand	Anodyne	MCHR1	21	44
CC(=O)c1cccc(NC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872258558	EE	On-Demand	Anodyne	CCR3	23	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(Cl)cn3)[C@H]21	ZINC000872258570	DE	On-Demand	Anodyne	F10	50	32
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc4ccccc4c3)[C@H]21	ZINC000872258597	EG	On-Demand	Anodyne	IMDH_CRYPV	19	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(N4CCOCC4)cc3)[C@H]21	ZINC000872258598	FD	On-Demand	Anodyne	MTOR	58	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccccc3C(=O)NC3CC3)[C@H]21	ZINC000872258599	FD	On-Demand	Anodyne	CCR8	54	35
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3cc(=O)oc4cc(O)ccc34)[C@H]21	ZINC000872258603	EE	On-Demand	Anodyne	HSD17B3	33	49
O=C(c1ccc2sccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258610	FE	On-Demand	Anodyne	L3MBTL3	69	38
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccccc3Cl)[C@H]21	ZINC000872258633	DF	On-Demand	Anodyne	KCNQ2	41	39
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000872258637	FD	On-Demand	Anodyne	XIAP	47	37
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000872258637	FD	On-Demand	Anodyne	BIRC8	43	30
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1n[nH]c2ccccc12	ZINC000872258639	CE	On-Demand	Anodyne	GSK3B	15	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1n[nH]c2ccccc12	ZINC000872258639	CE	On-Demand	Anodyne	GSK3A	50	48
COCCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258641	GD	On-Demand	Anodyne	AVPR1A	15	44
COCCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258641	GD	On-Demand	Anodyne	L3MBTL3	63	36
O=C(CCCCCc1cccs1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258659	GF	On-Demand	Anodyne	ETHR	44	35
C[C@@H](CCc1ccccc1F)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258661	GE	On-Demand	Anodyne	CCR1	15	40
C[C@H](CCc1ccccc1F)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258662	GE	On-Demand	Anodyne	CCR1	15	40
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3nc(O)c4oc5ccccc5c4n3)[C@H]21	ZINC000872258674	FG	On-Demand	Anodyne	PIM1	18	46
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3nc(O)c4oc5ccccc5c4n3)[C@H]21	ZINC000872258674	FG	On-Demand	Anodyne	CDC7	21	46
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3nc(O)c4oc5ccccc5c4n3)[C@H]21	ZINC000872258674	FG	On-Demand	Anodyne	PIM3	21	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000872258678	EH	On-Demand	Anodyne	ROCK1	15	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000872258678	EH	On-Demand	Anodyne	SPHK2	62	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000872258678	EH	On-Demand	Anodyne	SPHK1	50	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)C1	ZINC000872258680	EG	On-Demand	Anodyne	STK33	53	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3cccc(C#N)c3)[C@H]21	ZINC000872258683	DF	On-Demand	Mild	HRH3	48	48
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3cccc(C#N)c3)[C@H]21	ZINC000872258683	DF	On-Demand	Mild	CHRNA10	70	53
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOc3cccc(C#N)c3)[C@H]21	ZINC000872258683	DF	On-Demand	Mild	MEN1	40	37
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NNC(=O)c3cccc(Cl)c3)[C@H]21	ZINC000872258703	FD	On-Demand	Reactive	CACNA1I	24	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3sc4c(c3C#N)CCC4)[C@H]21	ZINC000872258705	FF	On-Demand	Mild	VIPR1	30	48
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc(C#N)c3)[C@H]21	ZINC000872258724	DD	On-Demand	Mild	CCR3	16	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3cccc(C#N)c3)[C@H]21	ZINC000872258724	DD	On-Demand	Mild	MCHR1	44	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc4c(c3)OCO4)[C@H]21	ZINC000872258734	ED	On-Demand	Anodyne	EDNRA	18	41
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c(Cl)c1	ZINC000872258738	GD	On-Demand	Anodyne	OXTR	21	43
O=C(c1cccc(OC2CCCC2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258759	GE	On-Demand	Anodyne	L3MBTL3	61	41
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	DRD2	21	49
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	DRD4	22	45
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	HTR2A	19	58
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	HRH1	17	42
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	SLC6A3	19	40
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	SLC18A2	53	43
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	GRIN2B	28	41
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	LTA4H	46	49
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	HRH3	36	51
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	SIGMAR1	88	60
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	ABCB1	16	40
c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258776	CH	On-Demand	Anodyne	L3MBTL3	32	40
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	DRD2	21	49
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	DRD4	22	45
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	HTR2A	19	58
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	HRH1	17	42
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	SLC6A3	19	40
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	SLC18A2	53	43
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	GRIN2B	28	41
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	LTA4H	46	49
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	HRH3	36	51
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	SIGMAR1	88	60
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	ABCB1	16	40
c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258777	CH	On-Demand	Anodyne	L3MBTL3	32	40
C#Cc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258806	CH	On-Demand	Mild	HRH3	28	47
C#Cc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258806	CH	On-Demand	Mild	SIGMAR1	22	40
C#Cc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258807	CH	On-Demand	Mild	HRH3	28	47
C#Cc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258807	CH	On-Demand	Mild	SIGMAR1	22	40
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1C#N	ZINC000872258811	DG	On-Demand	Mild	ACHE	15	41
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1C#N	ZINC000872258811	DG	On-Demand	Mild	SSTR5	61	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1C#N	ZINC000872258812	DG	On-Demand	Mild	ACHE	15	41
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1C#N	ZINC000872258812	DG	On-Demand	Mild	SSTR5	61	42
NS(=O)(=O)c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1F	ZINC000872258855	FE	On-Demand	Anodyne	SSTR5	23	43
NS(=O)(=O)c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1F	ZINC000872258856	FE	On-Demand	Anodyne	SSTR5	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872258882	GD	On-Demand	Anodyne	FKBP1A	20	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872258882	GD	On-Demand	Anodyne	PREP	45	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(-n3cnnn3)c2)C1	ZINC000872258891	CC	On-Demand	Anodyne	KCNJ1	44	33
NC(=O)c1ccc(CNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872258892	CD	On-Demand	Anodyne	F2	24	46
NC(=O)c1ccc(CNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872258892	CD	On-Demand	Anodyne	LNPEP	23	40
NC(=O)c1ccc(CNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872258892	CD	On-Demand	Anodyne	PROC	61	37
NC(=O)c1ccc(CNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872258892	CD	On-Demand	Anodyne	TMPRSS11D	62	37
CC(=O)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872258896	FD	On-Demand	Anodyne	L3MBTL3	86	41
c1cnc2nc(CN3CCC[C@H](OC4CCC4)CC3)cn2c1	ZINC000872258916	DF	On-Demand	Anodyne	SCN5A	51	32
c1cnc2nc(CN3CCC[C@@H](OC4CCC4)CC3)cn2c1	ZINC000872258917	DF	On-Demand	Anodyne	SCN5A	51	32
Cn1c(=O)oc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc21	ZINC000872258921	EG	On-Demand	Anodyne	SSTR5	45	36
Cn1c(=O)oc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc21	ZINC000872258922	EG	On-Demand	Anodyne	SSTR5	45	36
c1ccc(-n2ccnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872258923	EH	On-Demand	Anodyne	SCN5A	52	33
c1ccc(-n2ccnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872258924	EH	On-Demand	Anodyne	SCN5A	52	33
CS(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872258937	EG	On-Demand	Anodyne	ACHE	20	40
CS(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872258937	EG	On-Demand	Anodyne	SIGMAR1	31	41
CS(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872258937	EG	On-Demand	Anodyne	SSTR5	29	43
CS(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872258938	EG	On-Demand	Anodyne	ACHE	20	40
CS(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872258938	EG	On-Demand	Anodyne	SIGMAR1	31	41
CS(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872258938	EG	On-Demand	Anodyne	SSTR5	29	43
N#Cc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872258952	DH	On-Demand	Mild	SIGMAR1	15	40
N#Cc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872258953	DH	On-Demand	Mild	SIGMAR1	15	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3ccccc3C(F)(F)F)[C@H]21	ZINC000872258964	FH	On-Demand	Anodyne	RBP4	54	35
O=C(CCOc1cccc(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872258965	GD	On-Demand	Anodyne	ETHR	26	40
NS(=O)(=O)c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1Cl	ZINC000872258999	FF	On-Demand	Anodyne	SSTR5	25	43
NS(=O)(=O)c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1Cl	ZINC000872258999	FF	On-Demand	Anodyne	CCR3	21	40
NS(=O)(=O)c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1Cl	ZINC000872259000	FF	On-Demand	Anodyne	SSTR5	25	43
NS(=O)(=O)c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1Cl	ZINC000872259000	FF	On-Demand	Anodyne	CCR3	21	40
C=CCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872259021	FD	On-Demand	Mild	L3MBTL3	59	36
c1ccc2nc(CN3CCC[C@H](OC4CCC4)CC3)cnc2c1	ZINC000872259031	DH	On-Demand	Anodyne	SCN5A	66	34
c1ccc2nc(CN3CCC[C@@H](OC4CCC4)CC3)cnc2c1	ZINC000872259032	DH	On-Demand	Anodyne	SCN5A	66	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3cccnc3)[C@H]21	ZINC000872259037	CE	On-Demand	Anodyne	FKBP1A	15	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3cccnc3)[C@H]21	ZINC000872259037	CE	On-Demand	Anodyne	HRH3	26	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3cccnc3)[C@H]21	ZINC000872259037	CE	On-Demand	Anodyne	CHRNA7	41	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3cccnc3)[C@H]21	ZINC000872259037	CE	On-Demand	Anodyne	ACHP_LYMST	24	42
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	CHRM2	16	42
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	DRD2	26	47
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	DRD4	41	44
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	ACHE	40	43
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	HRH1	15	46
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	CHRM3	31	48
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	SIGMAR1	43	47
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	SSTR5	72	39
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	CCR3	52	46
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	BDKRB1	30	40
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	CXCR3	21	46
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	MCHR1	38	43
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	ALK	17	41
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259064	DG	On-Demand	Anodyne	CCR8	21	41
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	CHRM2	16	42
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	DRD2	26	47
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	DRD4	41	44
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	ACHE	40	43
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	HRH1	15	46
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	CHRM3	31	48
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	SIGMAR1	43	47
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	SSTR5	72	39
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	CCR3	52	46
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	BDKRB1	30	40
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	CXCR3	21	46
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	MCHR1	38	43
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	ALK	17	41
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259065	DG	On-Demand	Anodyne	CCR8	21	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3nc4c(s3)CCC4)[C@H]21	ZINC000872259119	EE	On-Demand	Anodyne	SLC27A1	41	49
O=C1c2ccccc2C(=O)N1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259129	EF	On-Demand	Anodyne	HTR1A	20	51
O=C1c2ccccc2C(=O)N1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259129	EF	On-Demand	Anodyne	SLC6A1	50	34
O=C1c2ccccc2C(=O)N1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259130	EF	On-Demand	Anodyne	HTR1A	20	51
O=C1c2ccccc2C(=O)N1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259130	EF	On-Demand	Anodyne	SLC6A1	50	34
COc1cccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872259131	DF	On-Demand	Anodyne	HRH3	21	49
COc1cccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872259131	DF	On-Demand	Anodyne	EBP	45	34
COc1cccc(OCCN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872259131	DF	On-Demand	Anodyne	CHRNA10	63	49
Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872259150	CF	On-Demand	Anodyne	HRH3	18	41
Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872259151	CF	On-Demand	Anodyne	HRH3	18	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3nc4ccccc4s3)[C@H]21	ZINC000872259166	EF	On-Demand	Anodyne	CSNK1D	41	47
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3nc4ccccc4s3)[C@H]21	ZINC000872259166	EF	On-Demand	Anodyne	SLC27A1	32	50
CCOc1ccccc1NC(=O)CCN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872259176	EF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1NC(=O)CCN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000872259176	EF	On-Demand	Anodyne	HCN4	44	34
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872259189	FF	On-Demand	Anodyne	SSTR5	24	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872259190	FF	On-Demand	Anodyne	SSTR5	24	43
CCCNC(=O)c1ccccc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872259195	DD	On-Demand	Anodyne	HCN1	43	31
CN(C)c1nccc(CN2CCC[C@H](OC3CCC3)CC2)n1	ZINC000872259202	DE	On-Demand	Anodyne	SCN5A	58	36
CN(C)c1nccc(CN2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000872259203	DE	On-Demand	Anodyne	SCN5A	58	36
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3nc4c(s3)CCCC4)[C@H]21	ZINC000872259209	EE	On-Demand	Anodyne	SLC27A1	50	52
O=C(c1ccc(OC2CCCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872259241	GE	On-Demand	Anodyne	L3MBTL3	79	39
Fc1c(CN2CCC[C@H](OC3CCC3)CC2)ccnc1Cl	ZINC000872259251	DH	On-Demand	Anodyne	SCN5A	46	37
Fc1c(CN2CCC[C@@H](OC3CCC3)CC2)ccnc1Cl	ZINC000872259252	DH	On-Demand	Anodyne	SCN5A	46	37
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000872259254	ED	On-Demand	Reactive	KCNK3	45	35
Cn1nnc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872259258	FC	On-Demand	Anodyne	L3MBTL3	58	34
Cn1nnc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872259258	FC	On-Demand	Anodyne	HPGD	40	35
c1cc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2cn1	ZINC000872259262	DI	On-Demand	Anodyne	SSTR5	49	39
c1cc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2cn1	ZINC000872259263	DI	On-Demand	Anodyne	SSTR5	49	39
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	ESR1	91	41
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	SLC6A4	15	42
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	KCNH2	18	48
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	ESR2	61	44
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	LTA4H	72	64
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	HRH3	99	49
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	SIGMAR1	34	50
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	EBP	52	50
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	CHRNA10	44	37
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	PSMB2	49	51
COc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259273	DG	On-Demand	Anodyne	PSMB1	54	51
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	ESR1	91	41
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	SLC6A4	15	42
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	KCNH2	18	48
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	ESR2	61	44
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	LTA4H	72	64
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	HRH3	99	49
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	SIGMAR1	34	50
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	EBP	52	50
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	CHRNA10	44	37
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	PSMB2	49	51
COc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259274	DG	On-Demand	Anodyne	PSMB1	54	51
CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872259302	GC	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)C(=O)N1CCC[C@H]1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872259303	GC	On-Demand	Anodyne	WNT3	40	33
Cc1nccc(CN2CCC[C@H](OC3CCC3)CC2)n1	ZINC000872259305	CF	On-Demand	Anodyne	SCN5A	73	39
Cc1nccc(CN2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000872259306	CF	On-Demand	Anodyne	SCN5A	73	39
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1O	ZINC000872259311	EG	On-Demand	Anodyne	ACHE	15	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1O	ZINC000872259311	EG	On-Demand	Anodyne	SSTR5	61	39
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1O	ZINC000872259312	EG	On-Demand	Anodyne	ACHE	15	42
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1O	ZINC000872259312	EG	On-Demand	Anodyne	SSTR5	61	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)N2CCCCC2)C1	ZINC000872259325	EE	On-Demand	Anodyne	NPSR1	17	50
Fc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259366	DH	On-Demand	Anodyne	SLC6A1	58	34
Fc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259366	DH	On-Demand	Anodyne	LTA4H	53	51
Fc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259366	DH	On-Demand	Anodyne	HTR7	17	40
Fc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259366	DH	On-Demand	Anodyne	CHRNA10	33	49
Fc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872259366	DH	On-Demand	Anodyne	PSMB1	41	37
Fc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259367	DH	On-Demand	Anodyne	SLC6A1	58	34
Fc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259367	DH	On-Demand	Anodyne	LTA4H	53	51
Fc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259367	DH	On-Demand	Anodyne	HTR7	17	40
Fc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259367	DH	On-Demand	Anodyne	CHRNA10	33	49
Fc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259367	DH	On-Demand	Anodyne	PSMB1	41	37
COc1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259381	FG	On-Demand	Anodyne	HRH3	20	44
COc1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259381	FG	On-Demand	Anodyne	SIGMAR1	21	44
COc1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259382	FG	On-Demand	Anodyne	HRH3	20	44
COc1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259382	FG	On-Demand	Anodyne	SIGMAR1	21	44
COC[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259385	EI	On-Demand	Anodyne	LTA4H	19	43
COC[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259385	EI	On-Demand	Anodyne	HRH3	25	52
COC[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259385	EI	On-Demand	Anodyne	SIGMAR1	16	40
COC[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259386	EI	On-Demand	Anodyne	LTA4H	19	43
COC[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259386	EI	On-Demand	Anodyne	HRH3	25	52
COC[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259386	EI	On-Demand	Anodyne	SIGMAR1	16	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3ccc(Cl)cc3)[C@H]21	ZINC000872259427	EG	On-Demand	Anodyne	CCR1	41	34
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	LTA4H	19	41
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	HRH3	51	54
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	SIGMAR1	30	42
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	CCR3	24	43
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	PREP	20	40
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	LSS	18	47
O=C(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259450	FH	On-Demand	Anodyne	L3MBTL3	97	62
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	LTA4H	19	41
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	HRH3	51	54
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	SIGMAR1	30	42
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	CCR3	24	43
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	PREP	20	40
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	LSS	18	47
O=C(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)N1CCCC1	ZINC000872259451	FH	On-Demand	Anodyne	L3MBTL3	97	62
Fc1ccc(-n2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259457	EG	On-Demand	Anodyne	SCN5A	42	32
Fc1ccc(-n2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259457	EG	On-Demand	Anodyne	FIMH	17	40
Fc1ccc(-n2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259458	EG	On-Demand	Anodyne	SCN5A	42	32
Fc1ccc(-n2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872259458	EG	On-Demand	Anodyne	FIMH	17	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872259493	CG	On-Demand	Anodyne	HRH3	18	41
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872259494	CG	On-Demand	Anodyne	HRH3	18	41
O=C(c1coc(Br)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872259510	GD	On-Demand	Anodyne	L3MBTL3	42	33
FC(F)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259546	DJ	On-Demand	Anodyne	SLC6A3	15	48
FC(F)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259546	DJ	On-Demand	Anodyne	HRH3	24	47
FC(F)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259546	DJ	On-Demand	Anodyne	SIGMAR1	23	40
FC(F)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259547	DJ	On-Demand	Anodyne	SLC6A3	15	48
FC(F)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259547	DJ	On-Demand	Anodyne	HRH3	24	47
FC(F)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259547	DJ	On-Demand	Anodyne	SIGMAR1	23	40
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)c2cccnc2c1	ZINC000872259575	DI	On-Demand	Anodyne	HNMT	47	35
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)c2cccnc2c1	ZINC000872259575	DI	On-Demand	Anodyne	SCN5A	50	36
c1cc(CN2CCC[C@H](OC3CCC3)CC2)c2cccnc2c1	ZINC000872259576	DI	On-Demand	Anodyne	HNMT	47	35
c1cc(CN2CCC[C@H](OC3CCC3)CC2)c2cccnc2c1	ZINC000872259576	DI	On-Demand	Anodyne	SCN5A	50	36
Cn1c(=O)sc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc21	ZINC000872259595	EH	On-Demand	Anodyne	SIGMAR1	15	55
Cn1c(=O)sc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc21	ZINC000872259598	EH	On-Demand	Anodyne	SIGMAR1	15	55
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1O	ZINC000872259599	DH	On-Demand	Anodyne	SSTR5	95	55
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1O	ZINC000872259601	DH	On-Demand	Anodyne	SSTR5	95	55
CC(C)(C#N)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259611	EI	On-Demand	Mild	HRH3	19	43
CC(C)(C#N)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259612	EI	On-Demand	Mild	HRH3	19	43
CCC(=O)Nc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872259625	GD	On-Demand	Anodyne	L3MBTL3	44	38
Fc1cncc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259628	CG	On-Demand	Anodyne	SSTR5	35	41
Fc1cncc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259629	CG	On-Demand	Anodyne	SSTR5	35	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872259649	GD	On-Demand	Anodyne	CNR1	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872259649	GD	On-Demand	Anodyne	PKM	26	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872259649	GD	On-Demand	Anodyne	TGM2	64	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872259649	GD	On-Demand	Anodyne	F13A1	70	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000872259670	DD	On-Demand	Anodyne	NPSR1	16	48
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(N4CCCCC4)nc3)[C@H]21	ZINC000872259674	FE	On-Demand	Anodyne	DGAT1	34	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(N4CCCCC4)nc3)[C@H]21	ZINC000872259674	FE	On-Demand	Anodyne	SLC27A1	42	36
O=C1CCCc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2N1	ZINC000872259676	GD	On-Demand	Anodyne	L3MBTL3	70	36
c1ccc(N2CC[C@@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872259713	EH	On-Demand	Anodyne	SIGMAR1	19	42
c1ccc(N2CC[C@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872259714	EH	On-Demand	Anodyne	SIGMAR1	19	42
c1ccc(N2CC[C@@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872259715	EH	On-Demand	Anodyne	SIGMAR1	19	42
c1ccc(N2CC[C@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872259716	EH	On-Demand	Anodyne	SIGMAR1	19	42
N#CC1(c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)CC1	ZINC000872259717	DI	On-Demand	Mild	HRH3	17	40
N#CC1(c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)CC1	ZINC000872259718	DI	On-Demand	Mild	HRH3	17	40
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	CCR3	20	44
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	NR1H4	18	53
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	EPHX2	16	44
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	TAAR1	37	40
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	AKR1C3	17	46
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	KCNK3	67	44
COc1cccc(NC(=O)c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872259730	FG	On-Demand	Anodyne	KCNK9	61	44
O=C(NNc1ccnc2cc(Cl)ccc12)[C@]12CCC[C@H]1OCC2	ZINC000872259736	EG	On-Demand	Reactive	HRP1_PLAFA	116	39
O=C(c1c[nH]cc1-c1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872259739	GE	On-Demand	Anodyne	L3MBTL3	31	40
Cn1c(=O)oc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc21	ZINC000872259765	EG	On-Demand	Anodyne	SSTR5	52	36
Cn1c(=O)oc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc21	ZINC000872259766	EG	On-Demand	Anodyne	SSTR5	52	36
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259776	CH	On-Demand	Anodyne	DRD4	20	42
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259776	CH	On-Demand	Anodyne	ACHE	17	40
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259776	CH	On-Demand	Anodyne	SIGMAR1	44	55
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259776	CH	On-Demand	Anodyne	CCR3	23	45
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259776	CH	On-Demand	Anodyne	CACNA1G	23	42
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259778	CH	On-Demand	Anodyne	DRD4	20	42
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259778	CH	On-Demand	Anodyne	ACHE	17	40
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259778	CH	On-Demand	Anodyne	SIGMAR1	44	55
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259778	CH	On-Demand	Anodyne	CCR3	23	45
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259778	CH	On-Demand	Anodyne	CACNA1G	23	42
CCSCc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872259783	GE	On-Demand	Anodyne	L3MBTL3	65	37
C[C@@H](OCCCNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872259785	DG	On-Demand	Anodyne	AMY2	52	36
c1cncc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259802	CG	On-Demand	Anodyne	SIGMAR1	28	50
c1cncc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259803	CG	On-Demand	Anodyne	SIGMAR1	28	50
CCn1c(CN2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872259806	EH	On-Demand	Anodyne	HRH1	32	40
CCn1c(CN2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872259806	EH	On-Demand	Anodyne	GRM2	23	53
CCn1c(CN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872259808	EH	On-Demand	Anodyne	HRH1	32	40
CCn1c(CN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872259808	EH	On-Demand	Anodyne	GRM2	23	53
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3cccc(C#N)c3)[C@H]21	ZINC000872259817	EE	On-Demand	Mild	CCR3	17	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3cccc(C#N)c3)[C@H]21	ZINC000872259817	EE	On-Demand	Mild	MCHR1	44	41
CCNC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872259843	GG	On-Demand	Anodyne	ACHE	18	48
CCNC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872259843	GG	On-Demand	Anodyne	SIGMAR1	16	47
CCNC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872259843	GG	On-Demand	Anodyne	SSTR5	84	43
CCNC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872259843	GG	On-Demand	Anodyne	MCHR1	27	43
CCNC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872259845	GG	On-Demand	Anodyne	ACHE	18	48
CCNC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872259845	GG	On-Demand	Anodyne	SIGMAR1	16	47
CCNC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872259845	GG	On-Demand	Anodyne	SSTR5	84	43
CCNC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872259845	GG	On-Demand	Anodyne	MCHR1	27	43
c1cc2c(cc1CN1CCC[C@H](OC3CCC3)CC1)OCCO2	ZINC000872259854	DG	On-Demand	Anodyne	HRH3	18	42
c1cc2c(cc1CN1CCC[C@H](OC3CCC3)CC1)OCCO2	ZINC000872259854	DG	On-Demand	Anodyne	MCHR1	27	47
c1cc2c(cc1CN1CCC[C@@H](OC3CCC3)CC1)OCCO2	ZINC000872259855	DG	On-Demand	Anodyne	HRH3	18	42
c1cc2c(cc1CN1CCC[C@@H](OC3CCC3)CC1)OCCO2	ZINC000872259855	DG	On-Demand	Anodyne	MCHR1	27	47
c1ccn2c(CN3CCC[C@H](OC4CCC4)CC3)cnc2c1	ZINC000872259860	CG	On-Demand	Anodyne	SCN5A	56	35
c1ccn2c(CN3CCC[C@@H](OC4CCC4)CC3)cnc2c1	ZINC000872259861	CG	On-Demand	Anodyne	SCN5A	56	35
CN(CCC#N)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259875	EH	On-Demand	Mild	HRH3	16	40
CN(CCC#N)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259876	EH	On-Demand	Mild	HRH3	16	40
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	LTA4H	62	46
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	HRH3	56	50
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	SIGMAR1	23	42
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	ESRRG	43	33
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	PSMB2	27	40
CN(C)CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259886	EH	On-Demand	Anodyne	PSMB1	35	40
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	LTA4H	62	46
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	HRH3	56	50
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	SIGMAR1	23	42
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	ESRRG	43	33
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	PSMB2	27	40
CN(C)CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259887	EH	On-Demand	Anodyne	PSMB1	35	40
Cc1c(C(=O)N2CCCC(F)(F)CC2)ccn1Cc1ccccc1	ZINC000872259892	EI	On-Demand	Anodyne	SLC12A5	67	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	F2	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	PREP	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	DPP7	62	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	PROC	44	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	L3MBTL3	93	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872259901	FF	On-Demand	Anodyne	TMPRSS11D	66	37
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1F	ZINC000872259921	FD	On-Demand	Anodyne	L3MBTL3	63	35
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA2	40	43
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA1	39	43
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA7	38	40
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	HRH3	22	43
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	SIGMAR1	23	41
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	SSTR5	16	40
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA4	19	40
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA12	31	43
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CA9	36	43
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	CYNT	23	40
NS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872259939	EE	On-Demand	Anodyne	NCE103	19	40
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA2	40	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA1	39	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA7	38	40
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	HRH3	22	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	SIGMAR1	23	41
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	SSTR5	16	40
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA4	19	40
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA12	31	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CA9	36	43
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	CYNT	23	40
NS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872259940	EE	On-Demand	Anodyne	NCE103	19	40
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@@]13C[C@@H](N)C[C@@H]1C3)CC2	ZINC000872259945	GG	On-Demand	Anodyne	DRD1	15	48
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@@]13C[C@@H](N)C[C@@H]1C3)CC2	ZINC000872259945	GG	On-Demand	Anodyne	MTNR1B	15	47
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCC(NC(=O)c4ccccc4)CC3)[C@H]21	ZINC000872259955	GD	On-Demand	Anodyne	DRD4	15	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)N3CCC(NC(=O)c4ccccc4)CC3)[C@H]21	ZINC000872259955	GD	On-Demand	Anodyne	CCR8	69	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872259965	EF	On-Demand	Anodyne	NPY2R	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872259965	EF	On-Demand	Anodyne	EPHX2	29	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872259965	EF	On-Demand	Anodyne	L3MBTL3	45	35
c1cc(N2CCOCC2)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872259966	EG	On-Demand	Clean	HRH3	22	48
c1cc(N2CCOCC2)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872259966	EG	On-Demand	Clean	L3MBTL3	36	42
c1cc(N2CCOCC2)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259967	EG	On-Demand	Clean	HRH3	22	48
c1cc(N2CCOCC2)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872259967	EG	On-Demand	Clean	L3MBTL3	36	42
c1ccc(-c2ncc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872259969	EI	On-Demand	Anodyne	SIGMAR1	38	42
c1ccc(-c2ncc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872259969	EI	On-Demand	Anodyne	SCN5A	40	34
c1ccc(-c2ncc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872259971	EI	On-Demand	Anodyne	SIGMAR1	38	42
c1ccc(-c2ncc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872259971	EI	On-Demand	Anodyne	SCN5A	40	34
NS(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872259976	EE	On-Demand	Anodyne	SIGMAR1	27	41
NS(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872259978	EE	On-Demand	Anodyne	SIGMAR1	27	41
Fc1cccc(F)c1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260008	CH	On-Demand	Anodyne	SCN5A	37	40
Fc1cccc(F)c1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260009	CH	On-Demand	Anodyne	SCN5A	37	40
FC(F)Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260017	EI	On-Demand	Anodyne	HRH2	27	41
FC(F)Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260017	EI	On-Demand	Anodyne	SIGMAR1	32	41
FC(F)Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260017	EI	On-Demand	Anodyne	CCR3	26	41
FC(F)Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260019	EI	On-Demand	Anodyne	HRH2	27	41
FC(F)Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260019	EI	On-Demand	Anodyne	SIGMAR1	32	41
FC(F)Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260019	EI	On-Demand	Anodyne	CCR3	26	41
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c2ccccc12	ZINC000872260024	GE	On-Demand	Anodyne	L3MBTL3	27	43
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(Cl)c1OCC(N)=O	ZINC000872260063	GG	On-Demand	Anodyne	HTR4	50	39
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(Cl)c1OCC(N)=O	ZINC000872260063	GG	On-Demand	Anodyne	SSTR5	65	38
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(Cl)c1OCC(N)=O	ZINC000872260064	GG	On-Demand	Anodyne	HTR4	50	39
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(Cl)c1OCC(N)=O	ZINC000872260064	GG	On-Demand	Anodyne	SSTR5	65	38
NC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260069	EE	On-Demand	Anodyne	ACHE	15	47
NC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260069	EE	On-Demand	Anodyne	LTA4H	50	41
NC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260069	EE	On-Demand	Anodyne	HRH3	46	51
NC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260069	EE	On-Demand	Anodyne	SIGMAR1	35	42
NC(=O)COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260069	EE	On-Demand	Anodyne	CCR3	24	41
NC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260070	EE	On-Demand	Anodyne	ACHE	15	47
NC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260070	EE	On-Demand	Anodyne	LTA4H	50	41
NC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260070	EE	On-Demand	Anodyne	HRH3	46	51
NC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260070	EE	On-Demand	Anodyne	SIGMAR1	35	42
NC(=O)COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260070	EE	On-Demand	Anodyne	CCR3	24	41
C[C@@H](Cc1cccc(F)c1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260092	GD	On-Demand	Anodyne	ST14	51	35
O=C(N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@]12CCC[C@H]1CNC2	ZINC000872260096	ED	On-Demand	Bother	SSTR1	41	40
O=C(N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@]12CCC[C@H]1CNC2	ZINC000872260096	ED	On-Demand	Bother	SLC27A4	43	33
O=C(c1ccccc1OCC1CC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260098	GD	On-Demand	Anodyne	HCN1	48	33
O=C(c1ccccc1OCC1CC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260098	GD	On-Demand	Anodyne	HCN4	42	33
O=C(c1ccccc1OCC1CC1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260098	GD	On-Demand	Anodyne	L3MBTL3	41	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	FKBP1A	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	CTSK	28	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	PREP	24	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	AMY2	45	31
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	KDM1A	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	SLC12A5	46	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000872260100	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
Nc1c(F)cccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260103	CG	On-Demand	Anodyne	SCN5A	41	35
Nc1c(F)cccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260104	CG	On-Demand	Anodyne	SCN5A	41	35
CCOCc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260122	EI	On-Demand	Anodyne	SSTR5	62	41
CCOCc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260123	EI	On-Demand	Anodyne	SSTR5	62	41
N#Cc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260133	CG	On-Demand	Mild	HRH3	33	52
N#Cc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260133	CG	On-Demand	Mild	SIGMAR1	25	53
N#Cc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260134	CG	On-Demand	Mild	HRH3	33	52
N#Cc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260134	CG	On-Demand	Mild	SIGMAR1	25	53
Fc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260143	CH	On-Demand	Anodyne	SIGMAR1	18	42
Fc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260143	CH	On-Demand	Anodyne	SCN5A	49	43
Fc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260144	CH	On-Demand	Anodyne	SIGMAR1	18	42
Fc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260144	CH	On-Demand	Anodyne	SCN5A	49	43
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1SC	ZINC000872260157	EI	On-Demand	Anodyne	SSTR5	61	43
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1SC	ZINC000872260158	EI	On-Demand	Anodyne	SSTR5	61	43
Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260163	CG	On-Demand	Anodyne	DRD2	15	51
Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260163	CG	On-Demand	Anodyne	DRD4	23	40
Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260163	CG	On-Demand	Anodyne	SIGMAR1	40	43
Oc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260163	CG	On-Demand	Anodyne	SCN5A	43	37
Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260164	CG	On-Demand	Anodyne	DRD2	15	51
Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260164	CG	On-Demand	Anodyne	DRD4	23	40
Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260164	CG	On-Demand	Anodyne	SIGMAR1	40	43
Oc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260164	CG	On-Demand	Anodyne	SCN5A	43	37
O=[N+]([O-])c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260177	DH	On-Demand	Bother	HRH3	21	42
O=[N+]([O-])c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260177	DH	On-Demand	Bother	SIGMAR1	28	53
O=[N+]([O-])c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260177	DH	On-Demand	Bother	KCNJ1	30	53
O=[N+]([O-])c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260178	DH	On-Demand	Bother	HRH3	21	42
O=[N+]([O-])c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260178	DH	On-Demand	Bother	SIGMAR1	28	53
O=[N+]([O-])c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260178	DH	On-Demand	Bother	KCNJ1	30	53
Cc1ccnn1-c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872260183	GD	On-Demand	Anodyne	L3MBTL3	58	36
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872260202	CG	On-Demand	Anodyne	SCN5A	85	47
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872260203	CG	On-Demand	Anodyne	SCN5A	85	47
c1nc(CN2CCC[C@H](OC3CCC3)CC2)cs1	ZINC000872260206	CG	On-Demand	Anodyne	SCN5A	73	46
c1nc(CN2CCC[C@@H](OC3CCC3)CC2)cs1	ZINC000872260207	CG	On-Demand	Anodyne	SCN5A	73	46
COc1ncccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260225	CG	On-Demand	Anodyne	SCN5A	72	35
COc1ncccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260226	CG	On-Demand	Anodyne	SCN5A	72	35
Brc1ncccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260235	EH	On-Demand	Anodyne	SCN5A	50	36
Brc1ncccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260236	EH	On-Demand	Anodyne	SCN5A	50	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)C1	ZINC000872260242	GE	On-Demand	Anodyne	EPHX2	19	40
O=C(c1cnc(-c2ccccc2)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260245	GD	On-Demand	Anodyne	L3MBTL3	53	38
c1cc(O[C@H]2CCOC2)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260263	EH	On-Demand	Anodyne	HRH3	25	53
c1cc(O[C@H]2CCOC2)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260264	EH	On-Demand	Anodyne	HRH3	25	53
c1cc(O[C@@H]2CCOC2)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260265	EH	On-Demand	Anodyne	HRH3	25	53
c1cc(O[C@@H]2CCOC2)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260266	EH	On-Demand	Anodyne	HRH3	25	53
CCOc1cncc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260292	DG	On-Demand	Anodyne	SSTR5	65	41
CCOc1cncc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260293	DG	On-Demand	Anodyne	SSTR5	65	41
O=C(c1cccc2c1OCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260306	FC	On-Demand	Anodyne	CHRM2	17	42
O=C(c1cccc(N2CCCC2=O)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260318	GD	On-Demand	Anodyne	L3MBTL3	56	40
COc1ccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872260323	DE	On-Demand	Anodyne	SCNN1A	26	42
COc1ccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872260323	DE	On-Demand	Anodyne	CTSK	16	47
COc1ccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872260323	DE	On-Demand	Anodyne	MTNR1A	39	40
COc1ccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872260323	DE	On-Demand	Anodyne	MTNR1B	31	40
O=[N+]([O-])c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260329	DH	On-Demand	Bother	ACHE	21	49
O=[N+]([O-])c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260329	DH	On-Demand	Bother	HRH2	25	44
O=[N+]([O-])c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260329	DH	On-Demand	Bother	SIGMAR1	32	54
O=[N+]([O-])c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260330	DH	On-Demand	Bother	ACHE	21	49
O=[N+]([O-])c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260330	DH	On-Demand	Bother	HRH2	25	44
O=[N+]([O-])c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260330	DH	On-Demand	Bother	SIGMAR1	32	54
CC(=O)c1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)s1	ZINC000872260338	FD	On-Demand	Anodyne	L3MBTL3	22	44
O=C(c1ccnc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260341	FD	On-Demand	Anodyne	L3MBTL3	57	35
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1OC	ZINC000872260344	EH	On-Demand	Anodyne	ACHE	16	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1OC	ZINC000872260344	EH	On-Demand	Anodyne	SSTR5	62	40
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1OC	ZINC000872260345	EH	On-Demand	Anodyne	ACHE	16	42
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1OC	ZINC000872260345	EH	On-Demand	Anodyne	SSTR5	62	40
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	DRD4	19	40
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	ACHE	20	47
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	PDE4A	35	41
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	HRH3	17	40
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	SSTR5	99	53
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	PDE4B	24	41
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000872260359	EI	On-Demand	Anodyne	PDE4D	35	41
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	DRD4	19	40
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	ACHE	20	47
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	PDE4A	35	41
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	HRH3	17	40
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	SSTR5	99	53
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	PDE4B	24	41
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000872260360	EI	On-Demand	Anodyne	PDE4D	35	41
Cn1ccnc1COc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260365	FH	On-Demand	Anodyne	HRH3	28	45
Cn1ccnc1COc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260366	FH	On-Demand	Anodyne	HRH3	28	45
O=C(Cc1ccc(C(F)(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260374	GE	On-Demand	Anodyne	MLNR	16	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1	ZINC000872260377	DH	On-Demand	Anodyne	HRH3	15	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1	ZINC000872260377	DH	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1	ZINC000872260378	DH	On-Demand	Anodyne	HRH3	15	42
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1	ZINC000872260378	DH	On-Demand	Anodyne	SIGMAR1	15	41
c1cc2c(cc1CN1CCC[C@@H](OC3CCC3)CC1)CCO2	ZINC000872260381	DH	On-Demand	Anodyne	MCHR1	17	48
c1cc2c(cc1CN1CCC[C@H](OC3CCC3)CC1)CCO2	ZINC000872260382	DH	On-Demand	Anodyne	MCHR1	17	48
c1cn(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)cn1	ZINC000872260394	EH	On-Demand	Anodyne	HRH3	16	40
c1cn(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)cn1	ZINC000872260394	EH	On-Demand	Anodyne	CYP2C19	17	40
c1cn(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)cn1	ZINC000872260395	EH	On-Demand	Anodyne	HRH3	16	40
c1cn(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)cn1	ZINC000872260395	EH	On-Demand	Anodyne	CYP2C19	17	40
O=C(Cc1ccc2cccnc2c1)N1CCO[C@@H]2CCC[C@@H]21	ZINC000872260398	CF	On-Demand	Anodyne	OPRK1	20	44
O=C(CCc1cccc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260402	GE	On-Demand	Anodyne	C3AR1	22	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	HRH1	17	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	SLC6A3	26	54
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	HRH3	25	51
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	SIGMAR1	52	53
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	CXCR4	19	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	CCR3	37	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	MLNR	29	40
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260407	CH	On-Demand	Anodyne	MCHR1	17	42
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	HRH1	17	40
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	SLC6A3	26	54
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	HRH3	25	51
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	SIGMAR1	52	53
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	CXCR4	19	40
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	CCR3	37	40
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	MLNR	29	40
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260408	CH	On-Demand	Anodyne	MCHR1	17	42
COCCc1ccc(OC[C@@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872260425	FE	On-Demand	Anodyne	ADRB1	16	47
COCCc1ccc(OC[C@H](O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872260426	FE	On-Demand	Anodyne	ADRB1	16	47
CC[C@H](C)[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872260429	GF	On-Demand	Anodyne	BIRC8	44	32
CC[C@@H](C)[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872260430	GF	On-Demand	Anodyne	BIRC8	44	32
O=C(NNC(=O)[C@]12CCC[C@H]1OCC2)c1cc(Cl)ccc1O	ZINC000872260439	DD	On-Demand	Reactive	KCNMA1	22	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCCON3C(=O)c4ccccc4C3=O)[C@H]21	ZINC000872260443	FE	On-Demand	Anodyne	HRH3	20	40
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3nccs3)[C@H]21	ZINC000872260455	CD	On-Demand	Anodyne	MAP1	119	46
O=C(c1ccc(-c2ccccc2)[nH]1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260504	GE	On-Demand	Anodyne	L3MBTL3	40	35
FC(F)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872260511	DH	On-Demand	Anodyne	HRH3	17	40
FC(F)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872260512	DH	On-Demand	Anodyne	HRH3	17	40
Fc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872260535	CG	On-Demand	Anodyne	SSTR5	53	36
Fc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872260536	CG	On-Demand	Anodyne	SSTR5	53	36
O=C(CNC(=O)[C@]12CCC[C@H]1CNC2)OCc1ccccc1	ZINC000872260547	DD	On-Demand	Anodyne	SLC12A5	68	35
c1cnc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc2n1	ZINC000872260548	DH	On-Demand	Anodyne	SSTR5	65	37
c1cnc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2n1	ZINC000872260549	DH	On-Demand	Anodyne	SSTR5	65	37
O=C(c1ccc2c(c1)COC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260556	FD	On-Demand	Anodyne	L3MBTL3	74	37
CCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1OC	ZINC000872260560	GD	On-Demand	Anodyne	L3MBTL3	62	34
Cn1c(=O)c(CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc2ccccc21	ZINC000872260562	EF	On-Demand	Anodyne	NPSR1	33	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000872260576	EE	On-Demand	Anodyne	HCN1	54	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000872260576	EE	On-Demand	Anodyne	HCN4	52	35
CCOc1ccc(C(=O)N2CCC(NC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872260583	GF	On-Demand	Anodyne	EPHX2	41	54
CCOc1ccc(C(=O)N2CCC(NC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872260583	GF	On-Demand	Anodyne	PLAU	21	41
CCOc1ccc(C(=O)N2CCC(NC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872260583	GF	On-Demand	Anodyne	CCR8	19	40
CCOc1ccc(C(=O)N2CCC(NC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872260583	GF	On-Demand	Anodyne	L3MBTL3	70	38
O=C(Nc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1)C1CC1	ZINC000872260591	GD	On-Demand	Anodyne	L3MBTL3	87	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872260603	EE	On-Demand	Anodyne	DRD4	17	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872260603	EE	On-Demand	Anodyne	EPHX2	31	51
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872260603	EE	On-Demand	Anodyne	CCR8	42	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872260603	EE	On-Demand	Anodyne	SFRP1	75	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872260603	EE	On-Demand	Anodyne	WNT3	62	34
O=[N+]([O-])c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1Cl	ZINC000872260619	EI	On-Demand	Bother	CCR3	18	40
O=[N+]([O-])c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1Cl	ZINC000872260620	EI	On-Demand	Bother	CCR3	18	40
c1ccn2cc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872260622	CG	On-Demand	Anodyne	DRD4	15	40
c1ccn2cc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872260622	CG	On-Demand	Anodyne	SCN5A	52	33
c1ccn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872260623	CG	On-Demand	Anodyne	DRD4	15	40
c1ccn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872260623	CG	On-Demand	Anodyne	SCN5A	52	33
c1coc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)cs2)c1	ZINC000872260630	EI	On-Demand	Anodyne	SCN5A	57	37
c1coc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)cs2)c1	ZINC000872260631	EI	On-Demand	Anodyne	SCN5A	57	37
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H]3CCN(C(=O)c4ccccc4)C3)[C@H]21	ZINC000872260639	EF	On-Demand	Anodyne	L3MBTL3	50	34
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H]3CCN(C(=O)c4ccccc4)C3)[C@H]21	ZINC000872260640	EF	On-Demand	Anodyne	L3MBTL3	50	34
Cc1nc(CN2CCC[C@H](OC3CCC3)CC2)cs1	ZINC000872260641	CG	On-Demand	Anodyne	SCN5A	41	48
Cc1nc(CN2CCC[C@@H](OC3CCC3)CC2)cs1	ZINC000872260642	CG	On-Demand	Anodyne	SCN5A	41	48
O=C(c1cnn(-c2ccccc2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260645	GD	On-Demand	Anodyne	L3MBTL3	43	32
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260648	CH	On-Demand	Anodyne	HRH3	21	44
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260648	CH	On-Demand	Anodyne	SIGMAR1	26	48
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260648	CH	On-Demand	Anodyne	MCHR1	18	41
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260649	CH	On-Demand	Anodyne	HRH3	21	44
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260649	CH	On-Demand	Anodyne	SIGMAR1	26	48
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260649	CH	On-Demand	Anodyne	MCHR1	18	41
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	CHRM2	19	45
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	DRD2	28	48
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	DRD4	57	48
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	ACHE	54	56
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	HRH1	18	40
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	DRD3	20	43
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	SLC6A3	23	46
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	CHRM3	25	45
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	LTA4H	42	40
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	HRH3	34	50
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	SIGMAR1	111	59
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	BCHE	15	40
c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260671	CH	On-Demand	Anodyne	SCN5A	53	37
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	CHRM2	19	45
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	DRD2	28	48
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	DRD4	57	48
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	ACHE	54	56
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	HRH1	18	40
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	DRD3	20	43
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	SLC6A3	23	46
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	CHRM3	25	45
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	LTA4H	42	40
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	HRH3	34	50
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	SIGMAR1	111	59
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	BCHE	15	40
c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260672	CH	On-Demand	Anodyne	SCN5A	53	37
O=C(c1ccsc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260688	DD	On-Demand	Anodyne	L3MBTL3	61	35
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	DRD2	16	41
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	DRD4	30	53
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	ACHE	29	48
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	LTA4H	28	44
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	HRH3	21	42
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	SIGMAR1	33	56
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	SSTR5	63	49
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	CCR3	30	53
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	BDKRB1	21	40
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	UTS2R	26	46
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	SLC6A5	39	50
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	MCHR1	63	53
O=C(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260699	EH	On-Demand	Anodyne	NOD2	40	34
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	DRD2	16	41
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	DRD4	30	53
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	ACHE	29	48
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	LTA4H	28	44
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	HRH3	21	42
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	SIGMAR1	33	56
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	SSTR5	63	49
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	CCR3	30	53
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	BDKRB1	21	40
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	UTS2R	26	46
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	SLC6A5	39	50
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	MCHR1	63	53
O=C(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260700	EH	On-Demand	Anodyne	NOD2	40	34
c1ccc(-n2ncc(CN3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000872260707	EG	On-Demand	Anodyne	SCN5A	58	35
c1ccc(-n2ncc(CN3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000872260708	EG	On-Demand	Anodyne	SCN5A	58	35
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	ACHE	17	41
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	HRH2	54	48
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	LTA4H	23	42
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	HRH3	39	48
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	SIGMAR1	28	44
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	CHRNA10	61	39
COCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260712	EI	On-Demand	Anodyne	CCR8	22	40
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	ACHE	17	41
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	HRH2	54	48
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	LTA4H	23	42
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	HRH3	39	48
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	SIGMAR1	28	44
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	CHRNA10	61	39
COCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260713	EI	On-Demand	Anodyne	CCR8	22	40
O=C(c1ccc(OCC2CC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260719	GD	On-Demand	Anodyne	L3MBTL3	65	36
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872260727	CG	On-Demand	Anodyne	SCN5A	71	37
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872260728	CG	On-Demand	Anodyne	SCN5A	71	37
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260729	EH	On-Demand	Anodyne	SIGMAR1	24	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260729	EH	On-Demand	Anodyne	SSTR5	68	40
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260729	EH	On-Demand	Anodyne	CCR3	65	41
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872260729	EH	On-Demand	Anodyne	MCHR1	43	40
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260730	EH	On-Demand	Anodyne	SIGMAR1	24	43
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260730	EH	On-Demand	Anodyne	SSTR5	68	40
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260730	EH	On-Demand	Anodyne	CCR3	65	41
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872260730	EH	On-Demand	Anodyne	MCHR1	43	40
COc1cc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c(OC)cc1Cl	ZINC000872260783	DE	On-Demand	Anodyne	HTR4	47	39
O=C(c1cccc2c1CCC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260784	FD	On-Demand	Anodyne	L3MBTL3	64	37
O=C(c1cccc(-n2cccn2)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260792	GD	On-Demand	Anodyne	L3MBTL3	43	39
O=C(Cc1ccc(-n2cccn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260808	GD	On-Demand	Anodyne	KCNJ1	42	35
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	CHRM2	15	40
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	HTR1A	16	46
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	DRD2	21	43
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	DRD4	38	43
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	ACHE	40	45
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	HRH2	47	43
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	HTR1D	22	46
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	HTR1B	16	42
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	HRH1	15	42
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	CHRM3	29	45
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	LTA4H	15	40
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	SIGMAR1	41	44
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	SSTR5	59	41
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	CCR3	89	45
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	FAAH	24	43
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	CXCR3	21	41
CC(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260811	DH	On-Demand	Anodyne	MCHR1	62	48
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	CHRM2	15	40
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	HTR1A	16	46
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	DRD2	21	43
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	DRD4	38	43
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	ACHE	40	45
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	HRH2	47	43
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	HTR1D	22	46
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	HTR1B	16	42
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	HRH1	15	42
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	CHRM3	29	45
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	LTA4H	15	40
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	SIGMAR1	41	44
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	SSTR5	59	41
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	CCR3	89	45
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	FAAH	24	43
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	CXCR3	21	41
CC(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260812	DH	On-Demand	Anodyne	MCHR1	62	48
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)N3CCc4ccccc4C3)[C@H]21	ZINC000872260886	EE	On-Demand	Anodyne	DPP8	19	49
O=C(c1cc(Cl)ccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260889	FD	On-Demand	Anodyne	PARP1	54	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	F2	29	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	CCR5	23	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	PREP	56	49
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	LNPEP	32	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	EPHX2	31	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	DPP7	45	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872260892	FE	On-Demand	Anodyne	TMPRSS11D	63	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccc2c(c1)OCO2	ZINC000872260897	DD	On-Demand	Anodyne	NOS2	73	45
N#Cc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260901	CG	On-Demand	Mild	DRD4	15	48
N#Cc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260901	CG	On-Demand	Mild	HRH3	22	44
N#Cc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260901	CG	On-Demand	Mild	SIGMAR1	28	57
N#Cc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260901	CG	On-Demand	Mild	CCR3	18	46
N#Cc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872260901	CG	On-Demand	Mild	CHRNA10	15	43
N#Cc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260902	CG	On-Demand	Mild	DRD4	15	48
N#Cc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260902	CG	On-Demand	Mild	HRH3	22	44
N#Cc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260902	CG	On-Demand	Mild	SIGMAR1	28	57
N#Cc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260902	CG	On-Demand	Mild	CCR3	18	46
N#Cc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872260902	CG	On-Demand	Mild	CHRNA10	15	43
NC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260916	DF	On-Demand	Anodyne	LTA4H	25	42
NC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260916	DF	On-Demand	Anodyne	HRH3	26	45
NC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260916	DF	On-Demand	Anodyne	SIGMAR1	35	43
NC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260916	DF	On-Demand	Anodyne	CHEK2	30	40
NC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872260916	DF	On-Demand	Anodyne	CCR3	29	44
NC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260917	DF	On-Demand	Anodyne	LTA4H	25	42
NC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260917	DF	On-Demand	Anodyne	HRH3	26	45
NC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260917	DF	On-Demand	Anodyne	SIGMAR1	35	43
NC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260917	DF	On-Demand	Anodyne	CHEK2	30	40
NC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872260917	DF	On-Demand	Anodyne	CCR3	29	44
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc2c1OCO2	ZINC000872260923	EG	On-Demand	Anodyne	MCHR1	15	52
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc2c1OCO2	ZINC000872260924	EG	On-Demand	Anodyne	MCHR1	15	52
O=C1CCc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc2N1	ZINC000872260926	GC	On-Demand	Anodyne	L3MBTL3	61	35
Cc1nn(-c2ccccc2)cc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872260927	EI	On-Demand	Anodyne	SCN5A	44	33
Cc1nn(-c2ccccc2)cc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872260928	EI	On-Demand	Anodyne	SCN5A	44	33
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260933	EH	On-Demand	Anodyne	DRD4	30	40
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260933	EH	On-Demand	Anodyne	ACHE	38	43
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260933	EH	On-Demand	Anodyne	HRH3	18	41
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260933	EH	On-Demand	Anodyne	SIGMAR1	57	47
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260933	EH	On-Demand	Anodyne	SCN5A	41	46
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260934	EH	On-Demand	Anodyne	DRD4	30	40
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260934	EH	On-Demand	Anodyne	ACHE	38	43
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260934	EH	On-Demand	Anodyne	HRH3	18	41
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260934	EH	On-Demand	Anodyne	SIGMAR1	57	47
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872260934	EH	On-Demand	Anodyne	SCN5A	41	46
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3cccnc3)[C@H]21	ZINC000872260941	DD	On-Demand	Anodyne	CHRNA7	26	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)Nc3cccnc3)[C@H]21	ZINC000872260941	DD	On-Demand	Anodyne	NAMPT	36	40
c1ccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)cs2)nc1	ZINC000872260949	EI	On-Demand	Anodyne	SCN5A	73	39
c1ccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)cs2)nc1	ZINC000872260950	EI	On-Demand	Anodyne	SCN5A	73	39
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)[C@H]21	ZINC000872260952	FF	On-Demand	Anodyne	DRD4	25	44
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)[C@H]21	ZINC000872260952	FF	On-Demand	Anodyne	SIGMAR1	34	42
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H]3CN(Cc4ccccc4)CCCO3)[C@H]21	ZINC000872260953	FF	On-Demand	Anodyne	DRD4	25	44
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H]3CN(Cc4ccccc4)CCCO3)[C@H]21	ZINC000872260953	FF	On-Demand	Anodyne	SIGMAR1	34	42
c1cnc2c(CN3CCC[C@H](OC4CCC4)CC3)cccc2c1	ZINC000872260959	DI	On-Demand	Anodyne	SCN5A	40	34
c1cnc2c(CN3CCC[C@@H](OC4CCC4)CC3)cccc2c1	ZINC000872260960	DI	On-Demand	Anodyne	SCN5A	40	34
c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872260966	CG	On-Demand	Anodyne	HRH3	25	44
c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872260966	CG	On-Demand	Anodyne	SIGMAR1	26	48
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872260967	CG	On-Demand	Anodyne	HRH3	25	44
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872260967	CG	On-Demand	Anodyne	SIGMAR1	26	48
O=C1OC[C@]2(CNCCc3ccc(F)cc3Cl)COCCN12	ZINC000872260983	ED	On-Demand	Anodyne	P2RX7	32	40
O=C1OC[C@@]2(CNCCc3ccc(F)cc3Cl)COCCN12	ZINC000872260984	ED	On-Demand	Anodyne	P2RX7	32	40
O=C(c1ccc(Cl)o1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872260987	ED	On-Demand	Anodyne	L3MBTL3	23	43
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)cc(OC)c1OCC(N)=O	ZINC000872261045	GE	On-Demand	Anodyne	SSTR5	69	38
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)cc(OC)c1OCC(N)=O	ZINC000872261047	GE	On-Demand	Anodyne	SSTR5	69	38
Oc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261052	CG	On-Demand	Clean	SIGMAR1	27	43
Oc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261053	CG	On-Demand	Clean	SIGMAR1	27	43
O=C(c1ccoc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261066	DC	On-Demand	Anodyne	L3MBTL3	67	36
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	ACHE	28	44
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	HRH1	15	40
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	LTA4H	29	49
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	HRH3	32	43
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	SIGMAR1	35	45
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	SSTR5	41	41
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	CCR3	62	45
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	MCHR1	47	48
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	CACNA1G	24	40
CC(=O)Nc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261082	DH	On-Demand	Anodyne	NOD2	43	38
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	ACHE	28	44
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	HRH1	15	40
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	LTA4H	29	49
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	HRH3	32	43
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	SIGMAR1	35	45
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	SSTR5	41	41
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	CCR3	62	45
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	MCHR1	47	48
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	CACNA1G	24	40
CC(=O)Nc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261083	DH	On-Demand	Anodyne	NOD2	43	38
FC(F)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261086	EI	On-Demand	Anodyne	HRH3	25	51
FC(F)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261086	EI	On-Demand	Anodyne	SIGMAR1	25	42
FC(F)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261087	EI	On-Demand	Anodyne	HRH3	25	51
FC(F)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261087	EI	On-Demand	Anodyne	SIGMAR1	25	42
CSc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872261104	FD	On-Demand	Anodyne	L3MBTL3	76	39
c1ccc(-n2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872261105	EH	On-Demand	Anodyne	DRD4	24	60
c1ccc(-n2cc(CN3CCC[C@H](OC4CCC4)CC3)cn2)cc1	ZINC000872261105	EH	On-Demand	Anodyne	SIGMAR1	25	41
c1ccc(-n2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872261106	EH	On-Demand	Anodyne	DRD4	24	60
c1ccc(-n2cc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)cc1	ZINC000872261106	EH	On-Demand	Anodyne	SIGMAR1	25	41
O=C(c1ccc2c(c1)OCCCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261133	GD	On-Demand	Anodyne	L3MBTL3	79	39
Cc1cc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1F	ZINC000872261138	CF	On-Demand	Anodyne	LEF	43	37
c1cnn(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)c1	ZINC000872261142	EH	On-Demand	Anodyne	HRH3	19	40
c1cnn(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)c1	ZINC000872261142	EH	On-Demand	Anodyne	SCN5A	48	33
c1cnn(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)c1	ZINC000872261143	EH	On-Demand	Anodyne	HRH3	19	40
c1cnn(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)c1	ZINC000872261143	EH	On-Demand	Anodyne	SCN5A	48	33
O=C(c1ccc(-n2cccn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261203	GD	On-Demand	Anodyne	AMP1_PLAFQ	40	32
O=C(c1ccc(-n2cccn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261203	GD	On-Demand	Anodyne	L3MBTL3	69	37
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1F	ZINC000872261233	CH	On-Demand	Anodyne	SCN5A	50	44
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1F	ZINC000872261233	CH	On-Demand	Anodyne	CHRNA10	28	40
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1F	ZINC000872261234	CH	On-Demand	Anodyne	SCN5A	50	44
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1F	ZINC000872261234	CH	On-Demand	Anodyne	CHRNA10	28	40
c1cnc(Oc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)cn1	ZINC000872261246	FI	On-Demand	Anodyne	LTA4H	33	42
c1cnc(Oc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2)cn1	ZINC000872261246	FI	On-Demand	Anodyne	HRH3	23	42
c1cnc(Oc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)cn1	ZINC000872261247	FI	On-Demand	Anodyne	LTA4H	33	42
c1cnc(Oc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2)cn1	ZINC000872261247	FI	On-Demand	Anodyne	HRH3	23	42
c1cc(CN2CCC[C@H](OC3CCC3)CC2)n[nH]1	ZINC000872261259	BE	On-Demand	Anodyne	SCN5A	23	47
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)n[nH]1	ZINC000872261260	BE	On-Demand	Anodyne	SCN5A	23	47
O=C(c1cc(F)c(F)c(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261264	FD	On-Demand	Anodyne	L3MBTL3	52	33
CC(=O)c1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261268	FD	On-Demand	Anodyne	L3MBTL3	50	43
C[C@@H](Cc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261273	FD	On-Demand	Anodyne	BIRC8	46	35
O=C(c1ccc(N2CCNC2=O)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261278	GC	On-Demand	Anodyne	L3MBTL3	65	39
O=C(c1cc(-c2cccs2)on1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261314	GD	On-Demand	Anodyne	ETHR	40	37
Fc1ccc(CN2CCC[C@H](OC3CCC3)CC2)c2ncccc12	ZINC000872261331	EI	On-Demand	Anodyne	SCN5A	46	37
Fc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)c2ncccc12	ZINC000872261333	EI	On-Demand	Anodyne	SCN5A	46	37
CC(=O)Nc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261361	DH	On-Demand	Anodyne	CHRM3	15	40
CC(=O)Nc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261361	DH	On-Demand	Anodyne	KCNQ2	61	33
CC(=O)Nc1ccccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261361	DH	On-Demand	Anodyne	CCR3	36	48
CC(=O)Nc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261363	DH	On-Demand	Anodyne	CHRM3	15	40
CC(=O)Nc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261363	DH	On-Demand	Anodyne	KCNQ2	61	33
CC(=O)Nc1ccccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261363	DH	On-Demand	Anodyne	CCR3	36	48
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(C#N)cc3)[C@H]21	ZINC000872261392	CF	On-Demand	Mild	HRH3	35	48
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(C#N)cc3)[C@H]21	ZINC000872261392	CF	On-Demand	Mild	KCNJ1	15	46
O=C(COc1cccc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261400	GD	On-Demand	Anodyne	CPT1A	41	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCCC(=O)c3ccccc3)[C@H]21	ZINC000872261414	DG	On-Demand	Anodyne	SLC6A1	64	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCCC(=O)c3ccccc3)[C@H]21	ZINC000872261414	DG	On-Demand	Anodyne	PREP	24	43
CC1(C)[C@@H](O)[C@H]2CCCN(CCCC(=O)c3ccccc3)[C@H]21	ZINC000872261414	DG	On-Demand	Anodyne	CYP2J2	56	40
O=C(c1ccc(-n2cncn2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261473	GC	On-Demand	Anodyne	L3MBTL3	57	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)c3ccc(F)cc3)[C@H]21	ZINC000872261491	DF	On-Demand	Anodyne	HTR2A	17	41
O=C(Nc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1)C1CC1	ZINC000872261497	GD	On-Demand	Anodyne	L3MBTL3	65	41
c1ccc2[nH]c(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872261518	CG	On-Demand	Anodyne	DRD4	17	60
c1ccc2[nH]c(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872261520	CG	On-Demand	Anodyne	DRD4	17	60
O=C(Cc1csc2ccccc12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261539	GE	On-Demand	Anodyne	FFAR2	50	34
C[C@H](C#N)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261541	EH	On-Demand	Mild	HRH3	25	52
C[C@@H](C#N)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261543	EH	On-Demand	Mild	HRH3	25	52
C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261545	EH	On-Demand	Mild	HRH3	25	52
C[C@H](C#N)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261546	EH	On-Demand	Mild	HRH3	25	52
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)c3ccccc3)[C@H]21	ZINC000872261555	CF	On-Demand	Anodyne	SLC6A1	66	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)c3ccccc3)[C@H]21	ZINC000872261555	CF	On-Demand	Anodyne	CYP2J2	49	35
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	ACHE	21	49
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	LTA4H	65	44
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	HRH3	66	55
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	SIGMAR1	38	44
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	PSMB2	32	42
COCCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261574	EH	On-Demand	Anodyne	PSMB1	36	42
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	ACHE	21	49
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	LTA4H	65	44
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	HRH3	66	55
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	SIGMAR1	38	44
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	PSMB2	32	42
COCCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261576	EH	On-Demand	Anodyne	PSMB1	36	42
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccccc3[N+](=O)[O-])[C@H]21	ZINC000872261592	FD	On-Demand	Bother	ABCB1	40	35
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccccc3[N+](=O)[O-])[C@H]21	ZINC000872261594	FD	On-Demand	Bother	ABCB1	40	35
c1cc(N2CCCC2)ncc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261597	EH	On-Demand	Anodyne	HRH3	21	42
c1cc(N2CCCC2)ncc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261598	EH	On-Demand	Anodyne	HRH3	21	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	CTRA_BOVIN	66	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	TRY1_BOVIN	51	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	CTSG	46	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	PREP	56	38
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	CELA2A	53	37
CC1(C)[C@@H](O)[C@H]2CCCN(CCC(=O)OCc3ccccc3)[C@H]21	ZINC000872261605	DF	On-Demand	Anodyne	SLC12A5	77	40
O=C(c1ccc2c(c1)CCC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261619	FD	On-Demand	Anodyne	L3MBTL3	87	40
O=C(CCc1cccs1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261646	ED	On-Demand	Anodyne	ETHR	50	37
Cc1oc(-c2ccccc2)nc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261647	GE	On-Demand	Anodyne	PDE8B	58	34
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc(S(=O)(=O)NC4CC4)cc3)[C@H]21	ZINC000872261659	FE	On-Demand	Anodyne	SFRP1	45	32
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872261711	GD	On-Demand	Anodyne	TGM2	59	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872261711	GD	On-Demand	Anodyne	F13A1	64	44
O=C(c1ccc(F)c(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261784	FD	On-Demand	Anodyne	L3MBTL3	77	39
O=C(c1cc(F)ccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261805	FD	On-Demand	Anodyne	PARP1	53	40
O=C(c1ccc(C2CCCCC2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261818	GG	On-Demand	Anodyne	L3MBTL3	88	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872261837	EE	On-Demand	Anodyne	EPHX2	43	69
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872261837	EE	On-Demand	Anodyne	SFRP1	38	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872261837	EE	On-Demand	Anodyne	L3MBTL3	86	42
c1cnc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872261840	DI	On-Demand	Anodyne	SSTR5	62	40
c1cnc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872261840	DI	On-Demand	Anodyne	CCR3	20	45
c1cnc2ccc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872261840	DI	On-Demand	Anodyne	MCHR1	15	47
c1cnc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872261841	DI	On-Demand	Anodyne	SSTR5	62	40
c1cnc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872261841	DI	On-Demand	Anodyne	CCR3	20	45
c1cnc2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872261841	DI	On-Demand	Anodyne	MCHR1	15	47
N#CCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261859	EI	On-Demand	Mild	HRH2	43	46
N#CCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261859	EI	On-Demand	Mild	HRH3	28	46
N#CCCCOc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261859	EI	On-Demand	Mild	SIGMAR1	16	41
N#CCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261860	EI	On-Demand	Mild	HRH2	43	46
N#CCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261860	EI	On-Demand	Mild	HRH3	28	46
N#CCCCOc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261860	EI	On-Demand	Mild	SIGMAR1	16	41
c1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)nccc2c1	ZINC000872261881	DI	On-Demand	Anodyne	SCN5A	41	38
c1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)nccc2c1	ZINC000872261882	DI	On-Demand	Anodyne	SCN5A	41	38
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	DRD2	19	56
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	DRD4	35	44
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	ACHE	35	41
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	HRH1	17	43
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	CHRM3	15	43
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	LTA4H	27	45
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	HRH3	31	44
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	SIGMAR1	40	56
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	SSTR5	65	40
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	CCR3	39	43
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	CXCR3	26	40
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	MCHR1	39	41
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	CACNA1I	29	41
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	NPFFR1	18	44
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261897	DG	On-Demand	Anodyne	NOD2	40	35
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	DRD2	19	56
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	DRD4	35	44
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	ACHE	35	41
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	HRH1	17	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	CHRM3	15	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	LTA4H	27	45
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	HRH3	31	44
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	SIGMAR1	40	56
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	SSTR5	65	40
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	CCR3	39	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	CXCR3	26	40
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	MCHR1	39	41
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	CACNA1I	29	41
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	NPFFR1	18	44
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261898	DG	On-Demand	Anodyne	NOD2	40	35
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA2	56	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA6	17	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA1	53	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA7	30	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	HRH3	25	60
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA4	39	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA12	36	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA9	48	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	NCE103	19	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	CA15	18	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(S(N)(=O)=O)cc3)[C@H]21	ZINC000872261903	ED	On-Demand	Anodyne	A6YCJ1_9METZ	24	40
O=C(CCCCC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872261916	GE	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261939	FD	On-Demand	Anodyne	PREP	48	41
O=C(CCCc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872261939	FD	On-Demand	Anodyne	FAAH	19	40
c1ccc(-n2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872261944	EG	On-Demand	Anodyne	SCN5A	59	35
c1ccc(-n2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872261945	EG	On-Demand	Anodyne	SCN5A	59	35
O=C(Cc1ccc(OCc2ccncc2)cc1)N1CCCC(F)(F)CC1	ZINC000872261960	FH	On-Demand	Anodyne	ADAM17	22	44
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261984	FH	On-Demand	Anodyne	DRD4	16	40
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261984	FH	On-Demand	Anodyne	LTA4H	29	41
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261984	FH	On-Demand	Anodyne	HRH3	26	49
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261984	FH	On-Demand	Anodyne	SIGMAR1	32	43
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872261984	FH	On-Demand	Anodyne	MCHR1	31	42
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261987	FH	On-Demand	Anodyne	DRD4	16	40
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261987	FH	On-Demand	Anodyne	LTA4H	29	41
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261987	FH	On-Demand	Anodyne	HRH3	26	49
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261987	FH	On-Demand	Anodyne	SIGMAR1	32	43
COC(=O)[C@@H](C)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872261987	FH	On-Demand	Anodyne	MCHR1	31	42
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	DRD2	16	48
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	ACHE	33	41
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	KCNH2	44	43
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	F10	20	42
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	FABP4	18	44
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	HRH3	17	44
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	SIGMAR1	36	40
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	SSTR5	41	37
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	CHEK2	33	41
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	CCR3	40	48
NC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872261989	DF	On-Demand	Anodyne	FAAH	18	40
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	DRD2	16	48
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	ACHE	33	41
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	KCNH2	44	43
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	F10	20	42
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	FABP4	18	44
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	HRH3	17	44
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	SIGMAR1	36	40
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	SSTR5	41	37
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	CHEK2	33	41
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	CCR3	40	48
NC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872261990	DF	On-Demand	Anodyne	FAAH	18	40
Oc1c(F)cccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872261996	CG	On-Demand	Clean	SCN5A	47	37
Oc1c(F)cccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872261997	CG	On-Demand	Clean	SCN5A	47	37
Brc1ccc(CN2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872262007	EH	On-Demand	Anodyne	SCN5A	70	39
Brc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872262008	EH	On-Demand	Anodyne	SCN5A	70	39
Fc1cc(F)cc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262022	CH	On-Demand	Anodyne	SIGMAR1	16	40
Fc1cc(F)cc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262023	CH	On-Demand	Anodyne	SIGMAR1	16	40
Cn1nnc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc21	ZINC000872262088	DF	On-Demand	Anodyne	SSTR5	50	38
Cn1nnc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc21	ZINC000872262089	DF	On-Demand	Anodyne	SSTR5	50	38
O=C(c1c(F)cc(F)cc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262090	FD	On-Demand	Anodyne	L3MBTL3	41	36
CCCc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872262098	FE	On-Demand	Anodyne	L3MBTL3	75	39
c1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)ccnc2c1	ZINC000872262099	DI	On-Demand	Anodyne	HNMT	55	40
c1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)ccnc2c1	ZINC000872262099	DI	On-Demand	Anodyne	SCN5A	44	34
c1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)ccnc2c1	ZINC000872262100	DI	On-Demand	Anodyne	HNMT	55	40
c1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)ccnc2c1	ZINC000872262100	DI	On-Demand	Anodyne	SCN5A	44	34
O=C(Cc1ccccc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262121	GE	On-Demand	Anodyne	SFRP1	47	34
O=C(c1ccc2c(c1)CCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262150	FD	On-Demand	Anodyne	L3MBTL3	63	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872262160	GE	On-Demand	Anodyne	EPHX2	30	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872262160	GE	On-Demand	Anodyne	TGM2	68	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872262160	GE	On-Demand	Anodyne	F13A1	68	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872262160	GE	On-Demand	Anodyne	NAMPT	86	52
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872262160	GE	On-Demand	Anodyne	TMPRSS11D	58	35
O=C(c1c(F)c(F)cc(F)c1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262173	GD	On-Demand	Anodyne	L3MBTL3	16	40
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c(C)c1	ZINC000872262179	FD	On-Demand	Anodyne	OXTR	22	43
CC1(C)[C@@H](O)[C@H]2CCCN(CCOC(=O)Cc3ccccc3)[C@H]21	ZINC000872262198	DE	On-Demand	Anodyne	CTRA_BOVIN	51	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOC(=O)Cc3ccccc3)[C@H]21	ZINC000872262198	DE	On-Demand	Anodyne	CTSG	41	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOC(=O)Cc3ccccc3)[C@H]21	ZINC000872262198	DE	On-Demand	Anodyne	CELA2A	42	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOC(=O)Cc3ccccc3)[C@H]21	ZINC000872262198	DE	On-Demand	Anodyne	SLC12A5	63	36
c1cc2c[nH]nc2cc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872262209	CG	On-Demand	Anodyne	SSTR5	49	37
c1cc2c[nH]nc2cc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872262210	CG	On-Demand	Anodyne	SSTR5	49	37
c1cc(CN2CCC[C@H](OC3CCC3)CC2)n2ccnc2c1	ZINC000872262211	CG	On-Demand	Anodyne	SCN5A	50	30
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)n2ccnc2c1	ZINC000872262212	CG	On-Demand	Anodyne	SCN5A	50	30
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NOCc3ccccc3)[C@H]21	ZINC000872262225	DD	On-Demand	Anodyne	CTRA_BOVIN	61	35
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NOCc3ccccc3)[C@H]21	ZINC000872262225	DD	On-Demand	Anodyne	CTSG	43	35
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NOCc3ccccc3)[C@H]21	ZINC000872262225	DD	On-Demand	Anodyne	CELA2A	51	35
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)NOCc3ccccc3)[C@H]21	ZINC000872262225	DD	On-Demand	Anodyne	SLC12A5	72	40
c1ccc2ncc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872262231	DI	On-Demand	Anodyne	SIGMAR1	17	44
c1ccc2ncc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872262231	DI	On-Demand	Anodyne	SSTR5	52	39
c1ccc2ncc(CN3CCC[C@H](OC4CCC4)CC3)cc2c1	ZINC000872262231	DI	On-Demand	Anodyne	MCHR1	17	45
c1ccc2ncc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872262232	DI	On-Demand	Anodyne	SIGMAR1	17	44
c1ccc2ncc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872262232	DI	On-Demand	Anodyne	SSTR5	52	39
c1ccc2ncc(CN3CCC[C@@H](OC4CCC4)CC3)cc2c1	ZINC000872262232	DI	On-Demand	Anodyne	MCHR1	17	45
Fc1cccn2cc(CN3CCC[C@H](OC4CCC4)CC3)nc12	ZINC000872262237	DG	On-Demand	Anodyne	SCN5A	79	38
Fc1cccn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nc12	ZINC000872262238	DG	On-Demand	Anodyne	SCN5A	79	38
O=C(c1ccc2n[nH]cc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262247	FC	On-Demand	Anodyne	L3MBTL3	70	38
COc1ccc(O)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262262	DG	On-Demand	Clean	SIGMAR1	19	40
COc1ccc(O)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262262	DG	On-Demand	Clean	EBP	40	36
COc1ccc(O)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262263	DG	On-Demand	Clean	SIGMAR1	19	40
COc1ccc(O)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262263	DG	On-Demand	Clean	EBP	40	36
c1ccc(Cn2ccnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872262264	EH	On-Demand	Anodyne	HRH3	17	40
c1ccc(Cn2ccnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872262264	EH	On-Demand	Anodyne	SIGMAR1	39	43
c1ccc(Cn2ccnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872262264	EH	On-Demand	Anodyne	SCN5A	76	42
c1ccc(Cn2ccnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872262265	EH	On-Demand	Anodyne	HRH3	17	40
c1ccc(Cn2ccnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872262265	EH	On-Demand	Anodyne	SIGMAR1	39	43
c1ccc(Cn2ccnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872262265	EH	On-Demand	Anodyne	SCN5A	76	42
c1ccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)co2)cc1	ZINC000872262277	EI	On-Demand	Anodyne	SCN5A	58	34
c1ccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)co2)cc1	ZINC000872262278	EI	On-Demand	Anodyne	SCN5A	58	34
CC1(C)[C@@H](O)[C@H]2CCCN(Cc3ccc4ncccc4c3)[C@H]21	ZINC000872262284	CG	On-Demand	Anodyne	HRH3	29	41
O=C(c1ccc(SC(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262308	GE	On-Demand	Anodyne	L3MBTL3	62	37
c1cc(CN2CCC[C@H](OC3CCC3)CC2)co1	ZINC000872262314	BG	On-Demand	Anodyne	HRH3	15	40
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)co1	ZINC000872262315	BG	On-Demand	Anodyne	HRH3	15	40
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262317	FH	On-Demand	Anodyne	ACHE	23	58
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262317	FH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262317	FH	On-Demand	Anodyne	SSTR5	71	42
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262317	FH	On-Demand	Anodyne	MCHR1	19	42
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262318	FH	On-Demand	Anodyne	ACHE	23	58
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262318	FH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262318	FH	On-Demand	Anodyne	SSTR5	71	42
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1OC(=O)C1CC1	ZINC000872262318	FH	On-Demand	Anodyne	MCHR1	19	42
Cn1cnc2cc(CN3CCC[C@H](OC4CCC4)CC3)ccc21	ZINC000872262322	DG	On-Demand	Anodyne	SSTR5	63	36
Cn1cnc2cc(CN3CCC[C@@H](OC4CCC4)CC3)ccc21	ZINC000872262323	DG	On-Demand	Anodyne	SSTR5	63	36
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	UGCG	61	40
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	CTRA_BOVIN	52	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	CTSG	41	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	GBA	33	46
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	CELA2A	42	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCCOCc3ccccc3)[C@H]21	ZINC000872262327	DG	On-Demand	Anodyne	GBA2	86	46
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)o1	ZINC000872262349	DF	On-Demand	Anodyne	HRH3	15	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)o1	ZINC000872262349	DF	On-Demand	Anodyne	SSTR5	41	35
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)o1	ZINC000872262350	DF	On-Demand	Anodyne	HRH3	15	43
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)o1	ZINC000872262350	DF	On-Demand	Anodyne	SSTR5	41	35
Cn1nc(CN2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000872262352	DG	On-Demand	Anodyne	HTR4	25	40
Cn1nc(CN2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000872262353	DG	On-Demand	Anodyne	HTR4	25	40
CS(=O)(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262354	FF	On-Demand	Anodyne	ACHE	24	44
CS(=O)(=O)Nc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262354	FF	On-Demand	Anodyne	SSTR5	44	35
CS(=O)(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262355	FF	On-Demand	Anodyne	ACHE	24	44
CS(=O)(=O)Nc1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262355	FF	On-Demand	Anodyne	SSTR5	44	35
c1ccc(-n2cncn2)c(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872262356	EG	On-Demand	Anodyne	SCN5A	46	32
c1ccc(-n2cncn2)c(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872262357	EG	On-Demand	Anodyne	SCN5A	46	32
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)CCc3ccccc3)[C@H]21	ZINC000872262359	DE	On-Demand	Anodyne	SLC18A2	45	37
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)CCc3ccccc3)[C@H]21	ZINC000872262360	DE	On-Demand	Anodyne	SLC18A2	45	37
c1ccc(-n2ccc(CN3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000872262362	EH	On-Demand	Anodyne	SCN5A	82	37
c1ccc(-n2ccc(CN3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000872262363	EH	On-Demand	Anodyne	SCN5A	82	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	EPHX2	37	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	CA12	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	CA9	19	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	NCE103	22	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	MTCA1	34	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1	ZINC000872262368	FG	On-Demand	Anodyne	P96878_MYCTU	42	42
Cc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872262378	ED	On-Demand	Anodyne	L3MBTL3	72	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccc(O)cc2)CC1	ZINC000872262401	EF	On-Demand	Anodyne	L3MBTL3	69	40
CCOc1ccccc1OCC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262417	GD	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1OCC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262417	GD	On-Demand	Anodyne	HCN4	42	33
CC1(C)[C@@H](O)[C@H]2CCCN(CCc3ccc(C(N)=O)cc3)[C@H]21	ZINC000872262418	DD	On-Demand	Anodyne	HRH3	30	41
O=C(c1cc(Cl)nc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262421	GD	On-Demand	Anodyne	L3MBTL3	48	34
O=C(c1ccc2c(c1)OCCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262445	FC	On-Demand	Anodyne	L3MBTL3	71	37
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	DRD4	60	45
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	NQO2	26	40
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	CTSK	21	49
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	CTSL	21	43
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	MTNR1A	52	40
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	MTNR1B	48	45
COc1cccc(C(=O)NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262478	ED	On-Demand	Anodyne	CTSS	20	44
CC(=O)c1ccc(OC[C@H](O)CN(C)[C@H]2CCCCN(C)C2=O)cc1	ZINC000872262483	ED	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1ccc(OC[C@@H](O)CN(C)[C@@H]2CCCCN(C)C2=O)cc1	ZINC000872262484	ED	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1ccc(OC[C@H](O)CN(C)[C@@H]2CCCCN(C)C2=O)cc1	ZINC000872262485	ED	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1ccc(OC[C@@H](O)CN(C)[C@H]2CCCCN(C)C2=O)cc1	ZINC000872262486	ED	On-Demand	Anodyne	ABCB1	16	42
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	UGCG	42	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	CTRA_BOVIN	54	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	CTSG	41	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	GBA	23	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	CELA2A	42	34
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	GBA2	61	41
CC1(C)[C@@H](O)[C@H]2CCCN(CCOCc3ccccc3)[C@H]21	ZINC000872262487	CF	On-Demand	Anodyne	SLC12A5	48	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000872262501	FG	On-Demand	Anodyne	EPHX2	40	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000872262501	FG	On-Demand	Anodyne	KCNK3	50	34
O=C(c1ccc(F)cc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262509	FD	On-Demand	Anodyne	P2RX7	22	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000872262528	EE	On-Demand	Anodyne	MC5R	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(Cl)nc1	ZINC000872262533	CE	On-Demand	Anodyne	NACHRBETA2	39	40
O=C(/C=C\c1ccc2c(c1)OCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262536	GD	On-Demand	Anodyne	ITGAL	18	40
O=C(/C=C/c1ccc2c(c1)OCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262537	GD	On-Demand	Anodyne	ITGAL	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000872262561	EG	On-Demand	Anodyne	SLC18A3	47	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000872262561	EG	On-Demand	Anodyne	PREP	52	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000872262561	EG	On-Demand	Anodyne	L3MBTL3	70	38
CC(C)(C)OC(=O)N1C[C@@H]2OC(=O)N([C@H]3CCN(Cc4ccccn4)C3)[C@@H]2C1	ZINC000872262569	GE	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1C[C@@H]2OC(=O)N([C@@H]3CCN(Cc4ccccn4)C3)[C@@H]2C1	ZINC000872262570	GE	On-Demand	Anodyne	GPR119	22	41
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(Cl)c(F)c3)[C@H]21	ZINC000872262577	EF	On-Demand	Anodyne	ENV	49	43
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)Nc3ccc(Cl)c(F)c3)[C@H]21	ZINC000872262577	EF	On-Demand	Anodyne	IMDH_CRYPV	16	41
O=C(c1ccc(OC(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262581	GD	On-Demand	Anodyne	L3MBTL3	64	37
Cc1cc(C)nc(Sc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)n1	ZINC000872262603	FG	On-Demand	Anodyne	AURKA	34	42
Cc1cc(C)nc(Sc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)n1	ZINC000872262603	FG	On-Demand	Anodyne	AURKC	57	38
O=C(c1ccc2c(c1)CCCC2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262622	FD	On-Demand	Anodyne	L3MBTL3	88	40
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1OC	ZINC000872262623	GD	On-Demand	Anodyne	L3MBTL3	71	37
O=C(c1ccc(N2CCCC2=O)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262624	GD	On-Demand	Anodyne	L3MBTL3	74	39
O=C(c1cccc2ccccc12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262631	FE	On-Demand	Anodyne	CHRM2	20	42
O=C(c1cccc2ccccc12)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262631	FE	On-Demand	Anodyne	L3MBTL3	42	42
CC1(C)[C@@H](O)[C@H]2CCCN(CC(=O)c3c[nH]c4ccc(F)cc34)[C@H]21	ZINC000872262652	EF	On-Demand	Anodyne	MPO	74	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000872262675	ED	On-Demand	Anodyne	EPHX2	22	49
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000872262675	ED	On-Demand	Anodyne	L3MBTL3	62	37
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000872262709	EE	On-Demand	Anodyne	NPY2R	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000872262709	EE	On-Demand	Anodyne	EPHX2	28	55
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000872262709	EE	On-Demand	Anodyne	L3MBTL3	53	40
O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)[C@@H]1CNC[C@H]1c1ccc(Cl)cc1	ZINC000872262719	ED	On-Demand	Anodyne	SLC6A3	17	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)C1	ZINC000872262759	FD	On-Demand	Anodyne	EPHX2	17	47
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1OC	ZINC000872262784	GD	On-Demand	Anodyne	L3MBTL3	71	37
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1OC	ZINC000872262784	GD	On-Demand	Anodyne	HPGD	42	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	F2	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	PREP	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	DPP7	62	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	PROC	44	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	L3MBTL3	93	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872262804	EE	On-Demand	Anodyne	TMPRSS11D	66	37
O=C(c1ccc(OC(F)(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262808	GD	On-Demand	Anodyne	EPHX2	33	42
O=C(c1ccc(OC(F)(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262808	GD	On-Demand	Anodyne	L3MBTL3	64	37
COc1ccc(N2CCN(C(=O)CN(C)[C@H]3CCCCN(C)C3=O)CC2)cc1	ZINC000872262824	GD	On-Demand	Clean	SSTR1	50	36
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262826	ED	On-Demand	Anodyne	MTNR1A	27	43
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262826	ED	On-Demand	Anodyne	MTNR1B	25	41
COc1ccc(N2CCN(C(=O)CN(C)[C@@H]3CCCCN(C)C3=O)CC2)cc1	ZINC000872262827	GD	On-Demand	Clean	SSTR1	50	36
CN1CCCC[C@@H](N(C)Cc2ccc(Cl)nc2)C1=O	ZINC000872262841	CE	On-Demand	Anodyne	Q8WSF8_APLCA	40	37
CN1CCCC[C@@H](N(C)Cc2ccc(Cl)nc2)C1=O	ZINC000872262841	CE	On-Demand	Anodyne	NACHRBETA2	47	37
CN1CCCC[C@H](N(C)Cc2ccc(Cl)nc2)C1=O	ZINC000872262842	CE	On-Demand	Anodyne	Q8WSF8_APLCA	40	37
CN1CCCC[C@H](N(C)Cc2ccc(Cl)nc2)C1=O	ZINC000872262842	CE	On-Demand	Anodyne	NACHRBETA2	47	37
O=C(CCCc1cccs1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262884	FD	On-Demand	Anodyne	ETHR	49	36
CC[C@H](C)NC(=O)c1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262886	EF	On-Demand	Anodyne	F2	20	43
CC[C@H](C)NC(=O)c1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872262886	EF	On-Demand	Anodyne	TMPRSS11D	46	33
CCOC(=O)C1=C(CN(C)[C@H]2CCCCN(C)C2=O)NC(=O)N[C@H]1C	ZINC000872262898	FC	On-Demand	Anodyne	SLC27A4	52	30
CCOC(=O)C1=C(CN(C)[C@@H]2CCCCN(C)C2=O)NC(=O)N[C@@H]1C	ZINC000872262901	FC	On-Demand	Anodyne	SLC27A4	52	30
CCOC(=O)C1=C(CN(C)[C@@H]2CCCCN(C)C2=O)NC(=O)N[C@H]1C	ZINC000872262902	FC	On-Demand	Anodyne	SLC27A4	52	30
CCOC(=O)C1=C(CN(C)[C@H]2CCCCN(C)C2=O)NC(=O)N[C@@H]1C	ZINC000872262903	FC	On-Demand	Anodyne	SLC27A4	52	30
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000872262911	FF	On-Demand	Anodyne	EPHX2	61	49
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000872262911	FF	On-Demand	Anodyne	CCR8	24	40
O=C(c1cc(=O)c2ccccc2o1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262921	GD	On-Demand	Anodyne	TNKS	22	40
C[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000872262927	DE	On-Demand	Anodyne	PTGER4	15	41
C[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000872262927	DE	On-Demand	Anodyne	XIAP	46	34
C[C@@H](NC(=O)CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000872262927	DE	On-Demand	Anodyne	BIRC8	45	31
O=C(NC[C@@H](O)c1cccc(Cl)c1)[C@]12CCC[C@H]1CNC2	ZINC000872262936	DD	On-Demand	Anodyne	ADRB1	26	40
O=C(NC[C@@H](O)c1cccc(Cl)c1)[C@]12CCC[C@H]1CNC2	ZINC000872262936	DD	On-Demand	Anodyne	ADRB3	41	41
O=C(c1ccc(Cl)s1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262937	FD	On-Demand	Anodyne	L3MBTL3	19	42
O=C(NC[C@H](O)c1cccc(Cl)c1)[C@]12CCC[C@H]1CNC2	ZINC000872262938	DD	On-Demand	Anodyne	ADRB1	26	40
O=C(NC[C@H](O)c1cccc(Cl)c1)[C@]12CCC[C@H]1CNC2	ZINC000872262938	DD	On-Demand	Anodyne	ADRB3	41	41
CC(=O)Nc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872262947	FD	On-Demand	Anodyne	L3MBTL3	64	40
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262958	GC	On-Demand	Anodyne	CCR1	27	43
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262958	GC	On-Demand	Anodyne	BIRC8	56	33
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262967	GC	On-Demand	Anodyne	CCR1	27	43
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262967	GC	On-Demand	Anodyne	BIRC8	56	33
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000872262968	EF	On-Demand	Anodyne	EPHX2	52	50
CCOc1ccccc1[C@@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262976	DG	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262976	DG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1[C@@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262976	DG	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1[C@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262977	DG	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262977	DG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1[C@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872262977	DG	On-Demand	Anodyne	HCN4	45	36
O=C(c1ccc(CNC(=O)[C@]23CCC[C@H]2CNC3)cc1)N1CCCC1	ZINC000872262982	ED	On-Demand	Anodyne	L3MBTL3	69	40
O=C(c1cc(F)cc(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872262984	FD	On-Demand	Anodyne	L3MBTL3	58	33
CC[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872263006	FD	On-Demand	Anodyne	BIRC8	44	32
CC[C@@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872263007	FD	On-Demand	Anodyne	BIRC8	44	32
CN1CCCC[C@H](N(C)Cc2cc(Cl)ccc2OCC#N)C1=O	ZINC000872263013	EF	On-Demand	Mild	NOS3	19	43
CN1CCCC[C@@H](N(C)Cc2cc(Cl)ccc2OCC#N)C1=O	ZINC000872263014	EF	On-Demand	Mild	NOS3	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000872263033	EF	On-Demand	Anodyne	AMY2	42	29
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000872263034	EF	On-Demand	Anodyne	AMY2	42	29
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000872263042	DD	On-Demand	Anodyne	EPHX2	18	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000872263042	DD	On-Demand	Anodyne	L3MBTL3	75	39
O=C(/C=C\c1ccccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263043	FD	On-Demand	Anodyne	CCR2	17	43
O=C(/C=C/c1ccccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263044	FD	On-Demand	Anodyne	CCR2	17	43
CN1CCCC[C@H](N(C)Cc2ccc(F)cc2C#N)C1=O	ZINC000872263057	CE	On-Demand	Mild	PGR	15	41
CN1CCCC[C@@H](N(C)Cc2ccc(F)cc2C#N)C1=O	ZINC000872263058	CE	On-Demand	Mild	PGR	15	41
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263075	DG	On-Demand	Anodyne	ACACA	28	48
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263075	DG	On-Demand	Anodyne	ACACB	30	49
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	PIK3CA	21	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	MTOR	38	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	EPHX2	25	55
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	PIK3CG	19	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	BTK	34	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263079	EE	On-Demand	Anodyne	L3MBTL3	70	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	ZINC000872263086	EG	On-Demand	Anodyne	EPHX2	16	46
O=C(CCC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1ccccc1	ZINC000872263087	FD	On-Demand	Anodyne	CYP2J2	44	31
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	ZINC000872263088	EG	On-Demand	Anodyne	EPHX2	16	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000872263089	GF	On-Demand	Anodyne	NPY2R	27	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000872263089	GF	On-Demand	Anodyne	EPHX2	15	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000872263089	GF	On-Demand	Anodyne	PTK6	34	41
O=C(Cc1ccc(Cl)cc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263090	GE	On-Demand	Anodyne	P2RX7	24	40
O=C(Cc1ccc(Cl)cc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263090	GE	On-Demand	Anodyne	EPHX2	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000872263102	FD	On-Demand	Anodyne	L3MBTL3	68	37
O=C(COc1ccc2ccccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263130	GE	On-Demand	Anodyne	HTR1D	15	40
O=C(COc1ccc2ccccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263130	GE	On-Demand	Anodyne	HTR1B	18	40
O=C(COc1ccc2ccccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263130	GE	On-Demand	Anodyne	CPT1A	50	33
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)C1	ZINC000872263141	EE	On-Demand	Anodyne	ENV	40	35
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(-c3cn[nH]c3)cn1)C2	ZINC000872263142	DD	On-Demand	Anodyne	ROCK2	42	37
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(-c3cn[nH]c3)cn1)C2	ZINC000872263142	DD	On-Demand	Anodyne	PTK6	60	35
CN1CCCC[C@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1=O	ZINC000872263143	EF	On-Demand	Bother	NOS3	18	63
CN1CCCC[C@@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1=O	ZINC000872263144	EF	On-Demand	Bother	NOS3	18	63
O=C(c1ccc(F)cc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263171	FD	On-Demand	Anodyne	L3MBTL3	40	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000872263181	ED	On-Demand	Anodyne	EPHX2	50	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nc(-c2ccccc2)no1	ZINC000872263192	DE	On-Demand	Anodyne	SPHK1	34	44
CNC(=O)Nc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872263193	DE	On-Demand	Anodyne	EPHX2	19	43
CNC(=O)Nc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872263193	DE	On-Demand	Anodyne	KCNK3	38	45
CC(=O)c1cccc(OCC(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872263195	GD	On-Demand	Anodyne	CPT1A	47	34
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(NC(=O)c2ccco2)cc1	ZINC000872263207	FG	On-Demand	Anodyne	TMPRSS11D	40	35
COc1ccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1OCC(F)(F)F	ZINC000872263223	EF	On-Demand	Anodyne	ENPP1	65	31
COc1ccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1OCC(F)(F)F	ZINC000872263223	EF	On-Demand	Anodyne	DRTS_TRYCR	47	33
CO[C@@H](CN1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccc(F)cc1	ZINC000872263242	DF	On-Demand	Anodyne	LEF	20	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872263247	DE	On-Demand	Anodyne	ADRB1	34	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872263247	DE	On-Demand	Anodyne	ADRB3	47	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872263247	DE	On-Demand	Anodyne	CYP3A4	44	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000872263248	DE	On-Demand	Anodyne	ADRB1	34	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000872263248	DE	On-Demand	Anodyne	ADRB3	47	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000872263248	DE	On-Demand	Anodyne	CYP3A4	44	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872263256	GE	On-Demand	Anodyne	LNPEP	42	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872263256	GE	On-Demand	Anodyne	EPHX2	42	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000872263256	GE	On-Demand	Anodyne	NAMPT	20	42
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	MMP13	29	40
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	CTSK	20	40
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	CACNA1B	25	44
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	MMP2	26	41
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	MMP3	41	40
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	MMP8	15	40
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	MMP1	44	40
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263266	DG	On-Demand	Anodyne	BIRC2	26	41
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	MMP13	29	40
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	CTSK	20	40
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	CACNA1B	25	44
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	MMP2	26	41
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	MMP3	41	40
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	MMP8	15	40
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	MMP1	44	40
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872263267	DG	On-Demand	Anodyne	BIRC2	26	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263273	FD	On-Demand	Anodyne	F2	18	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263273	FD	On-Demand	Anodyne	L3MBTL3	63	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872263273	FD	On-Demand	Anodyne	TMPRSS11D	63	41
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@@H](O)COc3ccccc3C#N)[C@H]21	ZINC000872263278	ED	On-Demand	Mild	ADRB1	51	35
CC1(C)[C@@H](O)[C@H]2CCCN(C[C@H](O)COc3ccccc3C#N)[C@H]21	ZINC000872263279	ED	On-Demand	Mild	ADRB1	51	35
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cccc(Oc3ccccn3)c1)C2	ZINC000872263300	EF	On-Demand	Anodyne	CFTR	31	45
Cc1ccc(F)c2[nH]c(C(=O)N3C[C@]4(C)CNC[C@]4(C)C3)cc12	ZINC000872263306	DF	On-Demand	Anodyne	HRH4	31	61
CN1CCCC[C@@H](N(C)CC(=O)Nc2cccnc2Cl)C1=O	ZINC000872263326	DD	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CN1CCCC[C@H](N(C)CC(=O)Nc2cccnc2Cl)C1=O	ZINC000872263327	DD	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc3c(C4CC4)cccc3[nH]1)C2	ZINC000872263378	DG	On-Demand	Anodyne	GRIN2B	21	43
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc3c(C4CC4)cccc3[nH]1)C2	ZINC000872263378	DG	On-Demand	Anodyne	HRH4	22	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000872263408	DE	On-Demand	Anodyne	AMP1_PLAFQ	52	39
CN1CCCC[C@@H](N(C)C[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000872263412	DE	On-Demand	Anodyne	CYP3A4	40	34
CN1CCCC[C@H](N(C)C[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000872263413	DE	On-Demand	Anodyne	CYP3A4	40	34
CN1CCCC[C@@H](N(C)C[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000872263414	DE	On-Demand	Anodyne	CYP3A4	40	34
CN1CCCC[C@H](N(C)C[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000872263415	DE	On-Demand	Anodyne	CYP3A4	40	34
Cc1ccc(CNC(=O)C2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1F	ZINC000872263416	GF	On-Demand	Anodyne	EPHX2	27	41
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000872263421	EF	On-Demand	Anodyne	CHRNA7	42	35
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000872263421	EF	On-Demand	Anodyne	C3AR1	44	44
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000872263422	EF	On-Demand	Anodyne	CHRNA7	42	35
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000872263422	EF	On-Demand	Anodyne	C3AR1	44	44
COc1ccc2c(c1)CC[C@H]2C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872263439	DE	On-Demand	Anodyne	PPARD	22	40
COc1ccc2c(c1)CC[C@H]2C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872263439	DE	On-Demand	Anodyne	MTNR1B	15	42
COc1ccc2c(c1)CC[C@H]2C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872263439	DE	On-Demand	Anodyne	EBP	17	41
C[C@@](N)(C(=O)N1CCOCC(F)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000872263477	ED	On-Demand	Bother	CACNA1D	52	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1=O	ZINC000872263482	EE	On-Demand	Anodyne	P2RX7	46	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1=O	ZINC000872263482	EE	On-Demand	Anodyne	LNPEP	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(CN2CCCC2=O)c1	ZINC000872263483	EE	On-Demand	Anodyne	P2RX7	26	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(CN2CCCC2=O)c1	ZINC000872263483	EE	On-Demand	Anodyne	TYRO3	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OCC(F)(F)F)c1	ZINC000872263531	EG	On-Demand	Anodyne	EPHX2	25	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	ZINC000872263555	GH	On-Demand	Anodyne	CA5B	29	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	ZINC000872263555	GH	On-Demand	Anodyne	CA5A	33	42
CN1CCCC[C@H](N(C)Cc2cc(=O)oc3cc(O)ccc23)C1=O	ZINC000872263559	ED	On-Demand	Anodyne	HSD17B3	34	51
CN1CCCC[C@@H](N(C)Cc2cc(=O)oc3cc(O)ccc23)C1=O	ZINC000872263562	ED	On-Demand	Anodyne	HSD17B3	34	51
CCOCCCNC(=O)c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872263582	FF	On-Demand	Anodyne	KCNK3	42	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000872263586	ED	On-Demand	Anodyne	CPT1A	73	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000872263586	ED	On-Demand	Anodyne	EPHX2	25	44
CN1CCCC[C@H](N(C)CCCOc2ccc(C#N)cc2)C1=O	ZINC000872263596	DE	On-Demand	Mild	HRH3	63	47
CN1CCCC[C@H](N(C)CCCOc2ccc(C#N)cc2)C1=O	ZINC000872263596	DE	On-Demand	Mild	MEN1	44	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000872263604	EF	On-Demand	Anodyne	SIGMAR1	17	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000872263604	EF	On-Demand	Anodyne	KDM1A	17	41
CN1CCCC[C@@H](N(C)CCCOc2ccc(C#N)cc2)C1=O	ZINC000872263612	DE	On-Demand	Mild	HRH3	63	47
CN1CCCC[C@@H](N(C)CCCOc2ccc(C#N)cc2)C1=O	ZINC000872263612	DE	On-Demand	Mild	MEN1	44	42
CN1CCCC[C@H](N(C)CC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	ZINC000872263634	FD	On-Demand	Reactive	CACNA1I	35	43
CN1CCCC[C@@H](N(C)CC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	ZINC000872263635	FD	On-Demand	Reactive	CACNA1I	35	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCOCC(F)(F)C1	ZINC000872263647	EE	On-Demand	Anodyne	MC4R	31	43
CCOCCCNC(=O)c1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872263648	ED	On-Demand	Anodyne	DRD4	40	31
CCOCCCNC(=O)c1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872263648	ED	On-Demand	Anodyne	CCR3	31	41
CCOCCCNC(=O)c1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872263648	ED	On-Demand	Anodyne	EPHX2	24	46
CN1CCCC[C@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263650	DD	On-Demand	Anodyne	FKBP1A	47	42
CN1CCCC[C@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263650	DD	On-Demand	Anodyne	SIGMAR1	17	48
CN1CCCC[C@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263650	DD	On-Demand	Anodyne	PREP	40	41
CN1CCCC[C@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263650	DD	On-Demand	Anodyne	SLC12A5	70	39
CN1CCCC[C@@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263651	DD	On-Demand	Anodyne	FKBP1A	47	42
CN1CCCC[C@@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263651	DD	On-Demand	Anodyne	SIGMAR1	17	48
CN1CCCC[C@@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263651	DD	On-Demand	Anodyne	PREP	40	41
CN1CCCC[C@@H](N(C)CC(=O)OCc2ccccc2)C1=O	ZINC000872263651	DD	On-Demand	Anodyne	SLC12A5	70	39
CC(=O)N1CCc2cc(C(=O)N3CCC(N4C(=O)O[C@H]5CNC[C@H]54)CC3)ccc21	ZINC000872263656	GC	On-Demand	Anodyne	L3MBTL3	54	34
O=C(c1ccccc1F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263675	ED	On-Demand	Anodyne	L3MBTL3	46	41
CC(C)(C)NC(=O)c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872263682	EG	On-Demand	Anodyne	KCNK3	94	46
CC(C)(C)NC(=O)c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872263682	EG	On-Demand	Anodyne	KCNK9	49	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCCOc1cccc(F)c1	ZINC000872263684	CE	On-Demand	Anodyne	HRH2	27	41
O=C(c1cccc(Br)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263685	GD	On-Demand	Anodyne	L3MBTL3	68	43
O=C(c1cccc(OC(F)F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263692	GD	On-Demand	Anodyne	L3MBTL3	42	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872263693	EE	On-Demand	Anodyne	PREP	27	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872263693	EE	On-Demand	Anodyne	L3MBTL3	65	44
CN1CCCC[C@H](N(C)Cc2nc3ccccc3[nH]2)C1=O	ZINC000872263694	CE	On-Demand	Anodyne	CXCR4	42	44
CN1CCCC[C@H](N(C)Cc2nc3ccccc3[nH]2)C1=O	ZINC000872263694	CE	On-Demand	Anodyne	KCNN3	31	40
CN1CCCC[C@@H](N(C)Cc2nc3ccccc3[nH]2)C1=O	ZINC000872263695	CE	On-Demand	Anodyne	CXCR4	42	44
CN1CCCC[C@@H](N(C)Cc2nc3ccccc3[nH]2)C1=O	ZINC000872263695	CE	On-Demand	Anodyne	KCNN3	31	40
N[C@H](CC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)Cc1ccccc1	ZINC000872263697	FC	On-Demand	Anodyne	DPP4	27	41
N[C@@H](CC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)Cc1ccccc1	ZINC000872263698	FC	On-Demand	Anodyne	DPP4	27	41
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(OCc3ccncc3)cc1)C2	ZINC000872263701	FF	On-Demand	Anodyne	ADAM17	18	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC(Cc2ccccc2)Cc2ccccc2)C1	ZINC000872263703	EG	On-Demand	Anodyne	MME	83	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC(Cc2ccccc2)Cc2ccccc2)C1	ZINC000872263703	EG	On-Demand	Anodyne	ANPEP	43	33
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC(Cc2ccccc2)Cc2ccccc2)C1	ZINC000872263703	EG	On-Demand	Anodyne	TACR2	49	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC(Cc2ccccc2)Cc2ccccc2)C1	ZINC000872263703	EG	On-Demand	Anodyne	TIMP3	44	33
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC(Cc2ccccc2)Cc2ccccc2)C1	ZINC000872263703	EG	On-Demand	Anodyne	ACE2	44	33
CN1CCCC[C@@H](N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O	ZINC000872263704	FD	On-Demand	Anodyne	MTOR	61	37
CN1CCCC[C@H](N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O	ZINC000872263705	FD	On-Demand	Anodyne	MTOR	61	37
O=C(c1ccc(Br)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263710	GD	On-Demand	Anodyne	L3MBTL3	85	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCCC2=O)cc1	ZINC000872263723	EE	On-Demand	Anodyne	P2RX7	29	41
COc1cc(N)c(Cl)cc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263726	GD	On-Demand	Anodyne	HTR4	100	43
Cc1nccc(-c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)n1	ZINC000872263739	DG	On-Demand	Anodyne	PRKD1	40	34
Cc1nccc(-c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)n1	ZINC000872263739	DG	On-Demand	Anodyne	SYK	42	36
CCOc1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263740	FD	On-Demand	Anodyne	OXTR	23	42
CCOc1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263740	FD	On-Demand	Anodyne	HCN1	64	41
CCOc1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263740	FD	On-Demand	Anodyne	HCN4	52	41
CCOc1ccccc1C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263740	FD	On-Demand	Anodyne	L3MBTL3	44	39
O=C(c1ccc2c(c1)OCO2)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263741	FC	On-Demand	Anodyne	L3MBTL3	72	37
O=C(c1ccc(Cl)c(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263743	GE	On-Demand	Anodyne	CCR3	18	42
O=C(c1ccc(Cl)c(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263743	GE	On-Demand	Anodyne	L3MBTL3	76	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872263759	FE	On-Demand	Anodyne	HRH3	15	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872263759	FE	On-Demand	Anodyne	MLYCD	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872263759	FE	On-Demand	Anodyne	L3MBTL3	76	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCCC(F)(F)CC1	ZINC000872263768	EG	On-Demand	Anodyne	MC4R	49	47
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCCC(F)(F)CC1	ZINC000872263768	EG	On-Demand	Anodyne	PRCP	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872263769	EE	On-Demand	Anodyne	SLC9A1	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872263769	EE	On-Demand	Anodyne	L3MBTL3	86	44
O=C(c1ccc(C(F)(F)F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263771	GE	On-Demand	Anodyne	L3MBTL3	74	39
CCCNC(=O)c1ccc(Cl)cc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872263772	EF	On-Demand	Anodyne	SLC6A9	48	37
O=C(/C=C/c1cccc(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263775	FD	On-Demand	Anodyne	CCR2	21	44
O=C(/C=C\c1cccc(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263776	FD	On-Demand	Anodyne	CCR2	21	44
O=C(c1cccnc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872263777	FD	On-Demand	Anodyne	G2YM83_BOTF4	51	34
C[C@@](N)(C(=O)N1CCCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872263778	EE	On-Demand	Bother	CACNA1C	41	35
C[C@@](N)(C(=O)N1CCCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872263778	EE	On-Demand	Bother	CACNA1D	65	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000872263780	DF	On-Demand	Anodyne	MPO	85	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000872263780	DF	On-Demand	Anodyne	MTNR1A	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1c(F)cccc1Cl	ZINC000872263787	CG	On-Demand	Anodyne	P2RX7	42	53
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)C1	ZINC000872263793	FF	On-Demand	Anodyne	EPHX2	27	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)C1	ZINC000872263793	FF	On-Demand	Anodyne	HIF1A	21	48
COc1cccc(C(=O)NNC(=O)[C@]23CCC[C@H]2OCC3)c1O	ZINC000872263807	DD	On-Demand	Reactive	KCNA3	41	37
COc1cccc(C(=O)NNC(=O)[C@]23CCC[C@H]2OCC3)c1O	ZINC000872263807	DD	On-Demand	Reactive	HCN1	62	36
COc1cccc(C(=O)NNC(=O)[C@]23CCC[C@H]2OCC3)c1O	ZINC000872263807	DD	On-Demand	Reactive	HCN4	50	35
COc1ccc(OC2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872263808	EF	On-Demand	Anodyne	PRSS2	63	33
COc1ccc(OC2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872263808	EF	On-Demand	Anodyne	NPBWR1	48	30
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	F2	41	43
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	ACE	76	39
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	OPRM1	54	50
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	OPRD1	43	50
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	SLC6A3	15	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MME	115	46
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	ANPEP	58	34
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	TACR1	28	44
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	TRHR	20	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	PGC	58	37
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MC4R	29	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CMA1	38	45
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTRA_BOVIN	57	35
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	FCER2	51	36
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTSB	62	40
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	PAPA1_CARPA	64	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	TRY1_BOVIN	60	36
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CYSP_TRYCR	57	43
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTSG	44	35
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTSK	48	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTSL	56	43
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CACNA1B	46	38
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	NPFFR2	61	35
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	TIMP3	87	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MC3R	24	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MC5R	29	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CAPNS1	85	44
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MMP3	21	44
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CELA2A	61	35
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	REN	93	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	REN1	44	33
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTSS	36	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CAPN1	108	43
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MMP9	17	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTRC	18	45
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CAPN2	78	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	ACE2	79	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MC1R	18	41
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	KLK5	21	40
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	MMP1	25	45
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	FPR1	57	40
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	CTRB_BOVIN	46	34
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	NPR	31	46
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	XIAP	38	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	BIRC2	16	42
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	BRCA1	63	34
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	NPFFR1	49	32
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263845	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	36	44
C[C@@]12CNC[C@]1(C)CN(C(=O)CCc1cccc3ccccc13)C2	ZINC000872263848	DG	On-Demand	Anodyne	NQO2	18	40
C[C@@]12CNC[C@]1(C)CN(C(=O)COCc1cccnc1)C2	ZINC000872263865	CD	On-Demand	Anodyne	CHRNA7	45	38
COc1ccc2c(CN(C)[C@H]3CCCCN(C)C3=O)cc(=O)oc2c1	ZINC000872263869	EE	On-Demand	Anodyne	MAOB	23	42
COc1ccc2c(CN(C)[C@@H]3CCCCN(C)C3=O)cc(=O)oc2c1	ZINC000872263870	EE	On-Demand	Anodyne	MAOB	23	42
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CHRM2	20	40
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CHRM1	21	40
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CHRM4	16	40
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CHRM5	15	40
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CHRM3	38	40
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263878	CD	On-Demand	Anodyne	CYP2J2	47	35
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CHRM2	20	40
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CHRM1	21	40
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CHRM4	16	40
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CHRM5	15	40
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CHRM3	38	40
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@@H](N(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000872263880	CD	On-Demand	Anodyne	CYP2J2	47	35
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CHRM2	20	40
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CHRM1	21	40
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CHRM4	16	40
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CHRM5	15	40
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CHRM3	38	40
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263882	CD	On-Demand	Anodyne	CYP2J2	47	35
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CHRM2	20	40
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CHRM1	21	40
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CHRM4	16	40
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CHRM5	15	40
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CHRM3	38	40
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@@H](N(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000872263884	CD	On-Demand	Anodyne	CYP2J2	47	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263885	EF	On-Demand	Anodyne	BMP1	49	39
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263885	EF	On-Demand	Anodyne	NOS2	81	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263886	EF	On-Demand	Anodyne	BMP1	49	39
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872263886	EF	On-Demand	Anodyne	NOS2	81	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000872263889	DD	On-Demand	Anodyne	ADRB2	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000872263889	DD	On-Demand	Anodyne	ADRB1	33	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000872263890	DD	On-Demand	Anodyne	ADRB2	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000872263890	DD	On-Demand	Anodyne	ADRB1	33	45
C[C@@]12CNC[C@]1(C)CN(C(=O)CCc1cccnc1Cl)C2	ZINC000872263905	DE	On-Demand	Anodyne	G2YM83_BOTF4	44	31
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000872263922	ED	On-Demand	Anodyne	PIK3CA	17	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000872263922	ED	On-Demand	Anodyne	MTOR	27	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000872263922	ED	On-Demand	Anodyne	EPHX2	29	53
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000872263922	ED	On-Demand	Anodyne	PIK3CG	16	42
O=C(NC[C@H](O)COc1cccc(F)c1)[C@]12CCC[C@H]1CNC2	ZINC000872263935	DD	On-Demand	Anodyne	ADRB1	27	40
O=C(NC[C@@H](O)COc1cccc(F)c1)[C@]12CCC[C@H]1CNC2	ZINC000872263936	DD	On-Demand	Anodyne	ADRB1	27	40
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CNC[C@H]1c1ccc(Cl)cc1)C2	ZINC000872263951	EE	On-Demand	Anodyne	SLC6A3	19	44
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CNC[C@H]1c1ccc(Cl)cc1)C2	ZINC000872263951	EE	On-Demand	Anodyne	MC4R	33	44
CCCCCNC(=O)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872263975	EE	On-Demand	Anodyne	TPP2	20	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872263976	ED	On-Demand	Anodyne	SIGMAR1	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872263976	ED	On-Demand	Anodyne	CCR5	24	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872263976	ED	On-Demand	Anodyne	PREP	76	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872263976	ED	On-Demand	Anodyne	ADAM10	20	40
Nc1cccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872263984	EC	On-Demand	Anodyne	L3MBTL3	66	43
COC(=O)c1cc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)ccc1Cl	ZINC000872263989	DE	On-Demand	Anodyne	ENV	40	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000872264012	EG	On-Demand	Anodyne	PDS	52	41
COc1cc(N)c(Cl)cc1C(=O)N1CCOCC(F)(F)C1	ZINC000872264021	DE	On-Demand	Anodyne	HTR4	104	52
COc1cc(N)c(Cl)cc1C(=O)N1CCOCC(F)(F)C1	ZINC000872264021	DE	On-Demand	Anodyne	LRRK2	32	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000872264035	FE	On-Demand	Anodyne	HRH3	24	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000872264035	FE	On-Demand	Anodyne	PREP	30	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000872264035	FE	On-Demand	Anodyne	L3MBTL3	53	42
O=C(Cc1ccc(Cl)c(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264036	GE	On-Demand	Anodyne	OPRK1	24	43
O=C(Cc1ccc(Cl)c(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264036	GE	On-Demand	Anodyne	CCR3	26	43
O=C(c1ccccc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264049	GE	On-Demand	Anodyne	RBP4	41	41
O=C(c1ccccc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264049	GE	On-Demand	Anodyne	SCD1	25	43
O=C(c1ccccc1C(F)(F)F)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264049	GE	On-Demand	Anodyne	SCD	23	42
Cc1cccc(C(=O)N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)c1	ZINC000872264061	FF	On-Demand	Anodyne	PREP	30	44
Cc1cccc(C(=O)N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)c1	ZINC000872264061	FF	On-Demand	Anodyne	L3MBTL3	57	42
Cc1cccc(C(=O)N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)c1	ZINC000872264061	FF	On-Demand	Anodyne	HPGD	44	42
O=C(c1cc(Cl)cc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264062	GE	On-Demand	Anodyne	L3MBTL3	54	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccccc2F)CC1	ZINC000872264083	FE	On-Demand	Anodyne	L3MBTL3	44	39
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872264085	ED	On-Demand	Anodyne	SLC18A3	16	43
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872264085	ED	On-Demand	Anodyne	L3MBTL3	78	39
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000872264116	EG	On-Demand	Anodyne	EPHX2	26	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000872264116	EG	On-Demand	Anodyne	PLAU	19	42
O=C(NC[C@@H](O)c1ccccc1Cl)[C@]12CCC[C@H]1CNC2	ZINC000872264142	DD	On-Demand	Anodyne	OPRL1	27	41
O=C(NC[C@H](O)c1ccccc1Cl)[C@]12CCC[C@H]1CNC2	ZINC000872264143	DD	On-Demand	Anodyne	OPRL1	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872264175	GF	On-Demand	Anodyne	CACNA1G	43	40
COCCOc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872264197	EF	On-Demand	Anodyne	REN	22	40
COCCOc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872264197	EF	On-Demand	Anodyne	STK17B	40	37
COCCOc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872264197	EF	On-Demand	Anodyne	QRFPR	42	34
COCCOc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872264197	EF	On-Demand	Anodyne	ENPP1	70	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(Nc3ccccc3)c2)C1	ZINC000872264200	DG	On-Demand	Anodyne	EPHX2	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(Nc3ccccc3)c2)C1	ZINC000872264200	DG	On-Demand	Anodyne	AKR1C3	23	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(Nc3ccccc3)c2)C1	ZINC000872264200	DG	On-Demand	Anodyne	KCNK3	52	34
Nc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872264252	EC	On-Demand	Anodyne	L3MBTL3	85	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264253	FC	On-Demand	Anodyne	OPRM1	31	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264253	FC	On-Demand	Anodyne	OPRD1	22	41
N[C@H](Cc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264254	FC	On-Demand	Anodyne	OPRM1	31	41
N[C@H](Cc1ccccc1)C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264254	FC	On-Demand	Anodyne	OPRD1	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)CC2CCCC2)CC1	ZINC000872264256	EF	On-Demand	Anodyne	ADAM10	17	42
O=C(c1cccc(C(F)(F)F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264258	GE	On-Demand	Anodyne	CCR2	46	39
O=C(c1cccc(C(F)(F)F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264258	GE	On-Demand	Anodyne	L3MBTL3	58	41
O=C(c1cccc(Cl)c1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264276	GE	On-Demand	Anodyne	P2RX7	15	40
O=C(c1cccc(Cl)c1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264276	GE	On-Demand	Anodyne	L3MBTL3	59	39
O=C(c1cccc(Cl)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264286	ED	On-Demand	Anodyne	L3MBTL3	66	43
COc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c(OC)c1	ZINC000872264289	GD	On-Demand	Anodyne	OXTR	34	45
O=C(Cc1cccs1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264290	ED	On-Demand	Anodyne	ETHR	35	46
O=C(c1ccccc1Br)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264295	GD	On-Demand	Anodyne	L3MBTL3	46	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	ACE	61	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	OPRM1	34	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	OPRD1	26	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	GHRHR	58	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	MME	97	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	ANPEP	50	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	TACR1	17	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CTRA_BOVIN	51	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	PAPA1_CARPA	51	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CYSP_TRYCR	48	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CTSG	40	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	TIMP3	97	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CAPNS1	78	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	HLA-DRB1	54	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CELA2A	59	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CAPN1	64	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	MMP9	15	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CAPN2	55	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	ACE2	64	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	MMP1	17	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	FPR1	44	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264297	DD	On-Demand	Anodyne	PSMB8	50	32
O=C(c1ccc(Cl)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264300	ED	On-Demand	Anodyne	L3MBTL3	85	41
CN1CCCC[C@@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264319	CD	On-Demand	Anodyne	SLC6A3	17	41
CN1CCCC[C@@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264319	CD	On-Demand	Anodyne	AOC3	16	42
CN1CCCC[C@@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264319	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
CN1CCCC[C@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264320	CD	On-Demand	Anodyne	SLC6A3	17	41
CN1CCCC[C@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264320	CD	On-Demand	Anodyne	AOC3	16	42
CN1CCCC[C@H](N(C)C[C@H](O)c2ccccc2)C1=O	ZINC000872264320	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
CN1CCCC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264321	CD	On-Demand	Anodyne	SLC6A3	17	41
CN1CCCC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264321	CD	On-Demand	Anodyne	AOC3	16	42
CN1CCCC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264321	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
CN1CCCC[C@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264322	CD	On-Demand	Anodyne	SLC6A3	17	41
CN1CCCC[C@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264322	CD	On-Demand	Anodyne	AOC3	16	42
CN1CCCC[C@H](N(C)C[C@@H](O)c2ccccc2)C1=O	ZINC000872264322	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
O=C(c1ccco1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264325	DC	On-Demand	Anodyne	L3MBTL3	55	38
O=C(c1ccc(Br)o1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264332	GD	On-Demand	Anodyne	L3MBTL3	34	43
O=C(c1ccc2ccccc2c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264337	FE	On-Demand	Anodyne	L3MBTL3	81	46
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872264356	CF	On-Demand	Anodyne	BIRC2	19	40
C[C@H](Cc1ccccc1F)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872264357	CF	On-Demand	Anodyne	BIRC2	19	40
CCN(Cc1ccc(Cl)cc1)C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872264364	CF	On-Demand	Anodyne	FFAR2	53	44
Cc1cc(C)cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1	ZINC000872264365	ED	On-Demand	Anodyne	L3MBTL3	57	33
CN1CCCC[C@H](N(C)CCOc2cccc(F)c2)C1=O	ZINC000872264372	CE	On-Demand	Anodyne	CHRNA10	65	47
CN1CCCC[C@H](N(C)CCOc2cccc(F)c2)C1=O	ZINC000872264372	CE	On-Demand	Anodyne	ACKR3	45	33
CN1CCCC[C@@H](N(C)CCOc2cccc(F)c2)C1=O	ZINC000872264374	CE	On-Demand	Anodyne	CHRNA10	65	47
CN1CCCC[C@@H](N(C)CCOc2cccc(F)c2)C1=O	ZINC000872264374	CE	On-Demand	Anodyne	ACKR3	45	33
CN1CCCC[C@@H](N(C)CC(=O)Nc2ccc3ccccc3c2)C1=O	ZINC000872264382	EF	On-Demand	Anodyne	LTA4H	15	42
CN1CCCC[C@@H](N(C)CC(=O)Nc2ccc3ccccc3c2)C1=O	ZINC000872264382	EF	On-Demand	Anodyne	IMDH_CRYPV	26	42
CN1CCCC[C@H](N(C)CC(=O)Nc2ccc3ccccc3c2)C1=O	ZINC000872264383	EF	On-Demand	Anodyne	LTA4H	15	42
CN1CCCC[C@H](N(C)CC(=O)Nc2ccc3ccccc3c2)C1=O	ZINC000872264383	EF	On-Demand	Anodyne	IMDH_CRYPV	26	42
CCOc1cc(CN[C@]23CCC[C@H]2OCC3)ccc1O	ZINC000872264389	CF	On-Demand	Anodyne	SSTR5	34	40
O=C(OCc1ccccc1)c1ccc(CN[C@]23CCC[C@H]2OCC3)[nH]1	ZINC000872264398	EG	On-Demand	Anodyne	SLC12A5	57	36
N[C@@H]1CCCCC[C@@H]1C(=O)NNc1ccccc1C(F)(F)F	ZINC000872264406	DG	On-Demand	Reactive	RBP4	40	37
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA2	39	40
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA1	40	40
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA5B	31	40
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA5A	28	40
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA12	29	41
NS(=O)(=O)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872264411	CD	On-Demand	Anodyne	CA9	34	41
O=C(COc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264432	EC	On-Demand	Anodyne	CPT1A	120	39
O=C(COc1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264432	EC	On-Demand	Anodyne	CPT2	46	34
O=C(c1cccc(F)c1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264436	ED	On-Demand	Anodyne	L3MBTL3	68	43
O=C(/C=C/c1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264454	ED	On-Demand	Anodyne	CCR2	19	43
O=C(/C=C\c1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264456	ED	On-Demand	Anodyne	CCR2	19	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	ACE	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	GHRHR	79	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	P2RY12	68	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	MME	100	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	ANPEP	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	TACR1	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	MC4R	69	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CMA1	49	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTRA_BOVIN	67	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	FCER2	56	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	KLK3	64	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTSB	68	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	TRY2_BOVIN	59	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	PAPA1_CARPA	73	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CYSP_TRYCR	68	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CCKAR	18	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTSG	44	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTSK	58	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTSL	54	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CPA1	24	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	TIMP3	82	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	MC5R	40	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CAPNS1	74	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	HLA-DRB1	86	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CELA2A	63	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	REN	33	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTSS	26	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	GHSR	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CAPN1	111	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CAPN2	128	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	ACE2	90	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	FPR1	59	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	CTRB_BOVIN	50	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	PLM2_PLAFA	54	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	GAG-PRO	82	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	PSMB8	49	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264457	FD	On-Demand	Anodyne	NPFFR1	47	32
CCOC(=O)N1CCC(NC(=O)CN(C)[C@H]2CCCCN(C)C2=O)CC1	ZINC000872264462	FC	On-Demand	Anodyne	CCR8	20	40
CCOC(=O)N1CCC(NC(=O)CN(C)[C@@H]2CCCCN(C)C2=O)CC1	ZINC000872264464	FC	On-Demand	Anodyne	CCR8	20	40
CCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872264466	FD	On-Demand	Anodyne	AVPR1A	15	49
CCOc1ccc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1	ZINC000872264466	FD	On-Demand	Anodyne	L3MBTL3	72	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872264472	FH	On-Demand	Anodyne	L3MBTL3	61	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872264486	FE	On-Demand	Anodyne	SSTR3	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872264486	FE	On-Demand	Anodyne	EPHX2	25	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872264486	FE	On-Demand	Anodyne	L3MBTL3	40	34
O=C(c1ccc(F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264492	ED	On-Demand	Anodyne	L3MBTL3	90	42
O=C(Cc1ccc2ccccc2c1)NNC(=O)[C@]12CCC[C@H]1OCC2	ZINC000872264504	EE	On-Demand	Reactive	LUXR	15	48
O=C(/C=C\c1ccc(Cl)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264512	GE	On-Demand	Anodyne	CCR2	18	41
O=C(/C=C/c1ccc(Cl)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264513	GE	On-Demand	Anodyne	CCR2	18	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)cc2C(=O)NCC2CC2)C1	ZINC000872264532	EF	On-Demand	Anodyne	F10	30	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)cc2C(=O)NCC2CC2)C1	ZINC000872264532	EF	On-Demand	Anodyne	CACNA1I	67	40
O=C(Cc1ccc(F)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264534	ED	On-Demand	Anodyne	MLNR	22	40
O=C(c1ccc(Cl)nc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264535	FD	On-Demand	Anodyne	L3MBTL3	62	43
C[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)[C@@H](N)c1ccccc1	ZINC000872264558	FD	On-Demand	Anodyne	BIRC8	45	32
C[C@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)[C@H](N)c1ccccc1	ZINC000872264559	FD	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)[C@@H](N)c1ccccc1	ZINC000872264560	FD	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](C(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)[C@H](N)c1ccccc1	ZINC000872264561	FD	On-Demand	Anodyne	BIRC8	45	32
O=C(c1ccccc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264564	DD	On-Demand	Anodyne	L3MBTL3	86	40
O=C(c1ccccc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264591	ED	On-Demand	Anodyne	L3MBTL3	72	44
C[C@@]12CNC[C@]1(C)CN(C(=O)CCc1ccc(N3CCCS3(=O)=O)cc1)C2	ZINC000872264595	GD	On-Demand	Anodyne	CDK1	16	40
Cc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872264605	EE	On-Demand	Anodyne	L3MBTL3	86	44
COC(=O)c1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872264614	DD	On-Demand	Anodyne	F2	17	40
COc1cc(N)c(Cl)cc1C(=O)N1CCCC(F)(F)CC1	ZINC000872264615	DG	On-Demand	Anodyne	HTR4	109	51
O=C(c1c(F)cccc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264625	FD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(c1c(Cl)cccc1Cl)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264629	GE	On-Demand	Anodyne	L3MBTL3	73	38
C[C@H](C(=O)Nc1cccnc1Cl)N(C)[C@@H]1CCCCN(C)C1=O	ZINC000872264635	EE	On-Demand	Anodyne	G2YM83_BOTF4	45	33
C[C@H](C(=O)Nc1cccnc1Cl)N(C)[C@H]1CCCCN(C)C1=O	ZINC000872264638	EE	On-Demand	Anodyne	G2YM83_BOTF4	45	33
O=C(CCC(=O)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1)c1cccs1	ZINC000872264645	GD	On-Demand	Anodyne	ETHR	48	36
O=C(c1ccc(-c2ccccc2)cc1)N1CCC(N2C(=O)O[C@H]3CNC[C@H]32)CC1	ZINC000872264666	GF	On-Demand	Anodyne	L3MBTL3	85	40
CN1CCCC[C@H](N(C)CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O	ZINC000872264671	GD	On-Demand	Anodyne	MTOR	50	36
CN1CCCC[C@@H](N(C)CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O	ZINC000872264673	GD	On-Demand	Anodyne	MTOR	50	36
C=C(Cl)C[C@@H](N)C(=O)N1CCCC(F)(F)CC1	ZINC000872264679	CE	On-Demand	Mild	DPP7	44	36
C=C(Cl)C[C@H](N)C(=O)N1CCCC(F)(F)CC1	ZINC000872264686	CE	On-Demand	Mild	DPP7	44	36
O=C(CCn1c(S)nnc1-c1cccs1)N1CCO[C@H](C(F)F)CC1	ZINC000872264695	GF	On-Demand	Anodyne	ETHR	70	44
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	HTR1A	22	50
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	HTR1D	57	50
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	HTR1B	45	50
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	MPO	56	38
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	HTR1E	28	42
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	MTNR1A	117	64
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	MTNR1B	89	63
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	GHSR	21	48
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)c2c1	ZINC000872264696	EF	On-Demand	Anodyne	ABCG2	29	48
O=C(CCn1c(S)nnc1-c1cccs1)N1CCO[C@@H](C(F)F)CC1	ZINC000872264698	GF	On-Demand	Anodyne	ETHR	70	44
Nc1cc(C(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)ccc1F	ZINC000872264703	EC	On-Demand	Anodyne	L3MBTL3	69	42
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872264705	FD	On-Demand	Anodyne	HRH3	20	42
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872264705	FD	On-Demand	Anodyne	SLC18A3	16	40
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872264705	FD	On-Demand	Anodyne	L3MBTL3	73	42
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872264705	FD	On-Demand	Anodyne	NPBWR1	74	31
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCOCCc1ccccc1	ZINC000872264749	EG	On-Demand	Anodyne	FKBP1A	31	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCOCCc1ccccc1	ZINC000872264749	EG	On-Demand	Anodyne	AMY2	47	32
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CC(c3cccc(F)c3)=NO1)C2	ZINC000872264765	ED	On-Demand	Anodyne	LUCI_PHOPY	22	42
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CC(c3cccc(F)c3)=NO1)C2	ZINC000872264766	ED	On-Demand	Anodyne	LUCI_PHOPY	22	42
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	HTR1A	23	41
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	DRD2	24	41
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	DRD4	25	41
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	DRD3	21	41
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	ADRA2C	16	42
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1OC	ZINC000872264771	EF	On-Demand	Anodyne	SIGMAR1	15	43
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(NC(=O)C(F)(F)F)cc1)C2	ZINC000872264777	FE	On-Demand	Anodyne	EPHX2	40	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCS(=O)(=O)Cc1ccccc1	ZINC000872264798	FE	On-Demand	Anodyne	FKBP1A	16	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCS(=O)(=O)Cc1ccccc1	ZINC000872264798	FE	On-Demand	Anodyne	TMPRSS11D	79	35
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872264801	FE	On-Demand	Anodyne	PREP	22	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872264801	FE	On-Demand	Anodyne	L3MBTL3	75	39
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1	ZINC000872264802	DF	On-Demand	Anodyne	DRD4	26	42
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1	ZINC000872264802	DF	On-Demand	Anodyne	SIGMAR1	17	46
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1	ZINC000872264802	DF	On-Demand	Anodyne	ABCB1	21	42
CCOCc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872264820	EG	On-Demand	Anodyne	SSTR5	39	40
O=C(c1ccc2nc(Cl)ccc2c1)N1CCO[C@@H](C(F)F)CC1	ZINC000872264822	EG	On-Demand	Anodyne	L3MBTL3	53	40
O=C(c1ccc2nc(Cl)ccc2c1)N1CCO[C@H](C(F)F)CC1	ZINC000872264823	EG	On-Demand	Anodyne	L3MBTL3	53	40
O=C(Cc1ccc2cccnc2c1)N1CCO[C@H](C(F)F)CC1	ZINC000872264842	DF	On-Demand	Anodyne	ETHR	50	31
O=C(Cc1ccc2cccnc2c1)N1CCO[C@@H](C(F)F)CC1	ZINC000872264843	DF	On-Demand	Anodyne	ETHR	50	31
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2	ZINC000872264873	DD	On-Demand	Anodyne	LUCI_PHOPY	52	37
O=C(c1csc(NC2CCCCC2)n1)N1CCO[C@@H](C(F)F)CC1	ZINC000872264874	FG	On-Demand	Anodyne	TRPC6	62	42
O=C(c1csc(NC2CCCCC2)n1)N1CCO[C@@H](C(F)F)CC1	ZINC000872264874	FG	On-Demand	Anodyne	TRPC3	56	42
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2	ZINC000872264875	DD	On-Demand	Anodyne	LUCI_PHOPY	52	37
O=C(c1csc(NC2CCCCC2)n1)N1CCO[C@H](C(F)F)CC1	ZINC000872264876	FG	On-Demand	Anodyne	TRPC6	62	42
O=C(c1csc(NC2CCCCC2)n1)N1CCO[C@H](C(F)F)CC1	ZINC000872264876	FG	On-Demand	Anodyne	TRPC3	56	42
CCOc1cc(CN2C[C@H]3COC[C@H]3C2)ccc1OC(=O)CC	ZINC000872264934	DE	On-Demand	Anodyne	SSTR5	74	40
CCCC[C@@](C)(F)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264973	CE	On-Demand	Anodyne	EST1_PIG	43	32
CCCC[C@](C)(F)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872264975	CE	On-Demand	Anodyne	EST1_PIG	43	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000872264976	DH	On-Demand	Anodyne	DHODH	21	42
COCCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872264988	EF	On-Demand	Anodyne	LTA4H	60	43
COCCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872264988	EF	On-Demand	Anodyne	HRH3	33	47
COCCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872264988	EF	On-Demand	Anodyne	SIGMAR1	16	42
COCCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872264988	EF	On-Demand	Anodyne	NOD1	16	41
COCCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872264988	EF	On-Demand	Anodyne	NOD2	45	42
COc1cc(CN2CCN(C)c3ncccc3C2)cc2c1OCO2	ZINC000872265018	EE	On-Demand	Anodyne	ADRA2C	17	40
CCNC(=O)COc1ccc(CN2CCN(C)c3ncccc3C2)cc1OC	ZINC000872265028	GE	On-Demand	Anodyne	DRD2	24	40
CCNC(=O)COc1ccc(CN2CCN(C)c3ncccc3C2)cc1OC	ZINC000872265028	GE	On-Demand	Anodyne	DRD3	30	40
CCNC(=O)COc1ccc(CN2CCN(C)c3ncccc3C2)cc1OC	ZINC000872265028	GE	On-Demand	Anodyne	SSTR5	51	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N(Cc2ccccc2)C2CCCCC2)C1	ZINC000872265034	DG	On-Demand	Anodyne	AMY2	43	29
CN1CCN(c2ncc(CN3CCN(C)c4ncccc4C3)cn2)CC1	ZINC000872265036	FD	On-Demand	Anodyne	HTR1A	16	40
CN1CCN(c2ncc(CN3CCN(C)c4ncccc4C3)cn2)CC1	ZINC000872265036	FD	On-Demand	Anodyne	DRD4	24	43
CN1CCN(c2ncc(CN3CCN(C)c4ncccc4C3)cn2)CC1	ZINC000872265036	FD	On-Demand	Anodyne	HTR3A	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2O)CC1	ZINC000872265038	ED	On-Demand	Anodyne	L3MBTL3	64	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1	ZINC000872265058	EF	On-Demand	Anodyne	ADAM10	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000872265065	DE	On-Demand	Anodyne	NOS2	48	35
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265068	ED	On-Demand	Anodyne	F2	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265068	ED	On-Demand	Anodyne	ACE	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265068	ED	On-Demand	Anodyne	MME	24	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265068	ED	On-Demand	Anodyne	SIGMAR1	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265069	ED	On-Demand	Anodyne	F2	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265069	ED	On-Demand	Anodyne	ACE	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265069	ED	On-Demand	Anodyne	MME	24	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872265069	ED	On-Demand	Anodyne	SIGMAR1	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	ZINC000872265084	GH	On-Demand	Anodyne	KCNQ2	21	41
CN1CCCC[C@@H](N(C)C[C@H](O)c2ccccc2Cl)C1=O	ZINC000872265122	DE	On-Demand	Anodyne	OPRM1	15	40
CN1CCCC[C@@H](N(C)C[C@H](O)c2ccccc2Cl)C1=O	ZINC000872265122	DE	On-Demand	Anodyne	OPRL1	50	40
CN1CCCC[C@H](N(C)C[C@H](O)c2ccccc2Cl)C1=O	ZINC000872265123	DE	On-Demand	Anodyne	OPRM1	15	40
CN1CCCC[C@H](N(C)C[C@H](O)c2ccccc2Cl)C1=O	ZINC000872265123	DE	On-Demand	Anodyne	OPRL1	50	40
COc1ccccc1/C(C)=C/C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265129	DF	On-Demand	Anodyne	KCNA3	40	40
COc1ccccc1/C(C)=C\C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265131	DF	On-Demand	Anodyne	KCNA3	40	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000872265145	DD	On-Demand	Anodyne	ADRB2	44	47
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000872265145	DD	On-Demand	Anodyne	ADRB1	64	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000872265145	DD	On-Demand	Anodyne	ADRB3	41	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000872265145	DD	On-Demand	Anodyne	AMY2	45	31
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000872265145	DD	On-Demand	Anodyne	ABCB1	20	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000872265149	DD	On-Demand	Anodyne	ADRB2	44	47
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000872265149	DD	On-Demand	Anodyne	ADRB1	64	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000872265149	DD	On-Demand	Anodyne	ADRB3	41	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000872265149	DD	On-Demand	Anodyne	AMY2	45	31
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000872265149	DD	On-Demand	Anodyne	ABCB1	20	41
CC(C)(C)OC(=O)NCc1cccc(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872265150	EF	On-Demand	Anodyne	HRH2	24	44
CC(C)(C)OC(=O)NCc1cccc(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872265150	EF	On-Demand	Anodyne	PDS	58	32
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nnnn1-c1ccccc1	ZINC000872265152	DD	On-Demand	Anodyne	TMPRSS11D	40	33
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	ZINC000872265180	DD	On-Demand	Anodyne	INHA	17	42
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	ZINC000872265181	DD	On-Demand	Anodyne	INHA	17	42
O=C(Cc1csc(C2CC2)n1)N1CCO[C@@H](C(F)F)CC1	ZINC000872265195	DE	On-Demand	Anodyne	ETHR	55	39
O=C(Cc1csc(C2CC2)n1)N1CCO[C@H](C(F)F)CC1	ZINC000872265197	DE	On-Demand	Anodyne	ETHR	55	39
CCn1c(CNC(=O)[C@@H]2CCCCC[C@@H]2N)nc2ccccc21	ZINC000872265198	DF	On-Demand	Anodyne	PDE6D	45	34
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	INHA	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	NPY2R	22	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	PREP	28	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	EPHX2	24	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	L3MBTL3	87	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000872265244	EG	On-Demand	Anodyne	KCNK3	25	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872265256	GE	On-Demand	Anodyne	CCR8	82	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872265256	GE	On-Demand	Anodyne	SFRP1	144	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872265256	GE	On-Demand	Anodyne	WNT3	100	42
CCn1c(CN2CCN(C)c3ncccc3C2)nc2ccccc21	ZINC000872265290	DF	On-Demand	Anodyne	GRM2	23	53
Cc1cccc(C(=O)NNC(=O)CN(C)[C@H]2CCCCN(C)C2=O)c1	ZINC000872265301	EC	On-Demand	Reactive	KCNK3	51	35
Cc1cccc(C(=O)NNC(=O)CN(C)[C@@H]2CCCCN(C)C2=O)c1	ZINC000872265303	EC	On-Demand	Reactive	KCNK3	51	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000872265310	DD	On-Demand	Anodyne	SSTR3	18	44
COc1ccccc1[C@@H](O)CNC(=O)[C@]12CCC[C@H]1CNC2	ZINC000872265315	DD	On-Demand	Anodyne	MBTPS1	53	35
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](C(F)F)CC1	ZINC000872265317	EF	On-Demand	Bother	L3MBTL3	53	47
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCO[C@H](C(F)F)CC1	ZINC000872265318	EF	On-Demand	Bother	L3MBTL3	53	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000872265326	ED	On-Demand	Anodyne	L3MBTL3	87	45
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872265346	ED	On-Demand	Anodyne	SLC9A1	44	31
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872265346	ED	On-Demand	Anodyne	L3MBTL3	51	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872265347	FE	On-Demand	Anodyne	GRIN2B	34	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872265347	FE	On-Demand	Anodyne	HRH4	35	58
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872265347	FE	On-Demand	Anodyne	CYP51A1	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872265347	FE	On-Demand	Anodyne	AKR1C3	22	55
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)C1	ZINC000872265348	EG	On-Demand	Anodyne	AVPR2	27	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)C1	ZINC000872265348	EG	On-Demand	Anodyne	PRNP	57	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)C1	ZINC000872265348	EG	On-Demand	Anodyne	KDM1A	15	50
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)C1	ZINC000872265348	EG	On-Demand	Anodyne	NOD2	42	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)C1	ZINC000872265348	EG	On-Demand	Anodyne	KCNK3	58	38
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872265364	FD	On-Demand	Anodyne	LRRK2	33	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872265418	GG	On-Demand	Anodyne	CCR3	88	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872265419	GG	On-Demand	Anodyne	CCR3	88	47
COC(=O)Nc1ccc(C(=O)N2C[C@]3(C)CNC[C@]3(C)C2)cc1	ZINC000872265420	DD	On-Demand	Anodyne	EPHX2	16	42
COC(=O)Nc1ccc(C(=O)N2C[C@]3(C)CNC[C@]3(C)C2)cc1	ZINC000872265420	DD	On-Demand	Anodyne	ACR	48	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000872265425	EG	On-Demand	Anodyne	KCNK3	94	57
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000872265425	EG	On-Demand	Anodyne	KCNK9	45	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000872265474	FG	On-Demand	Anodyne	AKT2	42	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000872265475	FE	On-Demand	Anodyne	EPHX2	25	46
C[C@@]12CNC[C@]1(C)CN(C(=O)c1c(F)ccc(S(=O)(=O)NC3CC3)c1F)C2	ZINC000872265479	GD	On-Demand	Anodyne	CCR8	74	32
C[C@@]12CNC[C@]1(C)CN(C(=O)c1c(F)ccc(S(=O)(=O)NC3CC3)c1F)C2	ZINC000872265479	GD	On-Demand	Anodyne	SFRP1	68	33
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(F)c(S(=O)(=O)NC3CC3)c1)C2	ZINC000872265491	GD	On-Demand	Anodyne	CCR8	66	32
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(F)c(S(=O)(=O)NC3CC3)c1)C2	ZINC000872265491	GD	On-Demand	Anodyne	SFRP1	115	41
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(F)c(S(=O)(=O)NC3CC3)c1)C2	ZINC000872265491	GD	On-Demand	Anodyne	WNT3	71	34
Cc1cc(C)c2cc(C(=O)N3C[C@]4(C)CNC[C@]4(C)C3)[nH]c2c1	ZINC000872265495	DF	On-Demand	Anodyne	HRH4	20	40
O=C(Cc1csc(C2CCCC2)n1)N1CCO[C@@H](C(F)F)CC1	ZINC000872265499	EG	On-Demand	Anodyne	ETHR	50	38
O=C(Cc1csc(C2CCCC2)n1)N1CCO[C@H](C(F)F)CC1	ZINC000872265500	EG	On-Demand	Anodyne	ETHR	50	38
Cc1ccc(N2CCCC2)c(C(=O)N2C[C@]3(C)CNC[C@]3(C)C2)c1	ZINC000872265502	EF	On-Demand	Anodyne	HCRTR1	42	38
C[C@@H](Cn1cncn1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265509	CC	On-Demand	Anodyne	HIS3	82	41
COc1ccccc1NC(=O)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872265517	FF	On-Demand	Anodyne	STK17B	41	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000872265535	EF	On-Demand	Anodyne	KCNA3	46	38
COc1cc(C)c(CN2CCN(C)c3ncccc3C2)cc1OC	ZINC000872265536	EF	On-Demand	Anodyne	ADRA2C	15	45
CC(=O)Nc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265571	DE	On-Demand	Anodyne	TRPV1	15	45
CC(=O)Nc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265571	DE	On-Demand	Anodyne	P2RY1	15	41
CC(=O)Nc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265571	DE	On-Demand	Anodyne	FAAH	15	40
CC(=O)Nc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265571	DE	On-Demand	Anodyne	NOD1	20	46
CC(=O)Nc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265571	DE	On-Demand	Anodyne	NOD2	54	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccn(Cc2ccccc2)n1	ZINC000872265587	DF	On-Demand	Anodyne	SIGMAR1	17	45
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1)C2	ZINC000872265591	GE	On-Demand	Anodyne	AKR1C3	49	35
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	HTR1A	17	48
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	HTR1D	25	48
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	HTR1B	21	43
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	FAAH	24	40
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	P2RY14	42	32
CC(=O)Nc1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872265629	DE	On-Demand	Anodyne	NOD2	42	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)NCCc1ccccc1	ZINC000872265644	DD	On-Demand	Anodyne	CA5B	16	42
C[C@@]12CNC[C@]1(C)CN(C(=O)CCc1ccc(Cl)c(Cl)c1)C2	ZINC000872265647	EG	On-Demand	Anodyne	OPRK1	23	40
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265694	DD	On-Demand	Anodyne	ACE	26	56
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265694	DD	On-Demand	Anodyne	CELA1	43	42
Cc1nn(CC(=O)N2C[C@]3(C)CNC[C@]3(C)C2)c(C)c1Cl	ZINC000872265704	DD	On-Demand	Anodyne	CCR1	20	46
CN(C)CCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265721	EE	On-Demand	Anodyne	LTA4H	50	45
CN(C)CCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265721	EE	On-Demand	Anodyne	HRH3	32	55
CN(C)CCOc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872265721	EE	On-Demand	Anodyne	ESRRG	46	35
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	ACE	72	40
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	MME	107	40
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	CPA1	49	37
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	ACE2	75	37
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	GAG-PRO	51	31
C[C@@H](Cc1ccccc1)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872265723	CE	On-Demand	Anodyne	Q82323_9DELA	73	31
COc1ccc2c(C)c(CCC(=O)N3C[C@]4(C)CNC[C@]4(C)C3)c(=O)oc2c1	ZINC000872265744	GF	On-Demand	Anodyne	MAOB	36	48
COc1ccc2c(C)c(CCC(=O)N3C[C@]4(C)CNC[C@]4(C)C3)c(=O)oc2c1	ZINC000872265744	GF	On-Demand	Anodyne	NQO1	37	47
COCCOc1ccc(F)cc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872265753	DD	On-Demand	Anodyne	SLC9A1	46	33
C[C@@H](Cc1nc2ccccc2s1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265755	EG	On-Demand	Anodyne	TRY1_BOVIN	45	37
C[C@@H](Cc1nc2ccccc2s1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265755	EG	On-Demand	Anodyne	TPSAB1	16	40
C[C@@H](Cc1nc2ccccc2s1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265755	EG	On-Demand	Anodyne	ST14	46	33
C[C@@H](Cc1nc2ccccc2s1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872265755	EG	On-Demand	Anodyne	TMPRSS6	64	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872265761	FF	On-Demand	Anodyne	EPHX2	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F	ZINC000872265764	EE	On-Demand	Anodyne	AMY2	47	32
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F	ZINC000872265765	EE	On-Demand	Anodyne	AMY2	47	32
C[C@H](O)c1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872265794	CE	On-Demand	Anodyne	F2	21	41
NS(=O)(=O)c1cccc(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872265813	CC	On-Demand	Anodyne	CA2	26	42
NS(=O)(=O)c1cccc(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872265813	CC	On-Demand	Anodyne	CA1	22	42
NS(=O)(=O)c1cccc(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872265813	CC	On-Demand	Anodyne	CA5A	40	33
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872265830	EF	On-Demand	Anodyne	DRD2	17	44
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872265830	EF	On-Demand	Anodyne	DRD4	22	41
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872265830	EF	On-Demand	Anodyne	DRD3	16	42
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872265830	EF	On-Demand	Anodyne	SIGMAR1	18	44
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC	ZINC000872265830	EF	On-Demand	Anodyne	SSTR5	77	49
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)C1	ZINC000872265833	EF	On-Demand	Anodyne	EPHX2	17	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)C1	ZINC000872265833	EF	On-Demand	Anodyne	L3MBTL3	72	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccsc2)CC1	ZINC000872265845	EE	On-Demand	Anodyne	L3MBTL3	47	36
CN1CCCC[C@H](N(C)C[C@H](O)c2cccnc2)C1=O	ZINC000872265929	CD	On-Demand	Anodyne	ADRB3	31	40
CN1CCCC[C@@H](N(C)C[C@H](O)c2cccnc2)C1=O	ZINC000872265930	CD	On-Demand	Anodyne	ADRB3	31	40
CN1CCCC[C@H](N(C)C[C@@H](O)c2cccnc2)C1=O	ZINC000872265931	CD	On-Demand	Anodyne	ADRB3	31	40
CN1CCCC[C@@H](N(C)C[C@@H](O)c2cccnc2)C1=O	ZINC000872265932	CD	On-Demand	Anodyne	ADRB3	31	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2c(F)cccc2F)CC1	ZINC000872265959	FE	On-Demand	Anodyne	L3MBTL3	66	38
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA2	122	45
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA6	22	40
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA1	106	45
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA7	77	44
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA13	34	41
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA5B	54	43
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA4	81	44
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA5A	57	43
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA14	50	40
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA12	82	45
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CA9	93	45
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CAH_METTE	41	41
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	CYNT	41	44
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	NCE103	28	44
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	P96878_MYCTU	47	37
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(S(N)(=O)=O)cc1)C2	ZINC000872265960	EC	On-Demand	Anodyne	A6YCJ1_9METZ	29	41
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)C2	ZINC000872265978	FD	On-Demand	Anodyne	PREP	50	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)C2	ZINC000872265978	FD	On-Demand	Anodyne	WNT3	42	35
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)C2	ZINC000872265979	FD	On-Demand	Anodyne	PREP	50	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)C2	ZINC000872265979	FD	On-Demand	Anodyne	WNT3	42	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000872265987	DD	On-Demand	Anodyne	LNPEP	41	35
Cc1ccc(CNC(=O)C2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872265998	FF	On-Demand	Anodyne	EPHX2	34	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)C1	ZINC000872266006	FF	On-Demand	Anodyne	AVPR2	135	54
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)C1	ZINC000872266006	FF	On-Demand	Anodyne	AVPR1A	75	54
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000872266021	EG	On-Demand	Anodyne	CPT1A	19	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000872266024	ED	On-Demand	Anodyne	PREP	30	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000872266024	ED	On-Demand	Anodyne	L3MBTL3	69	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	ZINC000872266038	GI	On-Demand	Anodyne	GRM4	26	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872266050	FE	On-Demand	Anodyne	CCR3	56	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872266050	FE	On-Demand	Anodyne	EPHX2	51	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872266059	FE	On-Demand	Anodyne	CCR3	56	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872266059	FE	On-Demand	Anodyne	EPHX2	51	46
CN(CC(=O)N1C[C@]2(C)CNC[C@]2(C)C1)C1=NS(=O)(=O)c2ccccc21	ZINC000872266061	GC	On-Demand	Anodyne	KCNA3	35	40
CN1CCCC[C@@H](N(C)CC[C@H](O)c2ccccc2)C1=O	ZINC000872266079	CE	On-Demand	Anodyne	OPRK1	28	42
CN1CCCC[C@@H](N(C)CC[C@H](O)c2ccccc2)C1=O	ZINC000872266079	CE	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
CN1CCCC[C@H](N(C)CC[C@H](O)c2ccccc2)C1=O	ZINC000872266080	CE	On-Demand	Anodyne	OPRK1	28	42
CN1CCCC[C@H](N(C)CC[C@H](O)c2ccccc2)C1=O	ZINC000872266080	CE	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
CN1CCCC[C@@H](N(C)CC[C@@H](O)c2ccccc2)C1=O	ZINC000872266081	CE	On-Demand	Anodyne	OPRK1	28	42
CN1CCCC[C@@H](N(C)CC[C@@H](O)c2ccccc2)C1=O	ZINC000872266081	CE	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
CN1CCCC[C@H](N(C)CC[C@@H](O)c2ccccc2)C1=O	ZINC000872266082	CE	On-Demand	Anodyne	OPRK1	28	42
CN1CCCC[C@H](N(C)CC[C@@H](O)c2ccccc2)C1=O	ZINC000872266082	CE	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
CN1CCCC[C@H](N(C)C[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000872266086	GD	On-Demand	Anodyne	GPR119	34	41
CN1CCCC[C@@H](N(C)C[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000872266087	GD	On-Demand	Anodyne	GPR119	34	41
CN1CCCC[C@H](N(C)C[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000872266089	GD	On-Demand	Anodyne	GPR119	34	41
CN1CCCC[C@@H](N(C)C[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000872266090	GD	On-Demand	Anodyne	GPR119	34	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	ZINC000872266098	FF	On-Demand	Anodyne	NPY2R	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	ZINC000872266098	FF	On-Demand	Anodyne	EPHX2	21	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	ZINC000872266098	FF	On-Demand	Anodyne	L3MBTL3	51	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872266100	GG	On-Demand	Anodyne	GRM5	26	67
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872266100	GG	On-Demand	Anodyne	ETHR	58	52
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872266101	GG	On-Demand	Anodyne	GRM5	26	67
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872266101	GG	On-Demand	Anodyne	ETHR	58	52
COc1ccc(Cn2cc(CN3C[C@H]4COC[C@H]4C3)nn2)cc1	ZINC000872266139	DD	On-Demand	Anodyne	FIMH	17	49
CN1CCCC[C@@H](N(C)C[C@@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266145	DC	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@@H](N(C)C[C@@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266145	DC	On-Demand	Anodyne	CYP2J2	47	33
CN1CCCC[C@@H](N(C)C[C@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266146	DC	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@@H](N(C)C[C@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266146	DC	On-Demand	Anodyne	CYP2J2	47	33
CN1CCCC[C@H](N(C)C[C@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266147	DC	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@H](N(C)C[C@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266147	DC	On-Demand	Anodyne	CYP2J2	47	33
CN1CCCC[C@H](N(C)C[C@@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266148	DC	On-Demand	Anodyne	AMY2	49	34
CN1CCCC[C@H](N(C)C[C@@](O)(C(N)=O)c2ccccc2)C1=O	ZINC000872266148	DC	On-Demand	Anodyne	CYP2J2	47	33
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C(=O)c3cccnc3)CC1)C2	ZINC000872266164	FD	On-Demand	Anodyne	SLC18A3	17	48
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C(=O)c3cccnc3)CC1)C2	ZINC000872266164	FD	On-Demand	Anodyne	L3MBTL3	76	37
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C(=O)c3cccnc3)CC1)C2	ZINC000872266164	FD	On-Demand	Anodyne	NAMPT	15	40
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872266208	EE	On-Demand	Anodyne	F3	84	36
c1ccc(N2CCCCC2)c(CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872266226	CF	On-Demand	Anodyne	KCNQ2	60	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCOCCc1ccccc1	ZINC000872266237	DF	On-Demand	Anodyne	FKBP1A	35	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCOCCc1ccccc1	ZINC000872266237	DF	On-Demand	Anodyne	AMY2	44	31
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3ccccn3)nc3ccccc13)C2	ZINC000872266248	FG	On-Demand	Anodyne	METAP1	52	43
CCOC(=O)N[C@H](C(=O)N1C[C@]2(C)CNC[C@]2(C)C1)C(C)C	ZINC000872266255	DD	On-Demand	Anodyne	CCR1	46	37
COC(=O)N[C@@H](C(=O)N1C[C@]2(C)CNC[C@]2(C)C1)C(C)C	ZINC000872266256	CC	On-Demand	Anodyne	CCR1	50	35
COC(=O)N[C@H](C(=O)N1C[C@]2(C)CNC[C@]2(C)C1)C(C)C	ZINC000872266257	CC	On-Demand	Anodyne	CCR1	50	35
CCOC(=O)N[C@@H](C(=O)N1C[C@]2(C)CNC[C@]2(C)C1)C(C)C	ZINC000872266260	DD	On-Demand	Anodyne	CCR1	46	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)C1	ZINC000872266263	GI	On-Demand	Anodyne	EPHX2	27	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)C1	ZINC000872266263	GI	On-Demand	Anodyne	MTCA1	23	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)C1	ZINC000872266263	GI	On-Demand	Anodyne	P96878_MYCTU	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CO	ZINC000872266272	CD	On-Demand	Anodyne	LNPEP	49	40
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	FKBP1A	43	41
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	CPT1A	22	40
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	CPT2	47	39
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	PREP	110	67
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	SFRP1	51	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	WNT3	56	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266276	FE	On-Demand	Anodyne	L3MBTL3	54	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000872266278	EG	On-Demand	Anodyne	CCR3	40	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000872266278	EG	On-Demand	Anodyne	EPHX2	23	41
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	FKBP1A	43	41
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	CPT1A	22	40
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	CPT2	47	39
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	PREP	110	67
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	SFRP1	51	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	WNT3	56	43
C[C@@]12CNC[C@]1(C)CN(C(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C2	ZINC000872266279	FE	On-Demand	Anodyne	L3MBTL3	54	34
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(CN3CCCCC3=O)cc1)C2	ZINC000872266280	FE	On-Demand	Anodyne	L3MBTL3	45	39
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ncn(Cc2ccccc2)n1	ZINC000872266301	DE	On-Demand	Anodyne	SIGMAR1	16	44
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1)C2	ZINC000872266340	GF	On-Demand	Anodyne	ACR	50	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2NC(=O)c2cccs2)C1	ZINC000872266363	EG	On-Demand	Anodyne	STK33	24	40
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(OCc3ccccc3)ccn1)C2	ZINC000872266372	FF	On-Demand	Anodyne	MAOB	22	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872266394	GE	On-Demand	Anodyne	F2	24	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872266394	GE	On-Demand	Anodyne	EPHX2	36	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872266394	GE	On-Demand	Anodyne	AKR1C3	51	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872266394	GE	On-Demand	Anodyne	NAMPT	51	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872266394	GE	On-Demand	Anodyne	TMPRSS11D	53	34
c1cc(N2CCOCC2)ccc1CN1C[C@H]2COC[C@H]2C1	ZINC000872266396	CD	On-Demand	Clean	L3MBTL3	31	41
CCCNC(=O)c1ccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1Cl	ZINC000872266400	EF	On-Demand	Anodyne	SLC6A9	55	37
CCOc1cccc([C@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872266411	DG	On-Demand	Anodyne	PDS	26	42
CCOc1cccc([C@@H](C)NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872266413	DG	On-Demand	Anodyne	PDS	26	42
O=C(c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1)N1CCCC1	ZINC000872266421	DE	On-Demand	Anodyne	HRH3	30	52
O=C(c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1)N1CCCC1	ZINC000872266421	DE	On-Demand	Anodyne	LSS	15	45
O=C(c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1)N1CCCC1	ZINC000872266421	DE	On-Demand	Anodyne	MLYCD	18	40
O=C(c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1)N1CCCC1	ZINC000872266421	DE	On-Demand	Anodyne	L3MBTL3	97	57
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(OCCc2ccccc2)CC1	ZINC000872266424	EG	On-Demand	Anodyne	GRIN2B	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(OCCc2ccccc2)CC1	ZINC000872266424	EG	On-Demand	Anodyne	PREP	65	41
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(S(=O)(=O)N3CCCC3)o1)C2	ZINC000872266431	FD	On-Demand	Anodyne	LPL	46	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000872266456	FF	On-Demand	Anodyne	PREP	41	40
CCOC(=O)Nc1ccc(C(=O)N2C[C@]3(C)CNC[C@]3(C)C2)cc1	ZINC000872266460	EE	On-Demand	Anodyne	ACR	51	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872266461	EF	On-Demand	Anodyne	EPHX2	25	54
COC(=O)N[C@@H](CC(C)C)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872266462	DD	On-Demand	Anodyne	CAPN1	16	42
COC(=O)N[C@H](CC(C)C)C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872266463	DD	On-Demand	Anodyne	CAPN1	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266466	GG	On-Demand	Anodyne	GRM5	19	73
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266466	GG	On-Demand	Anodyne	SPHK1	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266466	GG	On-Demand	Anodyne	ETHR	57	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266467	GG	On-Demand	Anodyne	GRM5	19	73
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266467	GG	On-Demand	Anodyne	SPHK1	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872266467	GG	On-Demand	Anodyne	ETHR	57	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872266473	FF	On-Demand	Anodyne	PREP	38	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872266473	FF	On-Demand	Anodyne	DPP7	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872266473	FF	On-Demand	Anodyne	CACNA1I	60	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872266474	FF	On-Demand	Anodyne	PREP	38	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872266474	FF	On-Demand	Anodyne	DPP7	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872266474	FF	On-Demand	Anodyne	CACNA1I	60	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000872266493	FF	On-Demand	Anodyne	CCR3	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000872266493	FF	On-Demand	Anodyne	P2RY14	45	34
C#CCOc1ccc(CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872266494	CD	On-Demand	Mild	HRH3	16	40
Fc1ccc(CCN2C[C@H]3COC[C@H]3C2)c(Cl)c1	ZINC000872266497	CF	On-Demand	Anodyne	HTR2A	17	42
Fc1ccc(CCN2C[C@H]3COC[C@H]3C2)c(Cl)c1	ZINC000872266497	CF	On-Demand	Anodyne	P2RX7	51	42
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3ccncc3)nc3ccccc13)C2	ZINC000872266540	FG	On-Demand	Anodyne	PRS	51	45
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3ccncc3)nc3ccccc13)C2	ZINC000872266540	FG	On-Demand	Anodyne	TACR3	19	43
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3ccncc3)nc3ccccc13)C2	ZINC000872266540	FG	On-Demand	Anodyne	MT-CO2	52	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)C1	ZINC000872266564	EF	On-Demand	Anodyne	EPHX2	20	42
COC(=O)N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872266581	CD	On-Demand	Anodyne	EPHX2	19	44
Cc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)s1	ZINC000872266595	EE	On-Demand	Anodyne	L3MBTL3	36	42
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)c(OC)c1	ZINC000872266634	GD	On-Demand	Anodyne	OXTR	20	46
C[C@@]12CNC[C@]1(C)CN(C(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1)C2	ZINC000872266643	GF	On-Demand	Anodyne	ADAM12	24	41
C[C@@]12CNC[C@]1(C)CN(C(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1)C2	ZINC000872266645	GF	On-Demand	Anodyne	ADAM12	24	41
CC(C)(C)OC(=O)N1CCC(CN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872266670	DE	On-Demand	Anodyne	GPR119	40	42
COc1cc(CN2CCN(C)c3ncccc3C2)ccc1C#N	ZINC000872266675	DE	On-Demand	Mild	DRD4	18	40
COc1cc(CN2CCN(C)c3ncccc3C2)ccc1C#N	ZINC000872266675	DE	On-Demand	Mild	KCNJ1	30	47
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872266705	DE	On-Demand	Anodyne	HTR1A	25	42
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872266705	DE	On-Demand	Anodyne	DRD4	44	42
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872266705	DE	On-Demand	Anodyne	FAAH	29	43
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872266705	DE	On-Demand	Anodyne	ABCG2	28	44
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872266705	DE	On-Demand	Anodyne	NOD2	42	36
COc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC(=O)C1CC1	ZINC000872266709	FF	On-Demand	Anodyne	ACHE	22	45
COc1cc(CN2CCN(C)c3ncccc3C2)ccc1OC(=O)C1CC1	ZINC000872266709	FF	On-Demand	Anodyne	SSTR5	56	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872266719	EE	On-Demand	Anodyne	PLG	21	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872266719	EE	On-Demand	Anodyne	PLAU	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872266719	EE	On-Demand	Anodyne	ST14	24	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872266719	EE	On-Demand	Anodyne	TMPRSS11D	48	33
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1F	ZINC000872266754	EE	On-Demand	Anodyne	ABCC1	71	36
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1F	ZINC000872266754	EE	On-Demand	Anodyne	ABCG2	29	46
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1F	ZINC000872266754	EE	On-Demand	Anodyne	NOD2	41	35
COc1ccc(-n2cc(CN3CCN(C)c4ncccc4C3)cn2)cc1	ZINC000872266758	EF	On-Demand	Anodyne	DRD4	18	48
CN1CCCC[C@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266759	EC	On-Demand	Anodyne	CA2	44	40
CN1CCCC[C@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266759	EC	On-Demand	Anodyne	CA1	45	40
CN1CCCC[C@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266759	EC	On-Demand	Anodyne	CA7	28	40
CN1CCCC[C@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266759	EC	On-Demand	Anodyne	CA12	28	40
CN1CCCC[C@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266759	EC	On-Demand	Anodyne	CA9	37	40
CN1CCCC[C@@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266760	EC	On-Demand	Anodyne	CA2	44	40
CN1CCCC[C@@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266760	EC	On-Demand	Anodyne	CA1	45	40
CN1CCCC[C@@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266760	EC	On-Demand	Anodyne	CA7	28	40
CN1CCCC[C@@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266760	EC	On-Demand	Anodyne	CA12	28	40
CN1CCCC[C@@H](N(C)CCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000872266760	EC	On-Demand	Anodyne	CA9	37	40
COc1ccccc1-n1nccc1CN1CCN(C)c2ncccc2C1	ZINC000872266761	EF	On-Demand	Anodyne	HTR1A	64	38
COc1ccccc1-n1nccc1CN1CCN(C)c2ncccc2C1	ZINC000872266761	EF	On-Demand	Anodyne	DRD2	45	42
COc1ccccc1-n1nccc1CN1CCN(C)c2ncccc2C1	ZINC000872266761	EF	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1-n1nccc1CN1CCN(C)c2ncccc2C1	ZINC000872266761	EF	On-Demand	Anodyne	DRD3	48	42
COc1ccccc1-n1nccc1CN1CCN(C)c2ncccc2C1	ZINC000872266761	EF	On-Demand	Anodyne	HTR7	39	42
CN1CCCC[C@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266762	DE	On-Demand	Anodyne	FKBP1A	41	41
CN1CCCC[C@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266762	DE	On-Demand	Anodyne	PREP	41	40
CN1CCCC[C@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266762	DE	On-Demand	Anodyne	AMY2	45	32
CN1CCCC[C@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266762	DE	On-Demand	Anodyne	SLC12A5	68	38
CN1CCCC[C@@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266763	DE	On-Demand	Anodyne	FKBP1A	41	41
CN1CCCC[C@@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266763	DE	On-Demand	Anodyne	PREP	41	40
CN1CCCC[C@@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266763	DE	On-Demand	Anodyne	AMY2	45	32
CN1CCCC[C@@H](N(C)CCC(=O)OCc2ccccc2)C1=O	ZINC000872266763	DE	On-Demand	Anodyne	SLC12A5	68	38
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(N3CCCS3(=O)=O)cc1Cl)C2	ZINC000872266783	GD	On-Demand	Anodyne	CDK1	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872266794	GD	On-Demand	Anodyne	TGM2	61	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872266794	GD	On-Demand	Anodyne	F13A1	76	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872266794	GD	On-Demand	Anodyne	AKR1C3	40	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872266794	GD	On-Demand	Anodyne	SFRP1	66	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872266794	GD	On-Demand	Anodyne	WNT3	53	32
CC(C)(C)OC(=O)N1CCC(CCN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872266799	DF	On-Demand	Anodyne	GPR119	46	44
c1ccc2nc(N3CCOCC3)c(CN3C[C@H]4COC[C@H]4C3)cc2c1	ZINC000872266819	EE	On-Demand	Anodyne	PIK3CA	40	39
c1ccc2nc(N3CCOCC3)c(CN3C[C@H]4COC[C@H]4C3)cc2c1	ZINC000872266819	EE	On-Demand	Anodyne	PIK3CD	59	39
C#CCCOc1ccc(CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872266821	CE	On-Demand	Mild	HRH3	23	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)C1	ZINC000872266823	DE	On-Demand	Anodyne	CPT1A	40	48
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCC[C@@H]2c2noc(C3CC3)n2)C1	ZINC000872266824	DE	On-Demand	Anodyne	CPT1A	40	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCCc2ccccc21	ZINC000872266833	ED	On-Demand	Anodyne	AVPR2	37	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000872266836	DG	On-Demand	Anodyne	LTA4H	36	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000872266836	DG	On-Demand	Anodyne	ADAM17	21	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000872266836	DG	On-Demand	Anodyne	EPHX2	29	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000872266836	DG	On-Demand	Anodyne	FFAR1	40	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000872266845	FG	On-Demand	Anodyne	TRY1_BOVIN	42	40
C[C@@]12CNC[C@]1(C)CN(C(=O)c1ccc(-n3cnc4ccccc43)nc1)C2	ZINC000872266893	FE	On-Demand	Anodyne	HPGD	47	39
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	ZINC000872266899	ED	On-Demand	Anodyne	SLC6A9	44	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1	ZINC000872266915	FG	On-Demand	Anodyne	PRCP	44	32
COc1cc(F)c(CN2CCN(C)c3ncccc3C2)cc1OC	ZINC000872266929	EF	On-Demand	Anodyne	ADRA2C	15	45
CN(C)S(=O)(=O)c1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266951	FD	On-Demand	Anodyne	TMPRSS11D	40	33
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1O	ZINC000872266955	DF	On-Demand	Anodyne	SSTR5	80	51
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	HRH2	23	40
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	SCNN1A	36	46
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	MMP13	16	41
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	CTSK	15	46
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	IKBKE	47	42
COc1ccc(OCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872266999	DE	On-Demand	Anodyne	TBK1	35	42
C[C@H]1CN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)C[C@H](C)O1	ZINC000872267005	GE	On-Demand	Anodyne	PROC	43	32
C[C@H]1CN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)C[C@H](C)O1	ZINC000872267005	GE	On-Demand	Anodyne	TMPRSS11D	53	33
C[C@H]1CN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)C[C@@H](C)O1	ZINC000872267006	GE	On-Demand	Anodyne	PROC	43	32
C[C@H]1CN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)C[C@@H](C)O1	ZINC000872267006	GE	On-Demand	Anodyne	TMPRSS11D	53	33
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267040	EF	On-Demand	Anodyne	KCNK3	43	42
Cc1noc(C2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)n1	ZINC000872267042	DD	On-Demand	Anodyne	ETHR	55	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(COc2ccccc2)CC1	ZINC000872267043	EG	On-Demand	Anodyne	GRIN2B	38	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(COc2ccccc2)CC1	ZINC000872267043	EG	On-Demand	Anodyne	SIGMAR1	17	51
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(COc2ccccc2)CC1	ZINC000872267043	EG	On-Demand	Anodyne	CPT1A	75	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(COc2ccccc2)CC1	ZINC000872267043	EG	On-Demand	Anodyne	CPT2	47	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(COc2ccccc2)CC1	ZINC000872267043	EG	On-Demand	Anodyne	CHRNA10	42	39
CC(=O)[C@](C#N)(CCN(C)[C@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000872267053	EE	On-Demand	Mild	AMY2	47	32
CC(=O)[C@@](C#N)(CCN(C)[C@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000872267054	EE	On-Demand	Mild	AMY2	47	32
CC(=O)[C@@](C#N)(CCN(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000872267055	EE	On-Demand	Mild	AMY2	47	32
CC(=O)[C@](C#N)(CCN(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000872267056	EE	On-Demand	Mild	AMY2	47	32
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872267060	GF	On-Demand	Anodyne	MLYCD	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872267060	GF	On-Demand	Anodyne	L3MBTL3	74	43
COCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1F	ZINC000872267071	DF	On-Demand	Anodyne	MET	56	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccc(F)cc1	ZINC000872267072	DD	On-Demand	Anodyne	ADRB2	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccc(F)cc1	ZINC000872267072	DD	On-Demand	Anodyne	ADRB1	45	48
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872267073	DD	On-Demand	Anodyne	ADRB2	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccc(F)cc1	ZINC000872267073	DD	On-Demand	Anodyne	ADRB1	45	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000872267082	FF	On-Demand	Anodyne	EPHX2	37	59
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C3CC3)CC1)C2	ZINC000872267106	CD	On-Demand	Anodyne	L3MBTL3	64	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000872267122	GF	On-Demand	Anodyne	CCR3	47	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000872267122	GF	On-Demand	Anodyne	EPHX2	61	53
CCOC(=O)CCCCCCNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872267146	DF	On-Demand	Anodyne	EPHX2	16	48
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1O	ZINC000872267160	EE	On-Demand	Anodyne	HTR1A	23	40
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1O	ZINC000872267160	EE	On-Demand	Anodyne	DRD2	25	40
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1O	ZINC000872267160	EE	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1O	ZINC000872267160	EE	On-Demand	Anodyne	DRD3	23	40
COc1cc(CN2CCN(C)c3ncccc3C2)cc(OC)c1O	ZINC000872267160	EE	On-Demand	Anodyne	ABCB1	25	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000872267195	FE	On-Demand	Anodyne	LNPEP	46	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000872267195	FE	On-Demand	Anodyne	TMPRSS11D	45	33
COc1cc(CN2C[C@H]3COC[C@H]3C2)ccc1OC(=O)C1CC1	ZINC000872267226	DE	On-Demand	Anodyne	S1PR5	20	43
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872267229	EF	On-Demand	Anodyne	MAPK14	41	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)C1	ZINC000872267234	EE	On-Demand	Anodyne	P2RY14	45	34
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3cccnc3)nc3ccccc13)C2	ZINC000872267253	FG	On-Demand	Anodyne	PRS	25	41
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3cccnc3)nc3ccccc13)C2	ZINC000872267253	FG	On-Demand	Anodyne	TACR3	19	42
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(-c3cccnc3)nc3ccccc13)C2	ZINC000872267253	FG	On-Demand	Anodyne	MT-CO2	48	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000872267273	ED	On-Demand	Anodyne	TMPRSS11D	67	35
Oc1cc(OCc2ccccc2)ccc1CN1C[C@H]2COC[C@H]2C1	ZINC000872267289	EG	On-Demand	Clean	MAOB	35	40
CN1CCCC[C@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267301	DD	On-Demand	Anodyne	FKBP1A	43	38
CN1CCCC[C@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267301	DD	On-Demand	Anodyne	SLC6A1	45	33
CN1CCCC[C@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267301	DD	On-Demand	Anodyne	SIGMAR1	16	41
CN1CCCC[C@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267301	DD	On-Demand	Anodyne	AMY2	48	33
CN1CCCC[C@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267301	DD	On-Demand	Anodyne	SLC12A5	46	35
CN1CCCC[C@@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267302	DD	On-Demand	Anodyne	FKBP1A	43	38
CN1CCCC[C@@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267302	DD	On-Demand	Anodyne	SLC6A1	45	33
CN1CCCC[C@@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267302	DD	On-Demand	Anodyne	SIGMAR1	16	41
CN1CCCC[C@@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267302	DD	On-Demand	Anodyne	AMY2	48	33
CN1CCCC[C@@H](N(C)CCOC(=O)Cc2ccccc2)C1=O	ZINC000872267302	DD	On-Demand	Anodyne	SLC12A5	46	35
CCOc1cc(CN2CCN(C)c3ncccc3C2)cc(Cl)c1O	ZINC000872267305	EG	On-Demand	Anodyne	SSTR5	56	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	F2	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	GRIN2B	24	47
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	SIGMAR1	19	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	C3AR1	55	54
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	PREP	41	37
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	EPHX2	34	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872267333	FF	On-Demand	Anodyne	CCR8	54	39
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	DRD2	24	46
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	DRD4	51	38
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	SIGMAR1	19	46
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	FAAH	20	40
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	ABCG2	31	48
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	NOD1	19	45
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872267355	DE	On-Demand	Anodyne	NOD2	52	45
COc1cccc(OC)c1CN1CCN(C)c2ncccc2C1	ZINC000872267356	DF	On-Demand	Anodyne	HTR1A	41	40
COc1cccc(OC)c1CN1CCN(C)c2ncccc2C1	ZINC000872267356	DF	On-Demand	Anodyne	DRD2	32	40
COc1cccc(OC)c1CN1CCN(C)c2ncccc2C1	ZINC000872267356	DF	On-Demand	Anodyne	DRD4	30	40
COc1cccc(OC)c1CN1CCN(C)c2ncccc2C1	ZINC000872267356	DF	On-Demand	Anodyne	DRD3	27	40
c1cc(N2CCCCC2)ccc1CN1C[C@H]2COC[C@H]2C1	ZINC000872267406	CF	On-Demand	Clean	HRH3	21	42
c1cc(N2CCCCC2)ccc1CN1C[C@H]2COC[C@H]2C1	ZINC000872267406	CF	On-Demand	Clean	L3MBTL3	40	40
COc1ccc2c(c1)CN(C(=O)[C@@H]1CCCCC[C@@H]1N)CC2	ZINC000872267414	DE	On-Demand	Anodyne	MTNR1B	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872267429	FF	On-Demand	Anodyne	EPHX2	58	49
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872267429	FF	On-Demand	Anodyne	CXCR3	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872267429	FF	On-Demand	Anodyne	SFRP1	58	35
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872267429	FF	On-Demand	Anodyne	WNT3	53	35
c1cn(-c2ccc(CN3C[C@H]4COC[C@H]4C3)cn2)cn1	ZINC000872267437	CD	On-Demand	Anodyne	NOS2	40	32
C[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)Oc1ccccc1	ZINC000872267451	CE	On-Demand	Anodyne	AMY2	46	31
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1Cl	ZINC000872267481	EF	On-Demand	Anodyne	DRD4	39	40
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1Cl	ZINC000872267481	EF	On-Demand	Anodyne	ABCG2	30	48
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1Cl	ZINC000872267481	EF	On-Demand	Anodyne	NOD2	43	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872267497	FG	On-Demand	Anodyne	PRCP	46	33
COc1ccc(CN(C)[C@H]2CCCCN(C)C2=O)cc1	ZINC000872267514	CE	On-Demand	Anodyne	SLC18A2	15	40
COc1ccc(CN(C)[C@H]2CCCCN(C)C2=O)cc1	ZINC000872267514	CE	On-Demand	Anodyne	SIGMAR1	20	46
COc1ccc(CN(C)[C@@H]2CCCCN(C)C2=O)cc1	ZINC000872267515	CE	On-Demand	Anodyne	SLC18A2	15	40
COc1ccc(CN(C)[C@@H]2CCCCN(C)C2=O)cc1	ZINC000872267515	CE	On-Demand	Anodyne	SIGMAR1	20	46
C[C@@]12CNC[C@]1(C)CN(C(=O)Cc1ccc(Cl)c(F)c1)C2	ZINC000872267529	DE	On-Demand	Anodyne	ENV	40	38
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	ESR1	16	41
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	LTA4H	65	47
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	HRH3	40	40
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	HTR5A	20	42
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	PSMB2	40	37
COc1ccc(OCCN2CCN(C)c3ncccc3C2)cc1	ZINC000872267553	DE	On-Demand	Anodyne	PSMB1	43	38
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)o1	ZINC000872267600	DD	On-Demand	Anodyne	NOD2	40	34
CN1CCCC[C@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267642	DD	On-Demand	Anodyne	FKBP1A	39	42
CN1CCCC[C@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267642	DD	On-Demand	Anodyne	PREP	37	41
CN1CCCC[C@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267642	DD	On-Demand	Anodyne	SLC12A5	63	40
CN1CCCC[C@@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267643	DD	On-Demand	Anodyne	FKBP1A	39	42
CN1CCCC[C@@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267643	DD	On-Demand	Anodyne	PREP	37	41
CN1CCCC[C@@H](N(C)CC(=O)NOCc2ccccc2)C1=O	ZINC000872267643	DD	On-Demand	Anodyne	SLC12A5	63	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc([N+](=O)[O-])cc1	ZINC000872267659	CE	On-Demand	Bother	SLC27A4	51	35
COc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267676	CE	On-Demand	Anodyne	DRD4	50	38
COc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267676	CE	On-Demand	Anodyne	MTNR1B	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000872267680	ED	On-Demand	Anodyne	DPP8	32	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCC(F)F)c1	ZINC000872267682	EF	On-Demand	Anodyne	PDS	80	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872267683	FG	On-Demand	Anodyne	CPT1A	46	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872267683	FG	On-Demand	Anodyne	GRM5	22	56
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872267683	FG	On-Demand	Anodyne	SMO	45	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872267683	FG	On-Demand	Anodyne	ETHR	73	56
O=C(Cc1ccccc1[N+](=O)[O-])N[C@]12CCC[C@H]1OCC2	ZINC000872267696	CD	On-Demand	Bother	COLA	81	33
NS(=O)(=O)c1cc(C(=O)N[C@]23CCC[C@H]2OCC3)ccc1Cl	ZINC000872267700	ED	On-Demand	Anodyne	CA6	17	44
NS(=O)(=O)c1cc(C(=O)N[C@]23CCC[C@H]2OCC3)ccc1Cl	ZINC000872267700	ED	On-Demand	Anodyne	CA13	28	44
CC(=O)c1ccc(OC[C@H](O)CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872267702	ED	On-Demand	Anodyne	ACOX1	72	33
CC(=O)c1ccc(OC[C@H](O)CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872267702	ED	On-Demand	Anodyne	ABCB1	63	43
CC(=O)c1ccc(OC[C@@H](O)CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872267703	ED	On-Demand	Anodyne	ACOX1	72	33
CC(=O)c1ccc(OC[C@@H](O)CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872267703	ED	On-Demand	Anodyne	ABCB1	63	43
CC(=O)c1ccc(OC[C@@H](O)CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872267704	ED	On-Demand	Anodyne	ACOX1	72	33
CC(=O)c1ccc(OC[C@@H](O)CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872267704	ED	On-Demand	Anodyne	ABCB1	63	43
CC(=O)c1ccc(OC[C@H](O)CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872267705	ED	On-Demand	Anodyne	ACOX1	72	33
CC(=O)c1ccc(OC[C@H](O)CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872267705	ED	On-Demand	Anodyne	ABCB1	63	43
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc3ccccc3oc1=O)C2	ZINC000872267706	DD	On-Demand	Anodyne	MAOB	15	53
COc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1OC	ZINC000872267716	CE	On-Demand	Anodyne	DRD2	19	41
COc1cc(N)c(Cl)cc1C(=O)N1C[C@]2(C)CNC[C@]2(C)C1	ZINC000872267732	DE	On-Demand	Anodyne	HTR4	114	53
CCc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872267753	CF	On-Demand	Anodyne	E3UJZ5_SPOLI	17	44
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(Cl)cc(Cl)c1	ZINC000872267757	DG	On-Demand	Anodyne	CACNA1I	54	34
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(S(C)(=O)=O)ccc1Cl)C2	ZINC000872267768	FD	On-Demand	Anodyne	SLC6A9	40	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C2	ZINC000872267769	DE	On-Demand	Bother	SLC27A4	48	31
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C2	ZINC000872267770	DE	On-Demand	Bother	SLC27A4	48	31
O=C(CNC(=O)c1cccc(Br)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267781	FE	On-Demand	Anodyne	CCR2	43	43
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cccc(NS(C)(=O)=O)c1)C2	ZINC000872267782	ED	On-Demand	Anodyne	NR3C2	18	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872267784	GE	On-Demand	Anodyne	TGM2	39	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000872267787	GF	On-Demand	Anodyne	CTSS	17	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000872267787	GF	On-Demand	Anodyne	LIMK2	35	40
Cc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267788	BE	On-Demand	Anodyne	KCNK3	59	42
Cc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267788	BE	On-Demand	Anodyne	KCNK9	46	42
O=C(/C=C\c1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872267792	CF	On-Demand	Anodyne	HDAC6	20	43
O=C(/C=C/c1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872267793	CF	On-Demand	Anodyne	HDAC6	20	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872267801	ED	On-Demand	Anodyne	EPHX2	22	46
COC(=O)CSCc1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267803	FF	On-Demand	Anodyne	QRFPR	22	43
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc(=O)c3ccccc3o1)C2	ZINC000872267804	DD	On-Demand	Anodyne	TNKS	29	44
C[C@@]12CNC[C@]1(C)CN(C(=O)COc1ccc3ccc(=O)oc3c1)C2	ZINC000872267816	ED	On-Demand	Anodyne	MAOA	41	43
C[C@@]12CNC[C@]1(C)CN(C(=O)COc1ccc3ccc(=O)oc3c1)C2	ZINC000872267816	ED	On-Demand	Anodyne	MAOB	25	45
O=C(COc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267832	EF	On-Demand	Anodyne	CCR2	42	33
O=C(COc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267832	EF	On-Demand	Anodyne	PDS	43	37
COc1cccc(C(=O)NCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267833	DD	On-Demand	Anodyne	DRD4	52	39
COc1cccc(C(=O)NCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267833	DD	On-Demand	Anodyne	CCR2	42	39
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	ZINC000872267847	GF	On-Demand	Anodyne	MAOA	15	54
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C2	ZINC000872267855	FF	On-Demand	Bother	SLC6A9	20	60
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872267866	GD	On-Demand	Anodyne	AKR1C3	58	41
O=C(CNC(=O)c1cccc(Cl)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267880	DD	On-Demand	Anodyne	CCR2	41	39
O=C(CNC(=O)c1cccc(Cl)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267880	DD	On-Demand	Anodyne	CACNA1I	39	42
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872267886	CD	On-Demand	Bother	SLC27A4	43	31
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872267886	CD	On-Demand	Bother	LUXR	25	49
CC(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267891	CE	On-Demand	Anodyne	KCNK3	85	37
CC(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872267891	CE	On-Demand	Anodyne	KCNK9	41	37
CCc1noc(-c2ccc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)n1	ZINC000872267896	FF	On-Demand	Anodyne	S1PR4	25	40
CCc1noc(-c2ccc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)n1	ZINC000872267896	FF	On-Demand	Anodyne	S1PR1	15	40
CCc1noc(-c2ccc(CCNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)n1	ZINC000872267896	FF	On-Demand	Anodyne	SPHK1	29	45
CCOc1ccccc1CCNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872267902	DF	On-Demand	Anodyne	MTNR1A	32	44
CCOc1ccccc1CCNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872267902	DF	On-Demand	Anodyne	HCN1	47	37
CCOc1ccccc1CCNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872267902	DF	On-Demand	Anodyne	HCN4	46	37
COc1ccccc1[C@@H]1CCCCN1C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872267910	DF	On-Demand	Anodyne	HTR1A	18	41
COc1ccccc1[C@H]1CCCCN1C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872267911	DF	On-Demand	Anodyne	HTR1A	18	41
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267939	EE	On-Demand	Anodyne	HRH2	44	43
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267939	EE	On-Demand	Anodyne	MTNR1A	33	45
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267939	EE	On-Demand	Anodyne	MTNR1B	29	45
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872267939	EE	On-Demand	Anodyne	EPHX2	23	45
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)C2	ZINC000872267953	FD	On-Demand	Bother	SLC6A9	21	64
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872267961	GD	On-Demand	Anodyne	CNR2	16	48
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000872267966	GE	On-Demand	Anodyne	CNR2	15	46
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(O)nc2ccccc12	ZINC000872267967	CE	On-Demand	Anodyne	TACR3	19	43
O=C(Cc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267976	DG	On-Demand	Anodyne	CCR2	66	36
O=C(Cc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872267976	DG	On-Demand	Anodyne	LUXR	27	44
O=C(N[C@]12CCC[C@H]1OCC2)c1cccnc1Cl	ZINC000872267989	CE	On-Demand	Anodyne	G2YM83_BOTF4	81	41
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1Cl	ZINC000872267994	DG	On-Demand	Anodyne	SLC6A9	51	41
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccn1	ZINC000872268000	BD	On-Demand	Anodyne	GRM4	51	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)Cc1ccccc1	ZINC000872268018	CD	On-Demand	Anodyne	MME	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)Cc1ccccc1	ZINC000872268019	CD	On-Demand	Anodyne	MME	41	36
O=C(Cc1ccc(Cl)c(Cl)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268023	DG	On-Demand	Anodyne	OPRK1	23	42
O=C(COc1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268040	CF	On-Demand	Anodyne	TRAR	33	49
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000872268083	GE	On-Demand	Anodyne	EPHX2	34	58
CC(=O)NCc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872268087	DE	On-Demand	Anodyne	TPSAB1	17	41
O=C(CNC(=O)c1ccccc1OC(F)F)N[C@]12CCC[C@H]1OCC2	ZINC000872268102	FD	On-Demand	Anodyne	HCN1	57	34
O=C(CNC(=O)c1ccccc1OC(F)F)N[C@]12CCC[C@H]1OCC2	ZINC000872268102	FD	On-Demand	Anodyne	HCN4	50	32
O=C(COc1ccc2ccc(=O)oc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268111	ED	On-Demand	Anodyne	MAOB	15	41
NS(=O)(=O)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268115	DC	On-Demand	Anodyne	CA2	49	46
NS(=O)(=O)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268115	DC	On-Demand	Anodyne	CA1	29	43
NS(=O)(=O)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268115	DC	On-Demand	Anodyne	CA4	21	43
NS(=O)(=O)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268115	DC	On-Demand	Anodyne	CA12	21	41
NS(=O)(=O)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268115	DC	On-Demand	Anodyne	CA9	27	44
CCCCC[C@@H](C)NC(=O)CN1CCO[C@@H](C(F)F)CC1	ZINC000872268138	DE	On-Demand	Anodyne	NOD1	46	32
CCCCC[C@@H](C)NC(=O)CN1CCO[C@H](C(F)F)CC1	ZINC000872268139	DE	On-Demand	Anodyne	NOD1	46	32
O=C(CCc1nc(O)c2ccccc2n1)N[C@]12CCC[C@H]1OCC2	ZINC000872268142	EE	On-Demand	Anodyne	TNKS	60	37
O=C(NNC(=O)[C@]12CCC[C@H]1OCC2)c1cc(Br)ccc1O	ZINC000872268143	FD	On-Demand	Reactive	PYK	70	32
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(COc2ccccc2)cc1	ZINC000872268148	EH	On-Demand	Anodyne	ADAM17	51	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(COc2ccccc2)cc1	ZINC000872268148	EH	On-Demand	Anodyne	SLC6A5	37	40
O=C(COc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268169	CD	On-Demand	Anodyne	CPT1A	69	34
O=C(COc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268169	CD	On-Demand	Anodyne	CPT2	44	33
O=C(Cc1ccc(Br)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268170	DF	On-Demand	Anodyne	LUXR	26	40
O=C(Cc1ccc(Br)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268170	DF	On-Demand	Anodyne	TRAR	30	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCO[C@H](c2cccc(F)c2)C1	ZINC000872268171	DF	On-Demand	Anodyne	CCR5	51	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCO[C@@H](c2cccc(F)c2)C1	ZINC000872268172	DF	On-Demand	Anodyne	CCR5	51	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000872268181	FE	On-Demand	Anodyne	PRCP	44	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000872268181	FE	On-Demand	Anodyne	L3MBTL3	46	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)C1	ZINC000872268200	DF	On-Demand	Anodyne	CCR3	45	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)C1	ZINC000872268201	DF	On-Demand	Anodyne	CCR3	45	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872268206	FD	On-Demand	Anodyne	TGM2	42	39
C[C@@]12CNC[C@]1(C)CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2	ZINC000872268209	FE	On-Demand	Bother	SLC6A9	22	59
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(OC(F)(F)F)cc1	ZINC000872268221	DG	On-Demand	Anodyne	EPHX2	40	39
O=C(COc1ccc(Br)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268226	EF	On-Demand	Anodyne	TRAR	44	50
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(C(F)(F)F)c1	ZINC000872268234	CG	On-Demand	Anodyne	CCR2	89	42
O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268242	FE	On-Demand	Anodyne	CCR2	76	41
CCOc1ccccc1OCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268245	DE	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1OCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268245	DE	On-Demand	Anodyne	HCN4	45	35
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000872268246	EF	On-Demand	Bother	TAAR1	25	47
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000872268250	GD	On-Demand	Anodyne	MERTK	29	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C\c1ccc3c(c1)OCO3)C2	ZINC000872268251	DD	On-Demand	Anodyne	ITGAL	20	43
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C\c1ccc3c(c1)OCO3)C2	ZINC000872268251	DD	On-Demand	Anodyne	DYRK1A	22	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C\c1ccc3c(c1)OCO3)C2	ZINC000872268251	DD	On-Demand	Anodyne	CLK1	36	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C\c1ccc3c(c1)OCO3)C2	ZINC000872268251	DD	On-Demand	Anodyne	DYRK2	74	38
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C/c1ccc3c(c1)OCO3)C2	ZINC000872268252	DD	On-Demand	Anodyne	ITGAL	20	43
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C/c1ccc3c(c1)OCO3)C2	ZINC000872268252	DD	On-Demand	Anodyne	DYRK1A	22	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C/c1ccc3c(c1)OCO3)C2	ZINC000872268252	DD	On-Demand	Anodyne	CLK1	36	40
C[C@@]12CNC[C@]1(C)CN(C(=O)/C=C/c1ccc3c(c1)OCO3)C2	ZINC000872268252	DD	On-Demand	Anodyne	DYRK2	74	38
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872268261	GD	On-Demand	Anodyne	TGM2	40	44
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872268261	GD	On-Demand	Anodyne	MERTK	31	43
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872268264	GE	On-Demand	Anodyne	AKR1C3	58	39
N#Cc1ccccc1OCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268266	CD	On-Demand	Mild	ADRB1	42	32
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C(=O)/C=C/c3ccccc3)CC1)C2	ZINC000872268267	GE	On-Demand	Anodyne	CCR2	17	42
C[C@@]12CNC[C@]1(C)CN(C(=O)C1CCN(C(=O)/C=C\c3ccccc3)CC1)C2	ZINC000872268268	GE	On-Demand	Anodyne	CCR2	17	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)C1	ZINC000872268272	DF	On-Demand	Anodyne	NPY2R	43	36
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)Nc2ccccc2)CC1	ZINC000872268291	FF	On-Demand	Anodyne	SMO	25	42
CCOc1ccc(S(=O)(=O)NCCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268307	GD	On-Demand	Anodyne	MMP13	15	42
CCCOc1ccc(OCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268318	DF	On-Demand	Anodyne	PLA2G4B	61	32
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000872268330	EE	On-Demand	Anodyne	PREP	18	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000872268330	EE	On-Demand	Anodyne	DPP8	17	42
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000872268344	GF	On-Demand	Anodyne	CTSS	21	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	ACHE	25	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	HTR1D	23	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	HTR1B	18	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	SSTR2	58	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MC4R	29	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	CCKAR	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	BCHE	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MPO	54	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	NMBR	57	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MC3R	56	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MC5R	46	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	SSTR3	21	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	CCKBR	41	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	GHSR	44	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MMP9	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1c[nH]c2ccccc12	ZINC000872268361	DG	On-Demand	Anodyne	MC1R	54	43
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268406	FD	On-Demand	Anodyne	F2	21	49
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268406	FD	On-Demand	Anodyne	TRY2_BOVIN	52	43
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268516	GD	On-Demand	Anodyne	CACNA1B	51	32
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268516	GD	On-Demand	Anodyne	CCR2	51	36
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268522	FD	On-Demand	Anodyne	TBXA2R	41	32
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268522	FD	On-Demand	Anodyne	PSEN2	40	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3ccccc3[C@@H]2c2ccccc2)C1	ZINC000872268524	EG	On-Demand	Anodyne	TRPM8	26	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3ccccc3[C@H]2c2ccccc2)C1	ZINC000872268525	EG	On-Demand	Anodyne	TRPM8	26	41
O=C(CCCc1cccs1)N[C@]12CCC[C@H]1OCC2	ZINC000872268536	CF	On-Demand	Anodyne	PTPRF	18	41
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268539	DD	On-Demand	Bother	SLC27A4	50	34
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268539	DD	On-Demand	Bother	TRAR	37	53
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000872268543	ED	On-Demand	Anodyne	BCHE	20	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000872268543	ED	On-Demand	Anodyne	SSTR3	18	42
O=C(CCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268556	CD	On-Demand	Anodyne	CHRNA7	42	35
O=C(CCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268556	CD	On-Demand	Anodyne	C3AR1	38	40
O=C(CCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268556	CD	On-Demand	Anodyne	NAMPT	28	40
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268590	GE	On-Demand	Anodyne	F2	19	41
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872268590	GE	On-Demand	Anodyne	TRY2_BOVIN	42	36
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)C2CC2)c1	ZINC000872268593	DE	On-Demand	Anodyne	KCNK3	52	47
Cc1noc(C)c1COc1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268615	FG	On-Demand	Anodyne	RORC	19	45
N#Cc1ccc(OCCCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872268617	DF	On-Demand	Mild	HRH3	77	56
N#Cc1ccc(OCCCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872268617	DF	On-Demand	Mild	MEN1	60	51
N#Cc1ccc(OCCCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872268622	DF	On-Demand	Mild	HRH3	77	56
N#Cc1ccc(OCCCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872268622	DF	On-Demand	Mild	MEN1	60	51
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2ccccc2[nH]1	ZINC000872268623	CF	On-Demand	Anodyne	PYGL	49	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2NC(=O)Cc2cccs2)C1	ZINC000872268630	FF	On-Demand	Anodyne	CA5B	39	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2NC(=O)Cc2cccs2)C1	ZINC000872268630	FF	On-Demand	Anodyne	CA5A	39	43
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000872268639	GG	On-Demand	Anodyne	L3MBTL3	41	35
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000872268640	GG	On-Demand	Anodyne	L3MBTL3	41	35
COC(=O)c1cn(CC(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc12	ZINC000872268647	EE	On-Demand	Anodyne	CNR1	19	45
COC(=O)c1cn(CC(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc12	ZINC000872268647	EE	On-Demand	Anodyne	CNR2	32	45
COc1cc(N)c(Cl)cc1C(=O)N1CCO[C@@H](C(F)F)CC1	ZINC000872268653	EE	On-Demand	Anodyne	HTR4	116	50
COc1cc(N)c(Cl)cc1C(=O)N1CCO[C@H](C(F)F)CC1	ZINC000872268654	EE	On-Demand	Anodyne	HTR4	116	50
Cc1ccc(COc2cccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)c2)cc1	ZINC000872268701	EH	On-Demand	Anodyne	EPHX2	24	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000872268719	FF	On-Demand	Anodyne	SPHK1	38	46
COC(=O)CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872268720	EF	On-Demand	Anodyne	S1PR4	15	41
COC(=O)CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872268720	EF	On-Demand	Anodyne	EPHX2	15	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N(Cc2ccc3c(c2)OCO3)c2ccc(F)cc2)C1	ZINC000872268735	FG	On-Demand	Anodyne	NOS2	62	34
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)Nc1ccccc1	ZINC000872268760	DE	On-Demand	Anodyne	HDAC10	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)Nc1ccccc1	ZINC000872268760	DE	On-Demand	Anodyne	HDAC3	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)Nc1ccccc1	ZINC000872268760	DE	On-Demand	Anodyne	HDAC6	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)Nc1ccccc1	ZINC000872268760	DE	On-Demand	Anodyne	HDAC11	23	40
O=C(CN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268777	CE	On-Demand	Anodyne	CTSK	15	40
O=C(CN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268777	CE	On-Demand	Anodyne	CTSL	24	40
O=C(CN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268777	CE	On-Demand	Anodyne	CCR5	42	38
O=C(CN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268777	CE	On-Demand	Anodyne	KLK5	40	37
O=C(CN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268777	CE	On-Demand	Anodyne	SLC12A5	65	36
O=C(CN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268779	CE	On-Demand	Anodyne	CTSK	15	40
O=C(CN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268779	CE	On-Demand	Anodyne	CTSL	24	40
O=C(CN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268779	CE	On-Demand	Anodyne	CCR5	42	38
O=C(CN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268779	CE	On-Demand	Anodyne	KLK5	40	37
O=C(CN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872268779	CE	On-Demand	Anodyne	SLC12A5	65	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	ACE	30	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CELA1	21	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	ELANE	26	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTRA_BOVIN	61	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CASP3	15	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	KLK3	77	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTSB	63	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	PAPA1_CARPA	71	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CYSP_TRYCR	52	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTSG	42	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTSK	44	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTSL	46	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CAPNS1	67	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	HLA-DRB1	41	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CELA2A	50	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CTSS	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CAPN1	83	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CASP1	27	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	CAPN2	137	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	PLAU	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	NPR	82	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	PSMB5	49	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	SLC12A5	69	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872268791	EE	On-Demand	Anodyne	Q9NAW4_PLAFA	35	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000872268806	EF	On-Demand	Bother	SCNN1A	44	32
O=C(COCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268807	CE	On-Demand	Anodyne	SLC12A5	56	37
Cn1nc(C(=O)N[C@@H]2CCNCC(C)(C)C2)c2ccccc2c1=O	ZINC000872268815	ED	On-Demand	Anodyne	HTR3A	15	44
Cn1nc(C(=O)N[C@H]2CCNCC(C)(C)C2)c2ccccc2c1=O	ZINC000872268819	ED	On-Demand	Anodyne	HTR3A	15	44
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268822	FD	On-Demand	Anodyne	PIK3CA	42	37
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268822	FD	On-Demand	Anodyne	MTOR	82	37
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268822	FD	On-Demand	Anodyne	EPHX2	21	42
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268822	FD	On-Demand	Anodyne	STAT6	52	32
O=C(CCc1nc(-c2cccs2)no1)N[C@]12CCC[C@H]1OCC2	ZINC000872268824	EF	On-Demand	Anodyne	ETHR	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(-c2nc[nH]n2)c1	ZINC000872268825	CE	On-Demand	Anodyne	TYK2	15	41
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872268832	FD	On-Demand	Anodyne	CASR	17	47
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872268832	FD	On-Demand	Anodyne	CCR3	20	45
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872268832	FD	On-Demand	Anodyne	ST14	40	35
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268845	FD	On-Demand	Anodyne	PIK3CA	42	37
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268845	FD	On-Demand	Anodyne	MTOR	82	37
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268845	FD	On-Demand	Anodyne	EPHX2	21	42
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872268845	FD	On-Demand	Anodyne	STAT6	52	32
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)c2cccs2)c1	ZINC000872268846	FG	On-Demand	Anodyne	KCNK3	60	50
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)c2cccs2)c1	ZINC000872268846	FG	On-Demand	Anodyne	KCNK9	35	50
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872268851	FD	On-Demand	Anodyne	CASR	17	47
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872268851	FD	On-Demand	Anodyne	CCR3	20	45
CS(=O)(=O)c1cccc(NC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872268851	FD	On-Demand	Anodyne	ST14	40	35
CCOc1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872268853	CE	On-Demand	Anodyne	TRAR	41	33
CCOc1cc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872268868	DF	On-Demand	Anodyne	F2	19	40
CCOc1cc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872268868	DF	On-Demand	Anodyne	SSTR5	54	39
COc1ccc2c(C)c(CCC(=O)N[C@]34CCC[C@H]3OCC4)c(=O)oc2c1	ZINC000872268890	FF	On-Demand	Anodyne	MAOB	29	43
O=C(CS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268892	ED	On-Demand	Anodyne	PSEN2	48	32
O=C(CSc1nnc(-c2ccc(F)cc2)o1)N[C@]12CCC[C@H]1OCC2	ZINC000872268924	FF	On-Demand	Anodyne	ALOX15	19	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1	ZINC000872268947	FH	On-Demand	Anodyne	NR2E3	64	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1	ZINC000872268947	FH	On-Demand	Anodyne	SHH	20	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1	ZINC000872268947	FH	On-Demand	Anodyne	SMO	22	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1	ZINC000872268947	FH	On-Demand	Anodyne	KCNK3	41	40
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268967	GE	On-Demand	Anodyne	TGM2	41	35
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872268967	GE	On-Demand	Anodyne	NAMPT	39	40
Cn1nc(CC(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc2c1=O	ZINC000872268985	ED	On-Demand	Anodyne	IMDH_CRYPV	33	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1coc(-c2ccccc2)n1	ZINC000872269020	DF	On-Demand	Anodyne	PDE8B	60	36
COc1ccc2c(CC(=O)N[C@]34CCC[C@H]3OCC4)coc2c1	ZINC000872269060	DF	On-Demand	Anodyne	MTNR1A	30	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000872269071	DF	On-Demand	Anodyne	ROCK2	19	44
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1COc2ccc(Cl)cc2C1	ZINC000872269072	DF	On-Demand	Anodyne	ROCK2	19	44
CCOc1ccccc1C(=O)NCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269092	ED	On-Demand	Anodyne	KCNA3	41	43
CCOc1ccccc1C(=O)NCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269092	ED	On-Demand	Anodyne	HCN1	90	45
CCOc1ccccc1C(=O)NCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269092	ED	On-Demand	Anodyne	HCN4	67	45
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)N[C@]12CCC[C@H]1OCC2	ZINC000872269108	GE	On-Demand	Anodyne	EPHX2	76	49
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872269116	GD	On-Demand	Anodyne	EPHX2	33	54
O=C(Cc1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872269134	CG	On-Demand	Anodyne	LUXR	30	50
CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@]34CCC[C@H]3OCC4)ccc21	ZINC000872269142	ED	On-Demand	Anodyne	PLD1	40	31
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872269158	GF	On-Demand	Anodyne	HRH1	19	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872269158	GF	On-Demand	Anodyne	CCR3	23	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872269160	GF	On-Demand	Anodyne	HRH1	19	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872269160	GF	On-Demand	Anodyne	CCR3	23	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(C2CC2)nc2ccccc12	ZINC000872269174	DH	On-Demand	Anodyne	TACR3	15	46
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872269197	FD	On-Demand	Anodyne	DRD4	28	41
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269202	GE	On-Demand	Anodyne	TGM2	48	33
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269202	GE	On-Demand	Anodyne	F13A1	42	36
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269202	GE	On-Demand	Anodyne	NAMPT	43	41
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872269204	FD	On-Demand	Anodyne	DRD4	28	41
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872269232	FH	On-Demand	Bother	L3MBTL3	70	51
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872269233	FH	On-Demand	Bother	L3MBTL3	70	51
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn(Cc2ccccc2Cl)c1	ZINC000872269235	EG	On-Demand	Anodyne	PANC	46	34
O=C(N[C@]12CCC[C@H]1OCC2)c1csc2ccccc12	ZINC000872269249	CG	On-Demand	Anodyne	C5AR1	26	42
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872269269	GH	On-Demand	Anodyne	L3MBTL3	19	40
Cc1oc(-c2ccccc2)nc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269276	DG	On-Demand	Anodyne	PDE8B	61	37
O=C(Nc1ccccc1)Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269313	FH	On-Demand	Anodyne	EPHX2	22	45
O=C(Nc1ccccc1)Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269313	FH	On-Demand	Anodyne	DGAT1	15	43
N#CCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872269319	CE	On-Demand	Mild	HRH3	15	44
N#CCOc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872269319	CE	On-Demand	Mild	SIGMAR1	18	46
N#CCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872269348	CE	On-Demand	Mild	HRH3	15	44
N#CCOc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872269348	CE	On-Demand	Mild	SIGMAR1	18	46
Cn1c(=O)n(CC(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872269349	DD	On-Demand	Anodyne	CALCRL	15	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn(Cc2ccccc2)c1	ZINC000872269350	DE	On-Demand	Anodyne	PANC	48	38
O=C(CCc1c[nH]c2ccccc12)N[C@]12CCC[C@H]1OCC2	ZINC000872269421	CF	On-Demand	Anodyne	NMBR	48	33
O=C(CCc1c[nH]c2ccccc12)N[C@]12CCC[C@H]1OCC2	ZINC000872269421	CF	On-Demand	Anodyne	MC5R	30	41
O=C(CCc1cccc(Br)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872269423	EG	On-Demand	Anodyne	LUXR	30	52
CC[C@@](C)(NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccccc1	ZINC000872269425	CF	On-Demand	Anodyne	AMY2	53	31
O=C(CNC(=O)c1cccc(F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872269454	DD	On-Demand	Anodyne	CCR2	60	38
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872269456	EE	On-Demand	Anodyne	TGM2	60	42
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000872269456	EE	On-Demand	Anodyne	F13A1	89	42
O[C@H](CN1CCO[C@@H](C(F)F)CC1)c1ccc(F)cc1	ZINC000872269490	CE	On-Demand	Anodyne	SLC6A3	27	44
O[C@H](CN1CCO[C@H](C(F)F)CC1)c1ccc(F)cc1	ZINC000872269491	CE	On-Demand	Anodyne	SLC6A3	27	44
O[C@@H](CN1CCO[C@@H](C(F)F)CC1)c1ccc(F)cc1	ZINC000872269493	CE	On-Demand	Anodyne	SLC6A3	27	44
O[C@@H](CN1CCO[C@H](C(F)F)CC1)c1ccc(F)cc1	ZINC000872269495	CE	On-Demand	Anodyne	SLC6A3	27	44
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000872269497	FF	On-Demand	Anodyne	SLC6A3	18	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000872269497	FF	On-Demand	Anodyne	MC4R	55	45
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000872269497	FF	On-Demand	Anodyne	PRCP	41	44
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000872269501	FF	On-Demand	Anodyne	SLC6A3	18	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000872269501	FF	On-Demand	Anodyne	MC4R	55	45
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000872269501	FF	On-Demand	Anodyne	PRCP	41	44
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872269531	GD	On-Demand	Mild	ITGA4	47	32
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872269531	GD	On-Demand	Mild	SFRP1	52	38
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872269531	GD	On-Demand	Mild	WNT3	44	36
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872269533	GD	On-Demand	Mild	ITGA4	47	32
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872269533	GD	On-Demand	Mild	SFRP1	52	38
N#Cc1cccc(S(=O)(=O)NCC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872269533	GD	On-Demand	Mild	WNT3	44	36
O=C(CCc1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269543	CG	On-Demand	Anodyne	LUXR	27	47
O=C(CCc1ccc2c(c1)OCCO2)N[C@]12CCC[C@H]1OCC2	ZINC000872269553	DE	On-Demand	Anodyne	LUXR	32	46
COc1ccc2c(CN3CCO[C@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269566	EF	On-Demand	Anodyne	CYP19A1	15	49
COc1ccc2c(CN3CCO[C@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269566	EF	On-Demand	Anodyne	CYP11B1	17	42
COc1ccc2c(CN3CCO[C@@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269567	EF	On-Demand	Anodyne	CYP19A1	15	49
COc1ccc2c(CN3CCO[C@@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269567	EF	On-Demand	Anodyne	CYP11B1	17	42
Fc1cccc(OCCN2CCO[C@H](C(F)F)CC2)c1	ZINC000872269609	CF	On-Demand	Anodyne	DRD2	16	53
Fc1cccc(OCCN2CCO[C@H](C(F)F)CC2)c1	ZINC000872269609	CF	On-Demand	Anodyne	LTA4H	39	41
Fc1cccc(OCCN2CCO[C@H](C(F)F)CC2)c1	ZINC000872269609	CF	On-Demand	Anodyne	CHRNA10	49	44
COc1ccc(-c2nc(C)c(C(=O)N[C@]34CCC[C@H]3OCC4)s2)cc1OC	ZINC000872269610	GH	On-Demand	Anodyne	PPARD	15	40
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1cccnc1Cl	ZINC000872269616	DE	On-Demand	Anodyne	G2YM83_BOTF4	63	32
CCOc1ccccc1C(=O)NCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269619	FE	On-Demand	Anodyne	KCNA3	41	41
CCOc1ccccc1C(=O)NCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269619	FE	On-Demand	Anodyne	HCN1	82	43
CCOc1ccccc1C(=O)NCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269619	FE	On-Demand	Anodyne	HCN4	64	43
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1cccnc1Cl	ZINC000872269621	DE	On-Demand	Anodyne	G2YM83_BOTF4	63	32
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	CA2	58	43
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	CA1	55	40
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	CA4	46	39
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	CA12	41	39
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	CA9	42	41
NS(=O)(=O)c1ccc(CCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269627	ED	On-Demand	Anodyne	NCE103	15	43
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872269629	EE	On-Demand	Anodyne	DRD2	24	49
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872269629	EE	On-Demand	Anodyne	DRD4	15	52
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872269629	EE	On-Demand	Anodyne	HTR4	118	76
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872269631	EE	On-Demand	Anodyne	DRD2	24	49
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872269631	EE	On-Demand	Anodyne	DRD4	15	52
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872269631	EE	On-Demand	Anodyne	HTR4	118	76
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000872269678	DD	On-Demand	Anodyne	INHA	19	45
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000872269680	DD	On-Demand	Anodyne	INHA	19	45
NC(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872269694	CD	On-Demand	Anodyne	KCNK3	64	36
Cc1oc(-c2ccccc2)nc1CC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269717	EG	On-Demand	Anodyne	PPARG	77	42
Cc1oc(-c2ccccc2)nc1CC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269717	EG	On-Demand	Anodyne	PPARA	83	43
Cc1oc(-c2ccccc2)nc1CC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269717	EG	On-Demand	Anodyne	PDE8B	67	45
O=C(CCCc1nc(O)c2ccccc2n1)N[C@]12CCC[C@H]1OCC2	ZINC000872269734	EE	On-Demand	Anodyne	TNKS	60	38
CCOc1cc(CCCNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872269737	EG	On-Demand	Anodyne	FKBP1A	44	45
CCOc1cc(CCCNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872269737	EG	On-Demand	Anodyne	SSTR5	53	37
CCOc1cc(CCCNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872269737	EG	On-Demand	Anodyne	MTNR1A	15	43
CCOc1cc(CCCNC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872269737	EG	On-Demand	Anodyne	MTNR1B	20	48
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(c2nc3ccccc3o2)CC1	ZINC000872269765	FF	On-Demand	Anodyne	PTGES	31	41
Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269774	EF	On-Demand	Anodyne	P2RX7	20	58
N[C@H](C(=O)N1CCO[C@@H](C(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000872269791	FF	On-Demand	Anodyne	RBP4	15	41
N[C@@H](C(=O)N1CCO[C@H](C(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000872269792	FF	On-Demand	Anodyne	RBP4	15	41
N[C@H](C(=O)N1CCO[C@H](C(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000872269793	FF	On-Demand	Anodyne	RBP4	15	41
N[C@@H](C(=O)N1CCO[C@@H](C(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000872269794	FF	On-Demand	Anodyne	RBP4	15	41
CCOc1ccccc1OCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269796	EG	On-Demand	Anodyne	HCN1	45	33
CCOc1ccccc1OCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872269796	EG	On-Demand	Anodyne	HCN4	43	33
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCOCC2)nc1	ZINC000872269869	DD	On-Demand	Anodyne	HPGDS	23	52
CC(=O)Nc1ccc2c(CN3CCO[C@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269889	FF	On-Demand	Anodyne	MCHR1	27	40
CC(=O)Nc1ccc2c(CN3CCO[C@@H](C(F)F)CC3)cc(=O)oc2c1	ZINC000872269890	FF	On-Demand	Anodyne	MCHR1	27	40
O=C(CN1CCO[C@@H](C(F)F)CC1)NNC(=O)c1ccc(F)cc1	ZINC000872269891	EC	On-Demand	Reactive	WNT3A	50	40
O=C(CN1CCO[C@@H](C(F)F)CC1)NNC(=O)c1ccc(F)cc1	ZINC000872269891	EC	On-Demand	Reactive	TNKS2	15	40
O=C(CN1CCO[C@H](C(F)F)CC1)NNC(=O)c1ccc(F)cc1	ZINC000872269892	EC	On-Demand	Reactive	WNT3A	50	40
O=C(CN1CCO[C@H](C(F)F)CC1)NNC(=O)c1ccc(F)cc1	ZINC000872269892	EC	On-Demand	Reactive	TNKS2	15	40
O=C(Cc1ccc(C(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269930	DG	On-Demand	Anodyne	LUXR	28	48
O=C(Cc1ccc(C(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872269930	DG	On-Demand	Anodyne	TRAR	30	48
O=C(CN1CCO[C@H](C(F)F)CC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872269935	GD	On-Demand	Bother	SSTR1	48	45
O=C(CN1CCO[C@@H](C(F)F)CC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872269936	GD	On-Demand	Bother	SSTR1	48	45
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc2ccccc2c1	ZINC000872269946	EG	On-Demand	Anodyne	DRD4	19	45
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccc2ccccc2c1	ZINC000872269946	EG	On-Demand	Anodyne	IMDH_CRYPV	19	40
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc2ccccc2c1	ZINC000872269947	EG	On-Demand	Anodyne	DRD4	19	45
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccc2ccccc2c1	ZINC000872269947	EG	On-Demand	Anodyne	IMDH_CRYPV	19	40
O=C(c1ccc2nc[nH]c2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872269986	DG	On-Demand	Anodyne	L3MBTL3	77	42
O=C(c1ccc2nc[nH]c2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872269986	DG	On-Demand	Anodyne	HPGD	48	38
O=C(c1ccc2nc[nH]c2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872269987	DG	On-Demand	Anodyne	L3MBTL3	77	42
O=C(c1ccc2nc[nH]c2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872269987	DG	On-Demand	Anodyne	HPGD	48	38
CS(=O)(=O)Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872269998	DD	On-Demand	Anodyne	CTSS	18	42
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872269999	GF	On-Demand	Anodyne	DRD4	26	41
O=C(CN1CCO[C@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872269999	GF	On-Demand	Anodyne	CNR2	19	42
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872270000	GF	On-Demand	Anodyne	DRD4	26	41
O=C(CN1CCO[C@@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872270000	GF	On-Demand	Anodyne	CNR2	19	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872270002	DG	On-Demand	Anodyne	GRIN2B	42	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872270002	DG	On-Demand	Anodyne	CCR3	132	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872270002	DG	On-Demand	Anodyne	CYP2D6	22	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872270003	DG	On-Demand	Anodyne	GRIN2B	42	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872270003	DG	On-Demand	Anodyne	CCR3	132	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872270003	DG	On-Demand	Anodyne	CYP2D6	22	40
O=c1cc(CN2CCO[C@@H](C(F)F)CC2)c2ccc(O)cc2o1	ZINC000872270063	EE	On-Demand	Anodyne	HSD17B3	34	48
O=c1cc(CN2CCO[C@H](C(F)F)CC2)c2ccc(O)cc2o1	ZINC000872270064	EE	On-Demand	Anodyne	HSD17B3	34	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872270080	GH	On-Demand	Anodyne	NPY2R	23	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872270080	GH	On-Demand	Anodyne	EPHX2	35	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000872270089	FF	On-Demand	Anodyne	GRM5	22	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000872270089	FF	On-Demand	Anodyne	SPHK1	31	40
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)c2ccoc2)CC1	ZINC000872270098	ED	On-Demand	Anodyne	L3MBTL3	56	34
COc1ccc2c(C)c(CCC(=O)N[C@H]3CCNCC(C)(C)C3)c(=O)oc2c1	ZINC000872270109	GF	On-Demand	Anodyne	MAOB	27	42
COc1ccc2c(C)c(CCC(=O)N[C@@H]3CCNCC(C)(C)C3)c(=O)oc2c1	ZINC000872270110	GF	On-Demand	Anodyne	MAOB	27	42
O=C(COc1cccc(NC(=O)C2CC2)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872270130	EE	On-Demand	Anodyne	EPHX2	18	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CSC2CCOCC2)c1	ZINC000872270144	FH	On-Demand	Anodyne	QRFPR	25	49
Cc1cccc(C(C)(C)NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872270148	CE	On-Demand	Anodyne	IMDH_CRYPV	40	31
O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270161	FF	On-Demand	Anodyne	L3MBTL3	69	40
O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270162	FF	On-Demand	Anodyne	L3MBTL3	69	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000872270167	EF	On-Demand	Anodyne	SPHK1	39	47
O=C(c1ccc2c(O)nc(S)nc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270180	FG	On-Demand	Anodyne	L3MBTL3	63	39
O=C(c1ccc2c(O)nc(S)nc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270180	FG	On-Demand	Anodyne	HPGD	43	37
O=C(c1ccc2c(O)nc(S)nc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270181	FG	On-Demand	Anodyne	L3MBTL3	63	39
O=C(c1ccc2c(O)nc(S)nc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270181	FG	On-Demand	Anodyne	HPGD	43	37
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	F2	28	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	FKBP1A	17	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	PTPN2	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	SIGMAR1	19	48
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	EPHX2	34	47
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872270185	GE	On-Demand	Anodyne	TMPRSS11D	52	35
O=C(COc1ccc(F)c(Cl)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872270186	DF	On-Demand	Anodyne	TRAR	28	40
O=C(Cc1ccc(-n2cnnn2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872270188	DD	On-Demand	Anodyne	KCNJ1	51	39
Cc1ccccc1[C@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(N)=O	ZINC000872270190	ED	On-Demand	Anodyne	CTSA	53	33
Cc1ccccc1[C@@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(N)=O	ZINC000872270191	ED	On-Demand	Anodyne	CTSA	53	33
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCCCCC2)nc1	ZINC000872270192	EF	On-Demand	Anodyne	HPGDS	18	49
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872270202	DD	On-Demand	Anodyne	INHA	20	47
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872270203	DD	On-Demand	Anodyne	INHA	20	47
O=C(Nc1ccc(Cl)cc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270219	DE	On-Demand	Anodyne	ENV	40	36
O=C(CN1CCO[C@@H](C(F)F)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872270226	FD	On-Demand	Reactive	DRD4	24	40
O=C(CN1CCO[C@@H](C(F)F)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872270226	FD	On-Demand	Reactive	CACNA1I	63	43
O=C(CN1CCO[C@H](C(F)F)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872270227	FD	On-Demand	Reactive	DRD4	24	40
O=C(CN1CCO[C@H](C(F)F)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872270227	FD	On-Demand	Reactive	CACNA1I	63	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000872270243	EF	On-Demand	Anodyne	GRM5	22	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000872270243	EF	On-Demand	Anodyne	SPHK1	30	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000872270273	EE	On-Demand	Anodyne	KCNK3	41	38
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000872270274	EE	On-Demand	Anodyne	KCNK3	41	38
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270277	FI	On-Demand	Anodyne	HRH3	16	46
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270277	FI	On-Demand	Anodyne	L3MBTL3	74	44
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270277	FI	On-Demand	Anodyne	HPGD	43	37
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270278	FI	On-Demand	Anodyne	HRH3	16	46
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270278	FI	On-Demand	Anodyne	L3MBTL3	74	44
O=C(c1ccc2nc(Cl)ccc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270278	FI	On-Demand	Anodyne	HPGD	43	37
COc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1O	ZINC000872270293	CD	On-Demand	Anodyne	KCNA3	42	37
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Cl)ccc2[nH]1	ZINC000872270305	DG	On-Demand	Anodyne	CYP51A1	16	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Cl)ccc2[nH]1	ZINC000872270305	DG	On-Demand	Anodyne	PYGL	92	48
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Cl)ccc2[nH]1	ZINC000872270305	DG	On-Demand	Anodyne	PYGM	24	44
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(OCc2cccnc2)cc1	ZINC000872270320	EG	On-Demand	Anodyne	SLC6A5	29	45
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000872270330	GD	On-Demand	Anodyne	EPHX2	26	42
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000872270330	GD	On-Demand	Anodyne	NAMPT	44	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Br)ccc2[nH]1	ZINC000872270348	EG	On-Demand	Anodyne	PYGL	53	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Br)ccc2[nH]1	ZINC000872270348	EG	On-Demand	Anodyne	PYGM	19	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Br)ccc2[nH]1	ZINC000872270348	EG	On-Demand	Anodyne	PYK	47	38
O=C(COc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872270406	DD	On-Demand	Bother	CACNA1C	43	33
O=C(COc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872270406	DD	On-Demand	Bother	CACNA1D	66	33
O=C(COc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872270406	DD	On-Demand	Bother	TRAR	28	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(Cl)ccc1O	ZINC000872270436	CE	On-Demand	Anodyne	KCNMA1	24	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)C1	ZINC000872270446	FH	On-Demand	Anodyne	PTGER1	54	38
O=C(Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1)c1ccccc1	ZINC000872270452	FG	On-Demand	Anodyne	AVPR2	21	40
O=C(Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1)c1ccccc1	ZINC000872270452	FG	On-Demand	Anodyne	PRNP	39	40
O=C(Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1)c1ccccc1	ZINC000872270452	FG	On-Demand	Anodyne	KCNK3	48	40
CC[C@@H](C(=O)N[C@]12CCC[C@H]1OCC2)c1ccccc1	ZINC000872270465	CG	On-Demand	Anodyne	KCNQ2	47	43
CCCCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270487	BF	On-Demand	Anodyne	LUXR	29	41
CCCCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270487	BF	On-Demand	Anodyne	LASR	59	41
O=C(CCCCCc1ccc(O)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270488	FI	On-Demand	Anodyne	FKBP1A	15	44
O=C(CCCCCc1ccc(O)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270488	FI	On-Demand	Anodyne	PREP	57	45
O=C(CCCCCc1ccc(O)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270489	FI	On-Demand	Anodyne	FKBP1A	15	44
O=C(CCCCCc1ccc(O)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270489	FI	On-Demand	Anodyne	PREP	57	45
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(Br)ccc1O	ZINC000872270512	EF	On-Demand	Anodyne	PYK	76	33
CN(C)S(=O)(=O)c1cc(C(=O)N[C@@H]2CCNCC(C)(C)C2)ccc1Cl	ZINC000872270520	GE	On-Demand	Anodyne	EZH2	43	38
CN(C)S(=O)(=O)c1cc(C(=O)N[C@H]2CCNCC(C)(C)C2)ccc1Cl	ZINC000872270521	GE	On-Demand	Anodyne	EZH2	43	38
O=C(c1cc(-c2ccccc2O)[nH]n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270531	FG	On-Demand	Anodyne	GRIN2B	28	41
O=C(c1cc(-c2ccccc2O)[nH]n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270532	FG	On-Demand	Anodyne	GRIN2B	28	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000872270533	CC	On-Demand	Anodyne	INHA	16	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CC(=O)N(C2CC2)C1	ZINC000872270534	CC	On-Demand	Anodyne	INHA	16	41
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(CN2CCCCC2)cc1	ZINC000872270540	EG	On-Demand	Anodyne	HRH3	21	42
O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872270557	GE	On-Demand	Anodyne	DRD4	18	40
O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872270558	GE	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(OCc2ccncc2)cc1	ZINC000872270584	EG	On-Demand	Anodyne	ADAM17	26	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(F)ccc2[nH]1	ZINC000872270594	CF	On-Demand	Anodyne	PYGL	51	39
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(F)ccc2[nH]1	ZINC000872270594	CF	On-Demand	Anodyne	PLD1	23	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(F)ccc2[nH]1	ZINC000872270594	CF	On-Demand	Anodyne	PLD2	39	41
O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270605	GE	On-Demand	Anodyne	CASR	44	34
O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270605	GE	On-Demand	Anodyne	MTOR	56	36
O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270605	GE	On-Demand	Anodyne	EPHX2	25	41
O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270605	GE	On-Demand	Anodyne	STAT6	53	33
O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270606	GE	On-Demand	Anodyne	CASR	44	34
O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270606	GE	On-Demand	Anodyne	MTOR	56	36
O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270606	GE	On-Demand	Anodyne	EPHX2	25	41
O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872270606	GE	On-Demand	Anodyne	STAT6	53	33
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N[C@]12CCC[C@H]1OCC2	ZINC000872270607	ED	On-Demand	Anodyne	SCARB1	34	44
COC(=O)NCc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872270669	DE	On-Demand	Anodyne	TPSAB1	17	41
COC(=O)NCc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872270669	DE	On-Demand	Anodyne	KDM1A	17	41
O=C(Cn1nnc(-c2ccccc2)n1)N[C@]12CCC[C@H]1OCC2	ZINC000872270686	DD	On-Demand	Anodyne	SCARB1	34	43
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)c2cccnc2)CC1	ZINC000872270697	ED	On-Demand	Anodyne	L3MBTL3	43	34
C[C@H](C(=O)Nc1cccnc1Cl)N1CCO[C@H](C(F)F)CC1	ZINC000872270702	EE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@H](C(=O)Nc1cccnc1Cl)N1CCO[C@@H](C(F)F)CC1	ZINC000872270703	EE	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CCCCCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270706	CG	On-Demand	Mild	LUXR	29	41
CCCCCCCC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270706	CG	On-Demand	Mild	LASR	59	41
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(O)c(Cl)c1	ZINC000872270714	CE	On-Demand	Anodyne	ADCYAP1R1	47	31
O=C(NCC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(O)cc1	ZINC000872270743	EE	On-Demand	Anodyne	PREP	27	49
O=C(NCC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(O)cc1	ZINC000872270744	EE	On-Demand	Anodyne	PREP	27	49
O=C(CCCc1nnc(-c2ccccc2)o1)N[C@]12CCC[C@H]1OCC2	ZINC000872270763	EF	On-Demand	Anodyne	TNKS	20	40
O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872270777	EF	On-Demand	Anodyne	TRAR	44	43
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000872270798	GF	On-Demand	Anodyne	RBP4	43	32
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000872270799	GF	On-Demand	Anodyne	RBP4	43	32
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000872270804	DG	On-Demand	Anodyne	ACE	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000872270804	DG	On-Demand	Anodyne	OPRM1	25	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000872270804	DG	On-Demand	Anodyne	MME	56	38
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000872270804	DG	On-Demand	Anodyne	REN	40	35
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000872270804	DG	On-Demand	Anodyne	ACE2	31	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000872270805	DG	On-Demand	Anodyne	ACE	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000872270805	DG	On-Demand	Anodyne	OPRM1	25	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000872270805	DG	On-Demand	Anodyne	MME	56	38
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000872270805	DG	On-Demand	Anodyne	REN	40	35
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000872270805	DG	On-Demand	Anodyne	ACE2	31	40
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872270809	FC	On-Demand	Reactive	CCR3	15	40
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872270810	FC	On-Demand	Reactive	CCR3	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000872270830	EG	On-Demand	Anodyne	SLC18A3	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000872270830	EG	On-Demand	Anodyne	L3MBTL3	43	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000872270831	EG	On-Demand	Anodyne	SLC18A3	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000872270831	EG	On-Demand	Anodyne	L3MBTL3	43	36
FC(F)[C@H]1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1	ZINC000872270871	EG	On-Demand	Anodyne	LUCI_PHOPY	70	46
FC(F)[C@@H]1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1	ZINC000872270872	EG	On-Demand	Anodyne	LUCI_PHOPY	70	46
FC(F)[C@H]1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1	ZINC000872270873	EG	On-Demand	Anodyne	LUCI_PHOPY	70	46
FC(F)[C@@H]1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1	ZINC000872270874	EG	On-Demand	Anodyne	LUCI_PHOPY	70	46
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872270883	FF	On-Demand	Anodyne	P2RX7	26	47
CNc1nc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cs1	ZINC000872270920	DF	On-Demand	Anodyne	TRPC6	69	49
CNc1nc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cs1	ZINC000872270920	DF	On-Demand	Anodyne	TRPC3	62	49
CNc1nc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cs1	ZINC000872270921	DF	On-Demand	Anodyne	TRPC6	69	49
CNc1nc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cs1	ZINC000872270921	DF	On-Demand	Anodyne	TRPC3	62	49
NS(=O)(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872270922	ED	On-Demand	Anodyne	CA2	36	44
NS(=O)(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872270922	ED	On-Demand	Anodyne	CA1	37	44
NS(=O)(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872270922	ED	On-Demand	Anodyne	CA7	20	42
NS(=O)(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872270922	ED	On-Demand	Anodyne	CA12	25	44
NS(=O)(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872270922	ED	On-Demand	Anodyne	CA9	31	42
NS(=O)(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872270923	ED	On-Demand	Anodyne	CA2	36	44
NS(=O)(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872270923	ED	On-Demand	Anodyne	CA1	37	44
NS(=O)(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872270923	ED	On-Demand	Anodyne	CA7	20	42
NS(=O)(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872270923	ED	On-Demand	Anodyne	CA12	25	44
NS(=O)(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872270923	ED	On-Demand	Anodyne	CA9	31	42
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	ACE	84	38
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	MME	142	38
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	ANPEP	64	36
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	TIMP3	75	36
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	CAPNS1	50	31
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	ACE2	86	37
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	FPR1	62	38
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	GAG-PRO	46	30
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872270925	CF	On-Demand	Anodyne	Q82323_9DELA	64	31
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	ACE	84	38
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	MME	142	38
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	ANPEP	64	36
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	TIMP3	75	36
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	CAPNS1	50	31
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	ACE2	86	37
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	FPR1	62	38
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	GAG-PRO	46	30
C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872270926	CF	On-Demand	Anodyne	Q82323_9DELA	64	31
CCOC(=O)N[C@@H](C(=O)N[C@@H]1CCNCC(C)(C)C1)C(C)C	ZINC000872270932	DD	On-Demand	Anodyne	HLA-DRB1	40	38
CCOC(=O)N[C@H](C(=O)N[C@@H]1CCNCC(C)(C)C1)C(C)C	ZINC000872270933	DD	On-Demand	Anodyne	HLA-DRB1	40	38
CCOC(=O)N[C@@H](C(=O)N[C@H]1CCNCC(C)(C)C1)C(C)C	ZINC000872270934	DD	On-Demand	Anodyne	HLA-DRB1	40	38
CCOC(=O)N[C@H](C(=O)N[C@H]1CCNCC(C)(C)C1)C(C)C	ZINC000872270935	DD	On-Demand	Anodyne	HLA-DRB1	40	38
O=C(CCOc1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872270942	DF	On-Demand	Anodyne	TRAR	28	42
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872270951	ED	On-Demand	Reactive	DRD4	22	45
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872270951	ED	On-Demand	Reactive	CCR2	22	40
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872270951	ED	On-Demand	Reactive	KCNK3	48	35
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](C(F)F)CC2)c1	ZINC000872270951	ED	On-Demand	Reactive	KCNK9	41	35
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872270952	ED	On-Demand	Reactive	DRD4	22	45
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872270952	ED	On-Demand	Reactive	CCR2	22	40
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872270952	ED	On-Demand	Reactive	KCNK3	48	35
Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](C(F)F)CC2)c1	ZINC000872270952	ED	On-Demand	Reactive	KCNK9	41	35
O=C(c1cnc(Cl)cn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872270956	DF	On-Demand	Anodyne	L3MBTL3	19	40
O=C(c1cnc(Cl)cn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872270957	DF	On-Demand	Anodyne	L3MBTL3	19	40
O=C(Cn1cncn1)N[C@]12CCC[C@H]1OCC2	ZINC000872270971	BC	On-Demand	Anodyne	HIS3	43	35
COC(OC)c1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)o1	ZINC000872270988	EG	On-Demand	Anodyne	L3MBTL3	32	44
COC(OC)c1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)o1	ZINC000872270989	EG	On-Demand	Anodyne	L3MBTL3	32	44
COc1ccc2c(c1)C[C@@H](C(=O)N[C@]13CCC[C@H]1OCC3)CO2	ZINC000872270998	DE	On-Demand	Anodyne	ROCK2	29	47
COc1ccc2c(c1)C[C@H](C(=O)N[C@]13CCC[C@H]1OCC3)CO2	ZINC000872270999	DE	On-Demand	Anodyne	ROCK2	29	47
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)c1cccnc1	ZINC000872271029	FF	On-Demand	Anodyne	KCNK3	81	39
O=C(CCc1nc(-c2ccccn2)no1)N[C@]12CCC[C@H]1OCC2	ZINC000872271038	ED	On-Demand	Anodyne	HCAR2	27	40
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872271046	EF	On-Demand	Anodyne	KCNK3	48	37
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872271047	EF	On-Demand	Anodyne	KCNK3	48	37
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872271048	EF	On-Demand	Anodyne	KCNK3	48	37
O=C(CCCc1nc(-c2cccs2)no1)N[C@]12CCC[C@H]1OCC2	ZINC000872271059	EF	On-Demand	Anodyne	ETHR	32	41
O=C(Cc1csc2ccccc12)N[C@]12CCC[C@H]1OCC2	ZINC000872271068	DG	On-Demand	Anodyne	FFAR2	43	32
C[C@@H](OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872271096	CE	On-Demand	Anodyne	TIMP3	48	35
C[C@@H](OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872271096	CE	On-Demand	Anodyne	SLC12A5	60	35
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	SLC6A1	60	37
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	SLC6A3	24	40
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	LTA4H	25	43
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	SIGMAR1	34	43
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	CCR5	38	40
O=C(Cc1ccccc1)OCCN1CCO[C@H](C(F)F)CC1	ZINC000872271102	DE	On-Demand	Anodyne	CYP2J2	42	30
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	SLC6A1	60	37
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	SLC6A3	24	40
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	LTA4H	25	43
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	SIGMAR1	34	43
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	CCR5	38	40
O=C(Cc1ccccc1)OCCN1CCO[C@@H](C(F)F)CC1	ZINC000872271103	DE	On-Demand	Anodyne	CYP2J2	42	30
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872271104	FF	On-Demand	Anodyne	F2	21	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872271104	FF	On-Demand	Anodyne	GRIN2B	54	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872271104	FF	On-Demand	Anodyne	NPY2R	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872271104	FF	On-Demand	Anodyne	EPHX2	17	53
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872271104	FF	On-Demand	Anodyne	L3MBTL3	81	39
O=C(c1c(O)cccc1O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271116	DF	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1c(O)cccc1O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271117	DF	On-Demand	Anodyne	L3MBTL3	69	39
O=C(Cc1ccc(OCc2ccncc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271222	GI	On-Demand	Anodyne	MLNR	16	40
O=C(Cc1ccc(OCc2ccncc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271223	GI	On-Demand	Anodyne	MLNR	16	40
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872271260	GD	On-Demand	Clean	NPBWR1	53	31
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872271261	GD	On-Demand	Clean	NPBWR1	53	31
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(NC(=O)c2ccco2)c1	ZINC000872271314	EF	On-Demand	Anodyne	KCNK3	65	51
Cc1cccc(NC(=O)NCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872271408	DD	On-Demand	Anodyne	CCKAR	20	40
O=C(Cc1ccc(-n2cccn2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271417	DE	On-Demand	Anodyne	AMP1_PLAFQ	42	35
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCO[C@@H](C(F)F)CC1	ZINC000872271434	GF	On-Demand	Bother	L3MBTL3	51	47
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCO[C@H](C(F)F)CC1	ZINC000872271435	GF	On-Demand	Bother	L3MBTL3	51	47
Cc1ccc(C(=O)N2CCC[C@H](C(=O)N[C@]34CCC[C@H]3OCC4)C2)cc1	ZINC000872271450	FF	On-Demand	Anodyne	L3MBTL3	41	35
O=C(N[C@]12CCC[C@H]1OCC2)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000872271469	DF	On-Demand	Bother	GABRA1	15	46
O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271512	DF	On-Demand	Clean	L3MBTL3	42	38
O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271513	DF	On-Demand	Clean	L3MBTL3	42	38
O=C(c1sccc1C(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271532	EI	On-Demand	Anodyne	L3MBTL3	47	36
O=C(c1sccc1C(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271534	EI	On-Demand	Anodyne	L3MBTL3	47	36
O=C(CCCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271543	CF	On-Demand	Anodyne	PREP	42	38
O=C(CCCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271543	CF	On-Demand	Anodyne	CES1	44	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2ccccc2F)CC1	ZINC000872271546	DG	On-Demand	Anodyne	RBP4	38	40
COc1cccc(O[C@@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271613	DE	On-Demand	Anodyne	CTSK	17	47
COc1cccc(O[C@@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271613	DE	On-Demand	Anodyne	MTNR1A	57	68
COc1cccc(O[C@@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271613	DE	On-Demand	Anodyne	MTNR1B	52	68
COc1cccc(O[C@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271615	DE	On-Demand	Anodyne	CTSK	17	47
COc1cccc(O[C@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271615	DE	On-Demand	Anodyne	MTNR1A	57	68
COc1cccc(O[C@H](C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872271615	DE	On-Demand	Anodyne	MTNR1B	52	68
O=C(Cc1ccc2cccnc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271621	EH	On-Demand	Anodyne	CDK5	15	40
FCc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271623	CG	On-Demand	Anodyne	DRD4	16	41
FCc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271625	CG	On-Demand	Anodyne	DRD4	16	41
O=C(Cc1ccc2cccnc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271628	EH	On-Demand	Anodyne	CDK5	15	40
CC(=O)Oc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271666	CE	On-Demand	Anodyne	HRH3	19	41
CC(=O)Oc1ccc(CN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271666	CE	On-Demand	Anodyne	MCHR1	33	40
CC(=O)Oc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271668	CE	On-Demand	Anodyne	HRH3	19	41
CC(=O)Oc1ccc(CN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271668	CE	On-Demand	Anodyne	MCHR1	33	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000872271669	EG	On-Demand	Anodyne	MME	51	37
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000872271669	EG	On-Demand	Anodyne	AMY2	43	29
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000872271671	EG	On-Demand	Anodyne	MME	51	37
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000872271671	EG	On-Demand	Anodyne	AMY2	43	29
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000872271672	FE	On-Demand	Anodyne	CPT1A	124	40
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000872271672	FE	On-Demand	Anodyne	CPT2	49	37
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872271704	DF	On-Demand	Anodyne	AMY2	44	30
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872271704	DF	On-Demand	Anodyne	XIAP	61	37
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872271705	DF	On-Demand	Anodyne	AMY2	44	30
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872271705	DF	On-Demand	Anodyne	XIAP	61	37
O=C(Cc1ccc2c(c1)OCO2)N[C@]12CCC[C@H]1OCC2	ZINC000872271736	CD	On-Demand	Anodyne	MCHR1	16	42
O=C(Cc1ccc2c(c1)OCO2)N[C@]12CCC[C@H]1OCC2	ZINC000872271736	CD	On-Demand	Anodyne	LUXR	26	43
O=C(CN1CCN(Cc2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872271763	ED	On-Demand	Anodyne	DRD4	52	38
O=C(CN1CCN(Cc2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872271763	ED	On-Demand	Anodyne	SIGMAR1	69	44
O=C(CN1CCN(Cc2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872271763	ED	On-Demand	Anodyne	CACNA1G	15	40
O=C(CN1CCN(Cc2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872271763	ED	On-Demand	Anodyne	NPFFR1	41	37
CCOc1cccc2c1OCC(C(=O)N[C@]13CCC[C@H]1OCC3)=C2	ZINC000872271802	EF	On-Demand	Anodyne	HCN4	40	31
O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872271804	GH	On-Demand	Bother	L3MBTL3	33	41
O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@H](OC2CCC2)CC1	ZINC000872271806	GH	On-Demand	Bother	L3MBTL3	33	41
O=C(CCCn1ccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271825	CD	On-Demand	Anodyne	TBXAS1	29	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNC(=O)C1CCC1	ZINC000872271897	CD	On-Demand	Anodyne	TBK1	67	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCC[C@@H](O)c1ccccc1	ZINC000872271899	CE	On-Demand	Anodyne	AMY2	42	29
N[C@@H]1CCCCC[C@@H]1C(=O)NCC[C@H](O)c1ccccc1	ZINC000872271901	CE	On-Demand	Anodyne	AMY2	42	29
O=C(CCCNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271909	EF	On-Demand	Anodyne	PREP	17	40
O=C(CCCNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271909	EF	On-Demand	Anodyne	CAPN1	16	40
O=C(CCCNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271909	EF	On-Demand	Anodyne	CAPN2	36	40
O=C(CCCNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271909	EF	On-Demand	Anodyne	NPR	56	35
O=C(CCCNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872271909	EF	On-Demand	Anodyne	SLC12A5	57	37
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(Cc2ccccc2)CC1	ZINC000872271918	EF	On-Demand	Anodyne	CHRM2	15	41
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(Cc2ccccc2)CC1	ZINC000872271918	EF	On-Demand	Anodyne	DRD4	38	41
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(Cc2ccccc2)CC1	ZINC000872271918	EF	On-Demand	Anodyne	ACHE	36	42
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(Cc2ccccc2)CC1	ZINC000872271918	EF	On-Demand	Anodyne	SIGMAR1	69	44
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(Cc2ccccc2)CC1	ZINC000872271918	EF	On-Demand	Anodyne	CACNA1G	36	48
C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872271926	CF	On-Demand	Anodyne	ECE1	23	41
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872271984	DD	On-Demand	Anodyne	CAPN1	28	42
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872271987	DD	On-Demand	Anodyne	CAPN1	28	42
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872271990	DD	On-Demand	Anodyne	CAPN1	28	42
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872271992	DD	On-Demand	Anodyne	CAPN1	28	42
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)c1ccc(F)cc1	ZINC000872272009	FH	On-Demand	Anodyne	TAAR1	44	37
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)c1ccc(F)cc1	ZINC000872272009	FH	On-Demand	Anodyne	KCNK3	98	50
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)c1ccc(F)cc1	ZINC000872272009	FH	On-Demand	Anodyne	KCNK9	47	39
COc1ccc2[nH]cc(CC(=O)N[C@]34CCC[C@H]3OCC4)c2c1	ZINC000872272012	DF	On-Demand	Anodyne	HTR1D	32	43
COc1ccc2[nH]cc(CC(=O)N[C@]34CCC[C@H]3OCC4)c2c1	ZINC000872272012	DF	On-Demand	Anodyne	NQO2	20	45
COc1ccc2[nH]cc(CC(=O)N[C@]34CCC[C@H]3OCC4)c2c1	ZINC000872272012	DF	On-Demand	Anodyne	MTNR1A	35	46
COc1ccc2[nH]cc(CC(=O)N[C@]34CCC[C@H]3OCC4)c2c1	ZINC000872272012	DF	On-Demand	Anodyne	MTNR1B	21	46
COc1ccc2[nH]cc(CC(=O)N[C@]34CCC[C@H]3OCC4)c2c1	ZINC000872272012	DF	On-Demand	Anodyne	ABCG2	24	40
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)NC1CC1	ZINC000872272019	EE	On-Demand	Anodyne	EPHX2	29	44
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)NC1CC1	ZINC000872272019	EE	On-Demand	Anodyne	KCNK3	41	34
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000872272058	FE	On-Demand	Anodyne	ACHE	22	43
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000872272058	FE	On-Demand	Anodyne	SIGMAR1	22	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(Cn2ccnc2)cc1	ZINC000872272061	DE	On-Demand	Anodyne	CYP11B1	31	41
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(Cn2ccnc2)cc1	ZINC000872272061	DE	On-Demand	Anodyne	TBXAS1	34	43
CCOc1cn(-c2ccccc2)nc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872272086	EF	On-Demand	Anodyne	HCN1	46	34
CCOc1cn(-c2ccccc2)nc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872272086	EF	On-Demand	Anodyne	HCN4	44	34
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(Cn2ccnc2)c1	ZINC000872272112	DE	On-Demand	Anodyne	CYP19A1	15	50
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(Cn2ccnc2)c1	ZINC000872272112	DE	On-Demand	Anodyne	CYP11B1	31	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(Cn2ccnc2)c1	ZINC000872272112	DE	On-Demand	Anodyne	TBXAS1	32	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(Cn2ccnc2)c1	ZINC000872272112	DE	On-Demand	Anodyne	CYP11B2	17	42
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000872272162	GG	On-Demand	Anodyne	TRPV1	23	45
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000872272164	GG	On-Demand	Anodyne	TRPV1	23	45
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872272168	FF	On-Demand	Anodyne	GRIN2B	23	47
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872272168	FF	On-Demand	Anodyne	PREP	30	42
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872272168	FF	On-Demand	Anodyne	SLC12A5	75	42
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCCC2)nc1	ZINC000872272189	DE	On-Demand	Anodyne	HPGDS	18	48
COCCn1cc(C(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872272291	EF	On-Demand	Anodyne	CNR1	27	55
COCCn1cc(C(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872272291	EF	On-Demand	Anodyne	CNR2	49	55
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872272301	EF	On-Demand	Anodyne	SLC6A1	66	38
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872272306	EF	On-Demand	Anodyne	SLC6A1	66	38
O=C(CCN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272312	DE	On-Demand	Anodyne	HTR4	22	42
O=C(CCN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272312	DE	On-Demand	Anodyne	CCR5	42	38
O=C(CCN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272312	DE	On-Demand	Anodyne	CYP2J2	45	31
O=C(CCN1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272312	DE	On-Demand	Anodyne	SLC12A5	52	35
O=C(CCN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272315	DE	On-Demand	Anodyne	HTR4	22	42
O=C(CCN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272315	DE	On-Demand	Anodyne	CCR5	42	38
O=C(CCN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272315	DE	On-Demand	Anodyne	CYP2J2	45	31
O=C(CCN1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000872272315	DE	On-Demand	Anodyne	SLC12A5	52	35
COCCOc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872272329	DE	On-Demand	Anodyne	DRD4	42	32
C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872272330	DF	On-Demand	Anodyne	MME	16	41
C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872272334	DF	On-Demand	Anodyne	MME	16	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCC2)c1	ZINC000872272372	DF	On-Demand	Anodyne	DRD4	20	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCC2)c1	ZINC000872272372	DF	On-Demand	Anodyne	ACHE	17	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCC2)c1	ZINC000872272372	DF	On-Demand	Anodyne	CHRM3	20	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCC2)c1	ZINC000872272372	DF	On-Demand	Anodyne	SIGMAR1	20	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCC2)c1	ZINC000872272372	DF	On-Demand	Anodyne	BDKRB1	32	44
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	HTR1A	73	47
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	DRD2	41	47
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	HTR2A	45	47
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	DRD3	46	45
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	HTR7	99	47
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	SIGMAR1	17	41
O=C(CCCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872272403	FE	On-Demand	Anodyne	CYP2J2	46	33
O=C(CNc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872272429	EF	On-Demand	Anodyne	CCR2	52	35
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCCC2)nn1	ZINC000872272444	DD	On-Demand	Anodyne	SCD1	54	39
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(N2CCCC2)nn1	ZINC000872272444	DD	On-Demand	Anodyne	SCD	44	37
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000872272455	EC	On-Demand	Anodyne	EPHX2	20	63
CSc1ccc(F)cc1CNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272500	DG	On-Demand	Anodyne	P2RX7	33	40
Cc1ncc(C(F)(F)F)cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872272506	FH	On-Demand	Anodyne	LIPG	47	40
CCC(=O)N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872272507	CD	On-Demand	Anodyne	EPHX2	17	53
CCC(=O)N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872272508	CD	On-Demand	Anodyne	EPHX2	17	53
Cc1ncc(C(F)(F)F)cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872272511	FH	On-Demand	Anodyne	LIPG	47	40
CS(=O)(=O)c1ccc(OCCCC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272586	FE	On-Demand	Anodyne	MMP13	29	40
COC(=O)[C@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272590	DD	On-Demand	Anodyne	SLC6A3	16	42
COC(=O)[C@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272590	DD	On-Demand	Anodyne	CTSK	16	43
COC(=O)[C@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272590	DD	On-Demand	Anodyne	AMY2	47	32
COC(=O)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272591	DD	On-Demand	Anodyne	SLC6A3	16	42
COC(=O)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272591	DD	On-Demand	Anodyne	CTSK	16	43
COC(=O)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872272591	DD	On-Demand	Anodyne	AMY2	47	32
O=C(c1ccc(Cl)nc1C(F)(F)F)N1CCO[C@@H](C(F)F)CC1	ZINC000872272598	FG	On-Demand	Anodyne	CXCR3	27	41
O=C(CSCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272637	CE	On-Demand	Anodyne	CHRNA7	43	36
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872272652	EF	On-Demand	Anodyne	SLC6A1	128	37
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872272652	EF	On-Demand	Anodyne	SIGMAR1	42	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872272652	EF	On-Demand	Anodyne	PDE8B	15	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872272653	EF	On-Demand	Anodyne	SLC6A1	128	37
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872272653	EF	On-Demand	Anodyne	SIGMAR1	42	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872272653	EF	On-Demand	Anodyne	PDE8B	15	40
O=C(CCc1ccc2ccccc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872272660	DH	On-Demand	Anodyne	LUXR	37	42
NC(=O)[C@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272663	DC	On-Demand	Anodyne	CHRM2	20	40
NC(=O)[C@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272663	DC	On-Demand	Anodyne	CHRM3	34	40
NC(=O)[C@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272663	DC	On-Demand	Anodyne	CYP2J2	47	33
NC(=O)[C@@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272664	DC	On-Demand	Anodyne	CHRM2	20	40
NC(=O)[C@@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272664	DC	On-Demand	Anodyne	CHRM3	34	40
NC(=O)[C@@](O)(CN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872272664	DC	On-Demand	Anodyne	CYP2J2	47	33
NC(=O)[C@@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272665	DC	On-Demand	Anodyne	CHRM2	20	40
NC(=O)[C@@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272665	DC	On-Demand	Anodyne	CHRM3	34	40
NC(=O)[C@@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272665	DC	On-Demand	Anodyne	CYP2J2	47	33
NC(=O)[C@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272666	DC	On-Demand	Anodyne	CHRM2	20	40
NC(=O)[C@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272666	DC	On-Demand	Anodyne	CHRM3	34	40
NC(=O)[C@](O)(CN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872272666	DC	On-Demand	Anodyne	CYP2J2	47	33
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000872272682	GF	On-Demand	Anodyne	CPT1A	60	34
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000872272682	GF	On-Demand	Anodyne	CPT2	41	31
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872272701	GG	On-Demand	Anodyne	PPIA	24	40
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872272701	GG	On-Demand	Anodyne	PTGER1	47	35
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1=O	ZINC000872272712	ED	On-Demand	Anodyne	HTR1A	34	49
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1=O	ZINC000872272712	ED	On-Demand	Anodyne	DRD2	24	47
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1=O	ZINC000872272713	ED	On-Demand	Anodyne	HTR1A	34	49
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1=O	ZINC000872272713	ED	On-Demand	Anodyne	DRD2	24	47
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA2	62	41
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA1	53	41
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA7	41	41
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA5B	65	41
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA4	48	38
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA5A	69	41
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA12	41	40
NS(=O)(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872272746	DC	On-Demand	Anodyne	CA9	41	41
O=C(c1ccc(Cl)nc1C(F)(F)F)N1CCO[C@H](C(F)F)CC1	ZINC000872272751	FG	On-Demand	Anodyne	CXCR3	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC2(CC1)OCc1ccccc12	ZINC000872272763	EF	On-Demand	Anodyne	SIGMAR1	15	52
O=C(c1cc(F)c2ncccc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872272765	EH	On-Demand	Anodyne	L3MBTL3	47	35
O=C(c1cc(F)c2ncccc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872272769	EH	On-Demand	Anodyne	L3MBTL3	47	35
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCOCC2)c1	ZINC000872272790	ED	On-Demand	Anodyne	CHRM3	17	41
O=C(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2cc(F)ccc12	ZINC000872272827	FG	On-Demand	Anodyne	GRIN2B	15	57
O=C(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2cc(F)ccc12	ZINC000872272828	FG	On-Demand	Anodyne	GRIN2B	15	57
COc1ccccc1/C(C)=C/C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872272843	DF	On-Demand	Anodyne	KCNA3	44	46
COc1ccccc1/C(C)=C/C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872272844	DF	On-Demand	Anodyne	KCNA3	44	46
COc1ccccc1/C(C)=C\C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872272845	DF	On-Demand	Anodyne	KCNA3	44	46
COc1ccccc1/C(C)=C\C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872272846	DF	On-Demand	Anodyne	KCNA3	44	46
O=C(Cc1cccc2ncccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872272887	EH	On-Demand	Anodyne	PREP	19	40
O=C(Cc1cccc2ncccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000872272888	EH	On-Demand	Anodyne	PREP	19	40
O=C(CNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272889	DD	On-Demand	Anodyne	CTSK	16	40
O=C(CNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272889	DD	On-Demand	Anodyne	CTSL	16	41
O=C(CNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272889	DD	On-Demand	Anodyne	PREP	22	43
O=C(CNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272889	DD	On-Demand	Anodyne	NPR	59	34
O=C(CNC(=O)OCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872272889	DD	On-Demand	Anodyne	SLC12A5	69	39
O=C(Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1)c1ccc2nc[nH]c2c1	ZINC000872272914	GG	On-Demand	Anodyne	KCNK3	59	34
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872272952	CE	On-Demand	Anodyne	PREP	21	40
C[C@H]1Cc2ccccc2CN1C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872272953	CE	On-Demand	Anodyne	PREP	21	40
FC(F)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nn2)CCO1	ZINC000872272960	DE	On-Demand	Anodyne	DRD4	26	41
FC(F)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nn2)CCO1	ZINC000872272960	DE	On-Demand	Anodyne	SIGMAR1	41	38
FC(F)[C@H]1CCN(Cc2cn(Cc3ccccc3)nn2)CCO1	ZINC000872272961	DE	On-Demand	Anodyne	DRD4	26	41
FC(F)[C@H]1CCN(Cc2cn(Cc3ccccc3)nn2)CCO1	ZINC000872272961	DE	On-Demand	Anodyne	SIGMAR1	41	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000872272974	DE	On-Demand	Bother	COLA	95	35
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	MME	54	39
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	CTSK	30	40
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	TIMP3	42	35
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	AMY2	49	34
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	CAPNS1	70	33
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	REN	45	36
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	CAPN1	59	40
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	CAPN2	38	40
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272994	DE	On-Demand	Anodyne	BRCA1	51	32
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	MME	54	39
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	CTSK	30	40
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	TIMP3	42	35
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	AMY2	49	34
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	CAPNS1	70	33
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	REN	45	36
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	CAPN1	59	40
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	CAPN2	38	40
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872272995	DE	On-Demand	Anodyne	BRCA1	51	32
NC(=O)c1cn(CC(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc12	ZINC000872272997	ED	On-Demand	Anodyne	CNR2	23	44
O=C(NC[C@]12COCCN1C(=O)OC2)c1ccc(-c2cccc(F)c2)s1	ZINC000872273096	GF	On-Demand	Anodyne	HSD17B2	32	41
O=C(NC[C@@]12COCCN1C(=O)OC2)c1ccc(-c2cccc(F)c2)s1	ZINC000872273097	GF	On-Demand	Anodyne	HSD17B2	32	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC2(Cc3ccccc3)CCC2)C1	ZINC000872273155	CE	On-Demand	Anodyne	SLC12A5	47	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCCCc3ccccc32)C1	ZINC000872273173	CF	On-Demand	Anodyne	AVPR2	40	48
O=C(c1cccc(CN2CCO[C@@H](C(F)F)CC2)c1)C(F)(F)F	ZINC000872273214	EG	On-Demand	Anodyne	ACHE	25	44
O=C(c1cccc(CN2CCO[C@H](C(F)F)CC2)c1)C(F)(F)F	ZINC000872273215	EG	On-Demand	Anodyne	ACHE	25	44
O=C(COc1ccc(C(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273242	EF	On-Demand	Anodyne	TRAR	44	43
O=C(CCOCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273258	CE	On-Demand	Anodyne	SLC12A5	55	36
CCC(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872273268	DE	On-Demand	Anodyne	KCNK3	62	34
O=C(CCCOc1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273323	DG	On-Demand	Anodyne	TRAR	27	41
CN(C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccc(-c2ccccc2)cc1	ZINC000872273359	DG	On-Demand	Anodyne	FASN	25	42
O=C(Cc1cccc(Br)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872273360	DF	On-Demand	Anodyne	LUXR	22	42
O=C(CCc1ccc(OC(F)(F)F)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273362	EG	On-Demand	Anodyne	TRAR	29	41
O=C(CCCOCc1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273423	DF	On-Demand	Anodyne	SLC12A5	46	35
O=C(CNC(=O)c1cc(-c2ccccc2)on1)N[C@]12CCC[C@H]1OCC2	ZINC000872273426	FD	On-Demand	Anodyne	HDAC10	15	47
CC(=O)[C@@](C#N)(CCN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872273442	EF	On-Demand	Mild	CYP2J2	48	34
CC(=O)[C@](C#N)(CCN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872273445	EF	On-Demand	Mild	CYP2J2	48	34
CC(=O)[C@](C#N)(CCN1CCO[C@@H](C(F)F)CC1)c1ccccc1	ZINC000872273448	EF	On-Demand	Mild	CYP2J2	48	34
CC(=O)[C@@](C#N)(CCN1CCO[C@H](C(F)F)CC1)c1ccccc1	ZINC000872273450	EF	On-Demand	Mild	CYP2J2	48	34
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872273453	EF	On-Demand	Anodyne	PAPA1_CARPA	24	46
NC(=O)c1ccc(CCN2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872273457	CD	On-Demand	Anodyne	PTGER4	41	32
NC(=O)c1ccc(CCN2CCO[C@H](C(F)F)CC2)cc1	ZINC000872273459	CD	On-Demand	Anodyne	PTGER4	41	32
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273486	FE	On-Demand	Anodyne	F2	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273486	FE	On-Demand	Anodyne	GRIN2B	21	43
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273486	FE	On-Demand	Anodyne	C3AR1	51	48
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273486	FE	On-Demand	Anodyne	EPHX2	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273486	FE	On-Demand	Anodyne	BIRC2	27	45
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273487	FE	On-Demand	Anodyne	F2	15	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273487	FE	On-Demand	Anodyne	GRIN2B	21	43
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273487	FE	On-Demand	Anodyne	C3AR1	51	48
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273487	FE	On-Demand	Anodyne	EPHX2	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872273487	FE	On-Demand	Anodyne	BIRC2	27	45
CCOc1ccccc1[C@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(C)=O	ZINC000872273508	FE	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(C)=O	ZINC000872273508	FE	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1[C@@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(C)=O	ZINC000872273510	FE	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@@H](CC(=O)N[C@]12CCC[C@H]1OCC2)NC(C)=O	ZINC000872273510	FE	On-Demand	Anodyne	HCN4	43	33
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273600	FE	On-Demand	Anodyne	ACE	45	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273600	FE	On-Demand	Anodyne	FKBP1A	37	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273600	FE	On-Demand	Anodyne	MME	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273601	FE	On-Demand	Anodyne	ACE	45	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273601	FE	On-Demand	Anodyne	FKBP1A	37	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000872273601	FE	On-Demand	Anodyne	MME	17	40
Cn1cc(-c2cccc(C(=O)N[C@H]3CCNCC(C)(C)C3)c2)cn1	ZINC000872273605	EF	On-Demand	Anodyne	TYRO3	28	44
Cn1cc(-c2cccc(C(=O)N[C@@H]3CCNCC(C)(C)C3)c2)cn1	ZINC000872273606	EF	On-Demand	Anodyne	TYRO3	28	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1Br	ZINC000872273661	GE	On-Demand	Anodyne	ADRB2	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1Br	ZINC000872273661	GE	On-Demand	Anodyne	ADRB1	48	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](O)COc1ccccc1Br	ZINC000872273661	GE	On-Demand	Anodyne	ABCB1	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1Br	ZINC000872273662	GE	On-Demand	Anodyne	ADRB2	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1Br	ZINC000872273662	GE	On-Demand	Anodyne	ADRB1	48	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1Br	ZINC000872273662	GE	On-Demand	Anodyne	ABCB1	15	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn2ccccc12	ZINC000872273675	CD	On-Demand	Anodyne	JAK3	19	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn2ccccc12	ZINC000872273675	CD	On-Demand	Anodyne	JAK1	15	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn2ccccc12	ZINC000872273675	CD	On-Demand	Anodyne	TYK2	23	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cnn2ccccc12	ZINC000872273675	CD	On-Demand	Anodyne	EPHB3	34	44
COc1ccccc1/C(C)=C\C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872273700	DF	On-Demand	Anodyne	KCNA3	45	41
COc1ccccc1/C(C)=C/C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872273701	DF	On-Demand	Anodyne	KCNA3	45	41
O=C(COCC(=O)N[C@]12CCC[C@H]1OCC2)NCc1cccnc1	ZINC000872273768	EC	On-Demand	Anodyne	NAMPT	44	38
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872273805	ED	On-Demand	Anodyne	DRD4	25	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872273806	ED	On-Demand	Anodyne	DRD4	25	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872273814	FE	On-Demand	Anodyne	CPT1A	121	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872273814	FE	On-Demand	Anodyne	CPT2	47	35
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872273815	FE	On-Demand	Anodyne	CPT1A	121	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872273815	FE	On-Demand	Anodyne	CPT2	47	35
O=C(CCCCC(=O)c1ccccc1)N[C@]12CCC[C@H]1OCC2	ZINC000872273821	DG	On-Demand	Anodyne	CYP2J2	45	31
O=C(CN[C@H](c1ccccc1)C(F)(F)F)N[C@]12CCC[C@H]1OCC2	ZINC000872273869	EF	On-Demand	Anodyne	CTSS	15	40
O=C(CN[C@@H](c1ccccc1)C(F)(F)F)N[C@]12CCC[C@H]1OCC2	ZINC000872273870	EF	On-Demand	Anodyne	CTSS	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000872273875	DE	On-Demand	Anodyne	CTSK	22	42
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(C(=O)c2ccccc2)CC1	ZINC000872273893	EE	On-Demand	Anodyne	L3MBTL3	81	38
COCCCOc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872273900	DF	On-Demand	Anodyne	DRD4	41	31
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872274001	DD	On-Demand	Anodyne	INHA	18	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872274002	DD	On-Demand	Anodyne	INHA	18	42
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	ACE	78	38
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	MME	126	38
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	ANPEP	59	35
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	TIMP3	79	38
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	ACE2	82	36
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	FPR1	51	37
C[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274036	CF	On-Demand	Anodyne	BRCA1	44	32
O=C(CCNC(=O)[C@]12CCC[C@H]1CNC2)OCc1ccccc1	ZINC000872274076	DD	On-Demand	Anodyne	SLC12A5	65	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)C1	ZINC000872274079	DE	On-Demand	Anodyne	Q8WSF8_APLCA	19	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)C1	ZINC000872274080	DE	On-Demand	Anodyne	Q8WSF8_APLCA	19	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)C1	ZINC000872274081	DE	On-Demand	Anodyne	Q8WSF8_APLCA	19	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)C1	ZINC000872274082	DE	On-Demand	Anodyne	Q8WSF8_APLCA	19	47
O=C(CCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274098	EE	On-Demand	Anodyne	HTR1A	46	45
O=C(CCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274098	EE	On-Demand	Anodyne	DRD2	23	42
O=C(CCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274098	EE	On-Demand	Anodyne	HTR2A	27	42
O=C(CCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274098	EE	On-Demand	Anodyne	DRD3	30	42
O=C(CCN1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274098	EE	On-Demand	Anodyne	HTR7	60	42
COc1cccc(SCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872274100	DF	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(SCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872274100	DF	On-Demand	Anodyne	MTNR1B	31	42
COc1cccc(SCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872274100	DF	On-Demand	Anodyne	FAS	29	44
O=C(CN1CCN(c2ccccn2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274151	ED	On-Demand	Anodyne	SLC27A1	49	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000872274196	EF	On-Demand	Anodyne	ETHR	22	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000872274197	EF	On-Demand	Anodyne	ETHR	22	45
O=C(C[C@@H]1CCc2ccccc2C1)N[C@]12CCC[C@H]1OCC2	ZINC000872274206	CG	On-Demand	Anodyne	PREP	27	41
O=C(C[C@H]1CCc2ccccc2C1)N[C@]12CCC[C@H]1OCC2	ZINC000872274207	CG	On-Demand	Anodyne	PREP	27	41
COc1ccc(-n2cc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)nn2)cc1	ZINC000872274286	ED	On-Demand	Anodyne	FIMH	21	41
O=C(CCSCc1nc(O)c2ccccc2n1)N[C@]12CCC[C@H]1OCC2	ZINC000872274291	FF	On-Demand	Anodyne	TNKS	69	39
CN(CCCC(=O)N[C@]12CCC[C@H]1OCC2)C1=NS(=O)(=O)c2ccccc21	ZINC000872274301	GD	On-Demand	Anodyne	KCNA3	32	40
Cc1ccc(OCc2cccc(C(=O)N[C@]34CCC[C@H]3OCC4)c2)cn1	ZINC000872274382	FG	On-Demand	Anodyne	ADAM17	42	38
O=C(CCCCCNC(=O)NC1CCCCC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274395	FG	On-Demand	Anodyne	EPHX2	18	50
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872274416	EH	On-Demand	Anodyne	CCR2	64	38
CN(C)C(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872274442	DE	On-Demand	Anodyne	KCNK3	60	34
O=C(CCN1CCN(c2ccccn2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274449	ED	On-Demand	Anodyne	HTR1A	21	49
O=C(CCN1CCN(c2ccccn2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274449	ED	On-Demand	Anodyne	DRD2	17	46
O=C(CCN1CCN(c2ccccn2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274449	ED	On-Demand	Anodyne	DRD4	34	43
O=C(CCN1CCN(c2ccccn2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872274449	ED	On-Demand	Anodyne	HTR7	15	46
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872274470	CD	On-Demand	Bother	CACNA1C	44	35
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872274470	CD	On-Demand	Bother	CACNA1D	70	35
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872274470	CD	On-Demand	Bother	LUXR	26	53
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872274470	CD	On-Demand	Bother	TRAR	19	53
Cc1cc(-c2noc([C@H](C)NC(=O)[C@@H]3CCCCC[C@@H]3N)n2)ccc1F	ZINC000872274473	FG	On-Demand	Anodyne	SPHK1	20	40
Cc1cc(-c2noc([C@@H](C)NC(=O)[C@@H]3CCCCC[C@@H]3N)n2)ccc1F	ZINC000872274474	FG	On-Demand	Anodyne	SPHK1	20	40
c1ccc2sc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872274529	DI	On-Demand	Anodyne	LTA4H	37	45
c1ccc2sc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872274529	DI	On-Demand	Anodyne	SSTR5	20	40
c1ccc2sc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872274530	DI	On-Demand	Anodyne	LTA4H	37	45
c1ccc2sc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872274530	DI	On-Demand	Anodyne	SSTR5	20	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cc(F)ccc1F	ZINC000872274533	EG	On-Demand	Anodyne	CCR3	36	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cc(F)ccc1F	ZINC000872274534	EG	On-Demand	Anodyne	CCR3	36	41
O=C(NCc1cccnc1-n1ccnc1)[C@]12CCC[C@H]1CNC2	ZINC000872274535	DD	On-Demand	Anodyne	NOS2	90	36
O[C@@H]1CCCC[C@H]1N1CCC[C@H](OC2CCC2)CC1	ZINC000872274543	CF	On-Demand	Anodyne	SLC18A3	54	58
O[C@@H]1CCCC[C@H]1N1CCC[C@@H](OC2CCC2)CC1	ZINC000872274545	CF	On-Demand	Anodyne	SLC18A3	54	58
O=[N+]([O-])c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872274563	EG	On-Demand	Bother	LTA4H	46	58
O=[N+]([O-])c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274564	EG	On-Demand	Bother	LTA4H	46	58
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	HTR2A	15	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	CCR3	78	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	CHRNA7	15	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	EPHX2	21	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	TERT	16	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274566	EH	On-Demand	Anodyne	MCHR1	43	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	HTR2A	15	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	CCR3	78	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	CHRNA7	15	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	EPHX2	21	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	TERT	16	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872274567	EH	On-Demand	Anodyne	MCHR1	43	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCN(c2ncccn2)CC1	ZINC000872274622	GD	On-Demand	Anodyne	DRD4	15	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCN(c2ncccn2)CC1	ZINC000872274624	GD	On-Demand	Anodyne	DRD4	15	42
CN(C)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872274637	DE	On-Demand	Anodyne	CTSK	15	42
CN(C)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872274637	DE	On-Demand	Anodyne	AMY2	46	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2N2CCCCC2)C1	ZINC000872274645	CF	On-Demand	Anodyne	KCNQ2	86	47
Cc1oc(-c2ccccc2)nc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274696	EJ	On-Demand	Anodyne	PPARG	71	39
Cc1oc(-c2ccccc2)nc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274696	EJ	On-Demand	Anodyne	PPARA	73	39
Cc1oc(-c2ccccc2)nc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274696	EJ	On-Demand	Anodyne	PDE8B	74	44
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274697	EJ	On-Demand	Anodyne	PPARG	71	39
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274697	EJ	On-Demand	Anodyne	PPARA	73	39
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274697	EJ	On-Demand	Anodyne	PDE8B	74	44
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274722	FF	On-Demand	Bother	ACOX1	46	33
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274722	FF	On-Demand	Bother	CCR3	15	46
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274722	FF	On-Demand	Bother	ABCB1	49	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274723	FF	On-Demand	Bother	ACOX1	46	33
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274723	FF	On-Demand	Bother	CCR3	15	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274723	FF	On-Demand	Bother	ABCB1	49	43
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274724	FF	On-Demand	Bother	ACOX1	46	33
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274724	FF	On-Demand	Bother	CCR3	15	46
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274724	FF	On-Demand	Bother	ABCB1	49	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274725	FF	On-Demand	Bother	ACOX1	46	33
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274725	FF	On-Demand	Bother	CCR3	15	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274725	FF	On-Demand	Bother	ABCB1	49	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1N1CCCC1=O	ZINC000872274732	GG	On-Demand	Anodyne	KCNQ2	66	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1N1CCCC1=O	ZINC000872274733	GG	On-Demand	Anodyne	KCNQ2	66	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274737	EF	On-Demand	Anodyne	DRD4	21	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274737	EF	On-Demand	Anodyne	LTA4H	50	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274737	EF	On-Demand	Anodyne	HRH3	30	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274737	EF	On-Demand	Anodyne	CPT1A	55	33
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274738	EF	On-Demand	Anodyne	DRD4	21	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274738	EF	On-Demand	Anodyne	LTA4H	50	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274738	EF	On-Demand	Anodyne	HRH3	30	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccccc1	ZINC000872274738	EF	On-Demand	Anodyne	CPT1A	55	33
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274769	EH	On-Demand	Anodyne	HDAC10	21	42
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274769	EH	On-Demand	Anodyne	HDAC11	17	42
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274769	EH	On-Demand	Anodyne	KCNK3	58	38
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274769	EH	On-Demand	Anodyne	KCNK9	47	38
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274770	EH	On-Demand	Anodyne	HDAC10	21	42
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274770	EH	On-Demand	Anodyne	HDAC11	17	42
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274770	EH	On-Demand	Anodyne	KCNK3	58	38
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872274770	EH	On-Demand	Anodyne	KCNK9	47	38
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274771	EH	On-Demand	Anodyne	HDAC10	21	42
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274771	EH	On-Demand	Anodyne	HDAC11	17	42
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274771	EH	On-Demand	Anodyne	KCNK3	58	38
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274771	EH	On-Demand	Anodyne	KCNK9	47	38
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274772	EH	On-Demand	Anodyne	HDAC10	21	42
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274772	EH	On-Demand	Anodyne	HDAC11	17	42
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274772	EH	On-Demand	Anodyne	KCNK3	58	38
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872274772	EH	On-Demand	Anodyne	KCNK9	47	38
CCOc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274795	EG	On-Demand	Anodyne	DRD4	18	41
CCOc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274795	EG	On-Demand	Anodyne	KCNQ2	41	32
CCOc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274795	EG	On-Demand	Anodyne	SSTR5	44	35
CCOc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274795	EG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872274795	EG	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274796	EG	On-Demand	Anodyne	DRD4	18	41
CCOc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274796	EG	On-Demand	Anodyne	KCNQ2	41	32
CCOc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274796	EG	On-Demand	Anodyne	SSTR5	44	35
CCOc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274796	EG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872274796	EG	On-Demand	Anodyne	HCN4	46	36
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1nc(-c2ccccn2)cs1	ZINC000872274828	DG	On-Demand	Anodyne	NPY5R	17	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1nc(-c2ccccn2)cs1	ZINC000872274828	DG	On-Demand	Anodyne	KCNN1	29	46
O=C(CCc1ccc(Br)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872274844	EG	On-Demand	Anodyne	TRAR	26	48
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274891	GG	On-Demand	Anodyne	HRH3	28	46
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274891	GG	On-Demand	Anodyne	SIGMAR1	28	48
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274891	GG	On-Demand	Anodyne	MCHR1	24	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274894	GG	On-Demand	Anodyne	HRH3	28	46
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274894	GG	On-Demand	Anodyne	SIGMAR1	28	48
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(CN2CCCC2)cc1	ZINC000872274894	GG	On-Demand	Anodyne	MCHR1	24	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(F)cc(Cl)c1	ZINC000872274934	CF	On-Demand	Anodyne	CACNA1I	44	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872275007	FE	On-Demand	Anodyne	DRD4	26	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872275007	FE	On-Demand	Anodyne	SIGMAR1	17	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872275007	FE	On-Demand	Anodyne	EPHX2	33	45
Cc1ccccc1CCNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275009	EG	On-Demand	Anodyne	SLC6A1	50	37
Cc1ccccc1CCNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275010	EG	On-Demand	Anodyne	SLC6A1	50	37
O=S(=O)(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000872275014	FH	On-Demand	Anodyne	APP	40	36
O=S(=O)(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000872275015	FH	On-Demand	Anodyne	APP	40	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872275037	EF	On-Demand	Anodyne	HRH3	24	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872275037	EF	On-Demand	Anodyne	SIGMAR1	27	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872275037	EF	On-Demand	Anodyne	CCR3	44	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872275037	EF	On-Demand	Anodyne	MLNR	41	39
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	ESR1	74	49
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	ESR2	50	49
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	LTA4H	59	44
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	HRH3	74	46
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	PSMB2	43	43
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275040	GF	On-Demand	Anodyne	PSMB1	47	43
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	ESR1	74	49
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	ESR2	50	49
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	LTA4H	59	44
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	HRH3	74	46
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	PSMB2	43	43
CN(C)S(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275041	GF	On-Demand	Anodyne	PSMB1	47	43
COc1ccc(CN(C)C(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872275065	GG	On-Demand	Anodyne	ACHE	15	44
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872275066	GG	On-Demand	Anodyne	ACHE	15	44
CN(C)CCOc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872275077	EE	On-Demand	Anodyne	LTA4H	23	40
CN(C)CCOc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872275077	EE	On-Demand	Anodyne	ESRRG	44	33
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1F	ZINC000872275082	EF	On-Demand	Anodyne	SLC6A1	48	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1F	ZINC000872275083	EF	On-Demand	Anodyne	SLC6A1	48	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@H]1COc2ccccc2O1	ZINC000872275085	FE	On-Demand	Anodyne	ADRA2B	16	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@@H]1COc2ccccc2O1	ZINC000872275086	FE	On-Demand	Anodyne	ADRA2B	16	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@H]1COc2ccccc2O1	ZINC000872275087	FE	On-Demand	Anodyne	ADRA2B	16	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@@H]1COc2ccccc2O1	ZINC000872275088	FE	On-Demand	Anodyne	ADRA2B	16	41
C[C@H](NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275095	EH	On-Demand	Anodyne	XIAP	43	38
C[C@H](NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275095	EH	On-Demand	Anodyne	BIRC8	46	32
C[C@H](NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275096	EH	On-Demand	Anodyne	XIAP	43	38
C[C@H](NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275096	EH	On-Demand	Anodyne	BIRC8	46	32
c1ccc(Cn2nnnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275098	EF	On-Demand	Anodyne	SIGMAR1	31	43
c1ccc(Cn2nnnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275099	EF	On-Demand	Anodyne	SIGMAR1	31	43
CCOc1ccccc1C(F)(F)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872275107	EG	On-Demand	Anodyne	HCN1	42	33
CCOc1ccccc1C(F)(F)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872275107	EG	On-Demand	Anodyne	HCN4	42	33
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275119	EF	On-Demand	Anodyne	HTR7	20	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275119	EF	On-Demand	Anodyne	PREP	46	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275119	EF	On-Demand	Anodyne	DPP8	17	45
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275120	EF	On-Demand	Anodyne	HTR7	20	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275120	EF	On-Demand	Anodyne	PREP	46	38
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872275120	EF	On-Demand	Anodyne	DPP8	17	45
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275136	EG	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275136	EG	On-Demand	Anodyne	ACOX1	80	36
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275136	EG	On-Demand	Anodyne	ABCB1	60	43
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275138	EG	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275138	EG	On-Demand	Anodyne	ACOX1	80	36
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275138	EG	On-Demand	Anodyne	ABCB1	60	43
Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275139	EG	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275139	EG	On-Demand	Anodyne	ACOX1	80	36
Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275139	EG	On-Demand	Anodyne	ABCB1	60	43
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275140	EG	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275140	EG	On-Demand	Anodyne	ACOX1	80	36
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275140	EG	On-Demand	Anodyne	ABCB1	60	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCCc2ccccc21	ZINC000872275141	EG	On-Demand	Anodyne	DRD4	22	56
CCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275142	EG	On-Demand	Anodyne	CHRM2	24	40
CCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275142	EG	On-Demand	Anodyne	CHRM1	25	40
CCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275142	EG	On-Demand	Anodyne	SLC6A1	98	41
CCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275142	EG	On-Demand	Anodyne	CHRM3	33	40
CCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275142	EG	On-Demand	Anodyne	CCR5	41	36
CCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275143	EG	On-Demand	Anodyne	CHRM2	24	40
CCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275143	EG	On-Demand	Anodyne	CHRM1	25	40
CCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275143	EG	On-Demand	Anodyne	SLC6A1	98	41
CCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275143	EG	On-Demand	Anodyne	CHRM3	33	40
CCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275143	EG	On-Demand	Anodyne	CCR5	41	36
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCCc2ccccc21	ZINC000872275145	EG	On-Demand	Anodyne	DRD4	22	56
O[C@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275165	EF	On-Demand	Anodyne	ADRB2	18	46
O[C@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275165	EF	On-Demand	Anodyne	ADRB1	16	46
O[C@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275165	EF	On-Demand	Anodyne	ABCB1	73	47
O[C@@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275166	EF	On-Demand	Anodyne	ADRB2	18	46
O[C@@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275166	EF	On-Demand	Anodyne	ADRB1	16	46
O[C@@H](COc1ccccc1F)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275166	EF	On-Demand	Anodyne	ABCB1	73	47
O[C@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275168	EF	On-Demand	Anodyne	ADRB2	18	46
O[C@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275168	EF	On-Demand	Anodyne	ADRB1	16	46
O[C@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275168	EF	On-Demand	Anodyne	ABCB1	73	47
O[C@@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275169	EF	On-Demand	Anodyne	ADRB2	18	46
O[C@@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275169	EF	On-Demand	Anodyne	ADRB1	16	46
O[C@@H](COc1ccccc1F)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872275169	EF	On-Demand	Anodyne	ABCB1	73	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872275180	FG	On-Demand	Anodyne	PRNP	50	39
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872275180	FG	On-Demand	Anodyne	RPS6KA3	25	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872275180	FG	On-Demand	Anodyne	NAMPT	46	63
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872275180	FG	On-Demand	Anodyne	KCNK3	15	43
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275184	CG	On-Demand	Anodyne	SLC6A3	30	50
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275184	CG	On-Demand	Anodyne	SLC18A3	15	50
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275184	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275185	CG	On-Demand	Anodyne	SLC6A3	30	50
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275185	CG	On-Demand	Anodyne	SLC18A3	15	50
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275185	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275186	CG	On-Demand	Anodyne	SLC6A3	30	50
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275186	CG	On-Demand	Anodyne	SLC18A3	15	50
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275186	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275187	CG	On-Demand	Anodyne	SLC6A3	30	50
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275187	CG	On-Demand	Anodyne	SLC18A3	15	50
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872275187	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
c1cc(CCN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872275190	CG	On-Demand	Anodyne	HRH3	18	64
c1cc(CCN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872275190	CG	On-Demand	Anodyne	SIGMAR1	22	40
c1cc(CCN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872275191	CG	On-Demand	Anodyne	HRH3	18	64
c1cc(CCN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872275191	CG	On-Demand	Anodyne	SIGMAR1	22	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(F)c(NC(=O)CCN3CCOCC3)c2)C1	ZINC000872275216	GD	On-Demand	Anodyne	EPHX2	24	45
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	SLC6A4	16	49
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	KCNH2	17	49
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	LTA4H	55	44
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	HRH3	118	55
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	SIGMAR1	22	54
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	PSMB2	40	42
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	PSMB1	44	42
N#Cc1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275243	EH	On-Demand	Mild	MEN1	65	55
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	SLC6A4	16	49
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	KCNH2	17	49
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	LTA4H	55	44
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	HRH3	118	55
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	SIGMAR1	22	54
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	PSMB2	40	42
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	PSMB1	44	42
N#Cc1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275245	EH	On-Demand	Mild	MEN1	65	55
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	DRD2	17	48
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	ACHE	35	46
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	SIGMAR1	35	42
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	SSTR5	45	37
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	CCR3	28	45
CN(C)C(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275262	EG	On-Demand	Anodyne	MCHR1	26	42
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	DRD2	17	48
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	ACHE	35	46
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	SIGMAR1	35	42
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	SSTR5	45	37
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	CCR3	28	45
CN(C)C(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275264	EG	On-Demand	Anodyne	MCHR1	26	42
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872275284	DE	On-Demand	Bother	CACNA1C	40	33
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872275284	DE	On-Demand	Bother	CACNA1D	60	33
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872275284	DE	On-Demand	Bother	LUXR	36	54
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@]12CCC[C@H]1OCC2	ZINC000872275284	DE	On-Demand	Bother	TRAR	17	45
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	ESR1	60	43
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	ESR2	44	43
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	LTA4H	59	46
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	HRH3	50	46
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	CCR3	15	60
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	CHRNA10	84	56
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	PSMB2	41	41
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	PSMB1	45	41
N#Cc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275286	DG	On-Demand	Mild	MEN1	44	41
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	ESR1	60	43
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	ESR2	44	43
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	LTA4H	59	46
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	HRH3	50	46
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	CCR3	15	60
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	CHRNA10	84	56
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	PSMB2	41	41
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	PSMB1	45	41
N#Cc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275288	DG	On-Demand	Mild	MEN1	44	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872275294	EE	On-Demand	Anodyne	POLG_HCV1	26	43
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872275295	EE	On-Demand	Anodyne	POLG_HCV1	26	43
CN1CCN(c2cccc(C(=O)N[C@]34CCC[C@H]3OCC4)n2)CC1	ZINC000872275328	ED	On-Demand	Anodyne	HSD11B1	15	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275334	DG	On-Demand	Anodyne	DRD4	20	50
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275334	DG	On-Demand	Anodyne	SLC6A1	62	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275334	DG	On-Demand	Anodyne	LTA4H	35	55
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275334	DG	On-Demand	Anodyne	SIGMAR1	20	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275336	DG	On-Demand	Anodyne	DRD4	20	50
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275336	DG	On-Demand	Anodyne	SLC6A1	62	36
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275336	DG	On-Demand	Anodyne	LTA4H	35	55
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872275336	DG	On-Demand	Anodyne	SIGMAR1	20	43
COc1ccc(-c2cncc(C(=O)N[C@]34CCC[C@H]3OCC4)c2)cc1	ZINC000872275370	EG	On-Demand	Anodyne	CYP11B2	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1	ZINC000872275371	GE	On-Demand	Anodyne	EPHB3	42	35
O=C(Nc1ccc(N2CCOCC2)cc1)[C@]12CCC[C@H]1CNC2	ZINC000872275378	DD	On-Demand	Anodyne	STAT6	41	30
COc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872275413	EG	On-Demand	Anodyne	KCNQ2	40	35
COc1ccccc1NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872275414	EG	On-Demand	Anodyne	KCNQ2	40	35
COc1ccccc1NC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872275415	EG	On-Demand	Anodyne	KCNQ2	40	35
COc1ccccc1NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872275416	EG	On-Demand	Anodyne	KCNQ2	40	35
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000872275417	EG	On-Demand	Anodyne	HTR2B	16	59
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000872275417	EG	On-Demand	Anodyne	PARP1	17	44
c1ccc2c(c1)OC[C@@H](CN1CCC[C@H](OC3CCC3)CC1)O2	ZINC000872275432	DG	On-Demand	Anodyne	ADRA2B	23	53
c1ccc2c(c1)OC[C@@H](CN1CCC[C@H](OC3CCC3)CC1)O2	ZINC000872275432	DG	On-Demand	Anodyne	ADRA2C	17	42
c1ccc2c(c1)OC[C@@H](CN1CCC[C@@H](OC3CCC3)CC1)O2	ZINC000872275433	DG	On-Demand	Anodyne	ADRA2B	23	53
c1ccc2c(c1)OC[C@@H](CN1CCC[C@@H](OC3CCC3)CC1)O2	ZINC000872275433	DG	On-Demand	Anodyne	ADRA2C	17	42
c1ccc2c(c1)OC[C@H](CN1CCC[C@H](OC3CCC3)CC1)O2	ZINC000872275434	DG	On-Demand	Anodyne	ADRA2B	23	53
c1ccc2c(c1)OC[C@H](CN1CCC[C@H](OC3CCC3)CC1)O2	ZINC000872275434	DG	On-Demand	Anodyne	ADRA2C	17	42
c1ccc2c(c1)OC[C@H](CN1CCC[C@@H](OC3CCC3)CC1)O2	ZINC000872275435	DG	On-Demand	Anodyne	ADRA2B	23	53
c1ccc2c(c1)OC[C@H](CN1CCC[C@@H](OC3CCC3)CC1)O2	ZINC000872275435	DG	On-Demand	Anodyne	ADRA2C	17	42
CN(C)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872275467	DE	On-Demand	Anodyne	OPRK1	22	40
CN(C)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872275467	DE	On-Demand	Anodyne	AMY2	49	34
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	ESR1	86	41
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	DRD2	15	50
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	SLC6A1	51	36
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	HRH1	25	44
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	SLC6A3	15	40
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	KCNH2	17	44
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	ESR2	58	41
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	LTA4H	93	60
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	HRH3	83	55
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	SIGMAR1	42	46
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	NPY1R	42	35
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	CHRNA10	67	45
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	PSMB2	51	50
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	PSMB1	56	51
c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275471	CG	On-Demand	Anodyne	MEN1	42	39
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	ESR1	86	41
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	DRD2	15	50
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	SLC6A1	51	36
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	HRH1	25	44
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	SLC6A3	15	40
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	KCNH2	17	44
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	ESR2	58	41
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	LTA4H	93	60
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	HRH3	83	55
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	SIGMAR1	42	46
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	NPY1R	42	35
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	CHRNA10	67	45
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	PSMB2	51	50
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	PSMB1	56	51
c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275475	CG	On-Demand	Anodyne	MEN1	42	39
COc1ccc(CNC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872275501	GG	On-Demand	Anodyne	SLC5A7	34	41
COc1ccc(CNC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872275501	GG	On-Demand	Anodyne	EHMT2	48	31
COc1ccc(CNC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872275504	GG	On-Demand	Anodyne	SLC5A7	34	41
COc1ccc(CNC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872275504	GG	On-Demand	Anodyne	EHMT2	48	31
O=C(NCc1ccc(-n2ccnc2)nc1)[C@]12CCC[C@H]1CNC2	ZINC000872275528	DD	On-Demand	Anodyne	NOS2	96	39
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275534	EI	On-Demand	Anodyne	DRD4	16	43
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275534	EI	On-Demand	Anodyne	CHRM3	18	40
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275534	EI	On-Demand	Anodyne	KCNQ2	56	34
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275534	EI	On-Demand	Anodyne	BIRC2	42	35
C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872275579	FI	On-Demand	Anodyne	KCNQ2	59	38
C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872275579	FI	On-Demand	Anodyne	EPHB3	42	32
C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872275587	FI	On-Demand	Anodyne	KCNQ2	59	38
C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872275587	FI	On-Demand	Anodyne	EPHB3	42	32
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1F	ZINC000872275588	GG	On-Demand	Anodyne	AVPR1B	45	32
COc1ccc(CN(C)C(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1F	ZINC000872275590	GG	On-Demand	Anodyne	AVPR1B	45	32
c1csc(-c2noc(CCCN3CCC[C@H](OC4CCC4)CC3)n2)c1	ZINC000872275609	FI	On-Demand	Anodyne	ETHR	31	41
c1csc(-c2noc(CCCN3CCC[C@@H](OC4CCC4)CC3)n2)c1	ZINC000872275613	FI	On-Demand	Anodyne	ETHR	31	41
c1csc(-c2noc(CN3CCC[C@H](OC4CCC4)CC3)n2)c1	ZINC000872275620	EH	On-Demand	Anodyne	ETHR	32	43
c1csc(-c2noc(CN3CCC[C@@H](OC4CCC4)CC3)n2)c1	ZINC000872275624	EH	On-Demand	Anodyne	ETHR	32	43
O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275631	GI	On-Demand	Anodyne	ACHE	17	43
O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275631	GI	On-Demand	Anodyne	HRH2	28	45
O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275631	GI	On-Demand	Anodyne	CHRM3	21	42
O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275631	GI	On-Demand	Anodyne	CCR3	15	40
O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275631	GI	On-Demand	Anodyne	MCHR1	18	42
O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275644	GI	On-Demand	Anodyne	ACHE	17	43
O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275644	GI	On-Demand	Anodyne	HRH2	28	45
O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275644	GI	On-Demand	Anodyne	CHRM3	21	42
O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275644	GI	On-Demand	Anodyne	CCR3	15	40
O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275644	GI	On-Demand	Anodyne	MCHR1	18	42
CN(C)CCOc1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872275647	DD	On-Demand	Anodyne	EPHX2	26	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2-n2ccnc2)C1	ZINC000872275706	CD	On-Demand	Anodyne	NOS2	53	31
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(Oc2ccccc2)ccn1	ZINC000872275721	DG	On-Demand	Anodyne	RAF1	48	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)C1	ZINC000872275774	FG	On-Demand	Anodyne	KCNQ2	41	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)C1	ZINC000872275774	FG	On-Demand	Anodyne	TEK	18	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)C1	ZINC000872275774	FG	On-Demand	Anodyne	LIPG	40	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1	ZINC000872275783	EG	On-Demand	Anodyne	CHEK2	69	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1	ZINC000872275783	EG	On-Demand	Anodyne	HPSE	22	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1	ZINC000872275783	EG	On-Demand	Anodyne	NR2E3	68	37
O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@]12CCC[C@H]1OCC2	ZINC000872275790	ED	On-Demand	Anodyne	PYGL	56	39
O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@]12CCC[C@H]1OCC2	ZINC000872275790	ED	On-Demand	Anodyne	PLD2	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCc2ccccc2C1	ZINC000872275813	DE	On-Demand	Anodyne	HTR7	17	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCc2ccccc2C1	ZINC000872275813	DE	On-Demand	Anodyne	NOD2	40	34
N#CCCn1cc(C(=O)CN2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000872275835	GI	On-Demand	Mild	CNR1	17	45
N#CCCn1cc(C(=O)CN2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000872275835	GI	On-Demand	Mild	CNR2	22	45
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	ADRB2	19	43
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	ADRB1	21	43
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	HRH1	23	49
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	ACOX1	71	37
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	CCR3	33	49
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275836	FG	On-Demand	Anodyne	ABCB1	77	60
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	ADRB2	19	43
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	ADRB1	21	43
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	HRH1	23	49
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	ACOX1	71	37
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	CCR3	33	49
CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275837	FG	On-Demand	Anodyne	ABCB1	77	60
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	ADRB2	19	43
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	ADRB1	21	43
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	HRH1	23	49
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	ACOX1	71	37
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	CCR3	33	49
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872275838	FG	On-Demand	Anodyne	ABCB1	77	60
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	ADRB2	19	43
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	ADRB1	21	43
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	HRH1	23	49
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	ACOX1	71	37
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	CCR3	33	49
CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872275839	FG	On-Demand	Anodyne	ABCB1	77	60
N#CCCn1cc(C(=O)CN2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000872275867	GI	On-Demand	Mild	CNR1	17	45
N#CCCn1cc(C(=O)CN2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000872275867	GI	On-Demand	Mild	CNR2	22	45
CN1CCCC[C@@H]1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872275875	CG	On-Demand	Anodyne	CHRNA10	50	35
CN1CCCC[C@H]1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275876	CG	On-Demand	Anodyne	CHRNA10	50	35
CN1CCCC[C@@H]1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872275877	CG	On-Demand	Anodyne	CHRNA10	50	35
CN1CCCC[C@H]1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872275878	CG	On-Demand	Anodyne	CHRNA10	50	35
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	ADRB2	26	51
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	ADRB1	56	51
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	HRH1	18	44
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	ADRB3	32	42
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	ACOX1	61	40
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	CCR3	24	47
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275879	GF	On-Demand	Anodyne	ABCB1	59	43
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	ADRB2	26	51
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	ADRB1	56	51
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	HRH1	18	44
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	ADRB3	32	42
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	ACOX1	61	40
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	CCR3	24	47
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275880	GF	On-Demand	Anodyne	ABCB1	59	43
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	ADRB2	26	51
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	ADRB1	56	51
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	HRH1	18	44
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	ADRB3	32	42
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	ACOX1	61	40
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	CCR3	24	47
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275881	GF	On-Demand	Anodyne	ABCB1	59	43
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	ADRB2	26	51
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	ADRB1	56	51
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	HRH1	18	44
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	ADRB3	32	42
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	ACOX1	61	40
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	CCR3	24	47
CC(=O)Nc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275882	GF	On-Demand	Anodyne	ABCB1	59	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2ccc(Cl)cn2)CC1	ZINC000872275889	EE	On-Demand	Anodyne	NPBWR1	46	45
CCOC(=O)C1=C(CN2CCC[C@@H](OC3CCC3)CC2)NC(=O)N[C@H]1C	ZINC000872275899	FD	On-Demand	Anodyne	SLC27A4	42	30
CCOC(=O)C1=C(CN2CCC[C@H](OC3CCC3)CC2)NC(=O)N[C@@H]1C	ZINC000872275901	FD	On-Demand	Anodyne	SLC27A4	42	30
CCOC(=O)C1=C(CN2CCC[C@@H](OC3CCC3)CC2)NC(=O)N[C@@H]1C	ZINC000872275903	FD	On-Demand	Anodyne	SLC27A4	42	30
CCOC(=O)C1=C(CN2CCC[C@H](OC3CCC3)CC2)NC(=O)N[C@H]1C	ZINC000872275905	FD	On-Demand	Anodyne	SLC27A4	42	30
Cc1ccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872275974	EG	On-Demand	Anodyne	TPSAB1	18	40
Cc1ccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872275976	EG	On-Demand	Anodyne	TPSAB1	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000872275984	FG	On-Demand	Anodyne	TYK2	56	36
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000872275984	FG	On-Demand	Anodyne	KCNK3	120	58
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000872275984	FG	On-Demand	Anodyne	KCNK9	71	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc2c(c1)OCO2	ZINC000872275990	FG	On-Demand	Anodyne	TERT	18	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc2c(c1)OCO2	ZINC000872275991	FG	On-Demand	Anodyne	TERT	18	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCC(C(=O)N2CCCC2)CC1	ZINC000872275992	GE	On-Demand	Anodyne	PREP	16	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCC(C(=O)N2CCCC2)CC1	ZINC000872275993	GE	On-Demand	Anodyne	PREP	16	40
C[C@H](C(=O)Nc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872275998	DG	On-Demand	Anodyne	TIMP3	62	33
C[C@H](C(=O)Nc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276000	DG	On-Demand	Anodyne	TIMP3	62	33
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	ADRB2	31	45
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	ADRB1	41	42
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	HRH1	18	50
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	ACOX1	46	35
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	CCR3	18	50
O[C@@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276004	DF	On-Demand	Anodyne	ABCB1	78	49
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	ADRB2	31	45
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	ADRB1	41	42
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	HRH1	18	50
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	ADRB3	22	44
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	ACOX1	46	35
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	CCR3	18	50
O[C@H](COc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276005	DF	On-Demand	Anodyne	ABCB1	78	49
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	ADRB2	31	45
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	ADRB1	41	42
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	HRH1	18	50
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	ADRB3	22	44
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	ACOX1	46	35
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	CCR3	18	50
O[C@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276006	DF	On-Demand	Anodyne	ABCB1	78	49
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	ADRB2	31	45
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	ADRB1	41	42
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	HRH1	18	50
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	ACOX1	46	35
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	CCR3	18	50
O[C@@H](COc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276007	DF	On-Demand	Anodyne	ABCB1	78	49
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCc1ccc(F)cc1	ZINC000872276017	EF	On-Demand	Anodyne	CCR3	65	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCc1ccc(F)cc1	ZINC000872276017	EF	On-Demand	Anodyne	GPBAR1	19	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCc1ccc(F)cc1	ZINC000872276018	EF	On-Demand	Anodyne	CCR3	65	38
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCc1ccc(F)cc1	ZINC000872276018	EF	On-Demand	Anodyne	GPBAR1	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	ZINC000872276023	FF	On-Demand	Anodyne	KDM1A	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	ZINC000872276023	FF	On-Demand	Anodyne	KCNK3	37	43
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HTR1A	25	43
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	DRD2	19	43
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	SLC6A1	117	39
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HRH1	24	45
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HTR4	32	42
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	LTA4H	49	42
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HTR7	27	48
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	ABCB1	25	47
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	PSMB1	40	37
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HCN1	64	35
CC(=O)c1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276039	EH	On-Demand	Anodyne	HCN4	45	35
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HTR1A	25	43
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	DRD2	19	43
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	SLC6A1	117	39
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HRH1	24	45
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HTR4	32	42
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	LTA4H	49	42
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HTR7	27	48
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	ABCB1	25	47
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	PSMB1	40	37
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HCN1	64	35
CC(=O)c1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276040	EH	On-Demand	Anodyne	HCN4	45	35
c1coc(-c2noc(CN3CCC[C@H](OC4CCC4)CC3)n2)c1	ZINC000872276058	DG	On-Demand	Anodyne	ADORA2A	33	40
c1coc(-c2noc(CN3CCC[C@@H](OC4CCC4)CC3)n2)c1	ZINC000872276059	DG	On-Demand	Anodyne	ADORA2A	33	40
CC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276070	BE	On-Demand	Anodyne	PAOX	18	41
CC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276071	BE	On-Demand	Anodyne	PAOX	18	41
COc1ccccc1COC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276083	FF	On-Demand	Anodyne	ABCB1	48	42
COc1ccccc1COC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276084	FF	On-Demand	Anodyne	ABCB1	48	42
COc1ccccc1COC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276085	FF	On-Demand	Anodyne	ABCB1	48	42
COc1ccccc1COC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276086	FF	On-Demand	Anodyne	ABCB1	48	42
O[C@H](COCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276087	EF	On-Demand	Anodyne	ABCB1	54	44
O[C@H](COCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276088	EF	On-Demand	Anodyne	ABCB1	54	44
O[C@@H](COCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276089	EF	On-Demand	Anodyne	ABCB1	54	44
O[C@@H](COCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276090	EF	On-Demand	Anodyne	ABCB1	54	44
O=S(=O)(c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1)C(F)F	ZINC000872276133	FH	On-Demand	Anodyne	HRH3	24	45
O=S(=O)(c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1)C(F)F	ZINC000872276134	FH	On-Demand	Anodyne	HRH3	24	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OCc2ccccn2)c1	ZINC000872276152	EH	On-Demand	Anodyne	EPHX2	15	41
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	HRH2	31	41
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	CHRM3	18	43
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	HRH3	36	42
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	CCR3	32	45
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	BDKRB1	29	41
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	PREP	35	43
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	FAAH	19	50
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	PARP1	19	44
O=C(c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276180	FI	On-Demand	Anodyne	L3MBTL3	74	45
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	HRH2	31	41
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	CHRM3	18	43
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	HRH3	36	42
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	CCR3	32	45
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	BDKRB1	29	41
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	PREP	35	43
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	FAAH	19	50
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	PARP1	19	44
O=C(c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1)N1CCCCC1	ZINC000872276182	FI	On-Demand	Anodyne	L3MBTL3	74	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000872276186	EF	On-Demand	Anodyne	F2	23	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000872276186	EF	On-Demand	Anodyne	HRH3	32	49
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000872276186	EF	On-Demand	Anodyne	SIGMAR1	25	54
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000872276186	EF	On-Demand	Anodyne	TMPRSS11D	48	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)C1	ZINC000872276190	EG	On-Demand	Anodyne	KCNQ2	50	41
N#Cc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276225	DG	On-Demand	Mild	LTA4H	46	42
N#Cc1ccccc1OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276225	DG	On-Demand	Mild	PSMB1	41	36
N#Cc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276226	DG	On-Demand	Mild	LTA4H	46	42
N#Cc1ccccc1OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872276226	DG	On-Demand	Mild	PSMB1	41	36
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276258	EH	On-Demand	Anodyne	SLC6A1	73	35
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276258	EH	On-Demand	Anodyne	CHRM3	19	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276258	EH	On-Demand	Anodyne	CCR3	23	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276258	EH	On-Demand	Anodyne	CHRNA7	16	40
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276259	EH	On-Demand	Anodyne	SLC6A1	73	35
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276259	EH	On-Demand	Anodyne	CHRM3	19	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276259	EH	On-Demand	Anodyne	CCR3	23	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1F	ZINC000872276259	EH	On-Demand	Anodyne	CHRNA7	16	40
C[C@H](c1nc(-c2cccs2)no1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276292	EI	On-Demand	Anodyne	ETHR	31	42
C[C@H](c1nc(-c2cccs2)no1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276293	EI	On-Demand	Anodyne	ETHR	31	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000872276320	CD	On-Demand	Anodyne	NOS2	104	39
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)N[C@]12CCC[C@H]1OCC2	ZINC000872276353	FD	On-Demand	Anodyne	ADAM10	41	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872276361	DG	On-Demand	Anodyne	DRD4	15	58
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872276361	DG	On-Demand	Anodyne	CCR3	65	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872276362	DG	On-Demand	Anodyne	DRD4	15	58
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(F)c1	ZINC000872276362	DG	On-Demand	Anodyne	CCR3	65	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	ACE	70	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	OPRM1	65	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	OPRD1	48	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	OPRK1	15	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	AVPR1B	48	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	MME	86	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	LTA4H	23	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	TACR1	41	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CMA1	81	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CTRA_BOVIN	73	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	FCER2	55	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	TRY2_BOVIN	56	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	TRY1_BOVIN	47	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CYSP_TRYCR	46	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	NPFFR2	48	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	TIMP3	80	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	ITGA4	35	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CAPNS1	52	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CELA2A	47	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CAPN1	54	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	CTRC	43	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	ACE2	84	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	PSMB8	57	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276363	FF	On-Demand	Anodyne	BRCA1	66	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	ACE	70	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	OPRM1	65	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	OPRD1	48	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	OPRK1	15	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	AVPR1B	48	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	MME	86	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	LTA4H	23	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	TACR1	41	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CMA1	81	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CTRA_BOVIN	73	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	FCER2	55	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	TRY2_BOVIN	56	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	TRY1_BOVIN	47	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CYSP_TRYCR	46	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	NPFFR2	48	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	TIMP3	80	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	ITGA4	35	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CAPNS1	52	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CELA2A	47	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CAPN1	54	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	CTRC	43	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	ACE2	84	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	PSMB8	57	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276364	FF	On-Demand	Anodyne	BRCA1	66	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	ACE	70	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	OPRM1	65	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	OPRD1	48	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	OPRK1	15	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	AVPR1B	48	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	MME	86	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	LTA4H	23	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	TACR1	41	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CMA1	81	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CTRA_BOVIN	73	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	FCER2	55	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	TRY2_BOVIN	56	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	TRY1_BOVIN	47	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CYSP_TRYCR	46	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	NPFFR2	48	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	TIMP3	80	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	ITGA4	35	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CAPNS1	52	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CELA2A	47	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CAPN1	54	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	CTRC	43	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	ACE2	84	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	PSMB8	57	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276365	FF	On-Demand	Anodyne	BRCA1	66	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	ACE	70	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	OPRM1	65	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	OPRD1	48	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	OPRK1	15	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	AVPR1B	48	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	MME	86	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	LTA4H	23	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	TACR1	41	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CMA1	81	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CTRA_BOVIN	73	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	FCER2	55	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	TRY2_BOVIN	56	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	TRY1_BOVIN	47	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CYSP_TRYCR	46	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	NPFFR2	48	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	TIMP3	80	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	ITGA4	35	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CAPNS1	52	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CELA2A	47	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CAPN1	54	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	CTRC	43	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	ACE2	84	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	PSMB8	57	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276366	FF	On-Demand	Anodyne	BRCA1	66	35
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	ADRB2	17	42
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	ADRB1	30	42
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	HRH1	15	43
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	HRH3	19	44
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	ACOX1	67	35
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276374	FG	On-Demand	Anodyne	ABCB1	68	49
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	ADRB2	17	42
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	ADRB1	30	42
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	HRH1	15	43
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	HRH3	19	44
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	ACOX1	67	35
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276375	FG	On-Demand	Anodyne	ABCB1	68	49
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	ADRB2	17	42
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	ADRB1	30	42
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	HRH1	15	43
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	HRH3	19	44
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	ACOX1	67	35
CC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276376	FG	On-Demand	Anodyne	ABCB1	68	49
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	ADRB2	17	42
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	ADRB1	30	42
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	HRH1	15	43
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	HRH3	19	44
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	ACOX1	67	35
CC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276377	FG	On-Demand	Anodyne	ABCB1	68	49
COC(=O)c1sccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276378	FF	On-Demand	Anodyne	FAS	49	47
COC(=O)c1sccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276379	FF	On-Demand	Anodyne	FAS	49	47
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	ESR1	74	38
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	ESR2	50	38
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	LTA4H	64	44
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	CA1	15	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	CA7	27	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	HRH3	66	45
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	CA12	16	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	CA9	16	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	PSMB2	43	46
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	PSMB1	48	46
NS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872276391	FE	On-Demand	Anodyne	MEN1	38	48
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	ESR1	74	38
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	ESR2	50	38
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	LTA4H	64	44
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	CA1	15	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	CA7	27	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	HRH3	66	45
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	CA12	16	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	CA9	16	60
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	PSMB2	43	46
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	PSMB1	48	46
NS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872276392	FE	On-Demand	Anodyne	MEN1	38	48
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276426	FH	On-Demand	Anodyne	KCNQ2	44	34
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276426	FH	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276426	FH	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276427	FH	On-Demand	Anodyne	KCNQ2	44	34
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276427	FH	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276427	FH	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276428	FH	On-Demand	Anodyne	KCNQ2	44	34
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276428	FH	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276428	FH	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276429	FH	On-Demand	Anodyne	KCNQ2	44	34
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276429	FH	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1NC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276429	FH	On-Demand	Anodyne	HCN4	45	36
O=C(Nc1ccccc1)c1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872276458	FG	On-Demand	Anodyne	KCNK3	56	41
O=C(CCSc1ccccn1)N[C@]12CCC[C@H]1OCC2	ZINC000872276484	CE	On-Demand	Anodyne	FAS	18	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)C1	ZINC000872276514	FF	On-Demand	Anodyne	GRM4	56	44
Cc1ccc(-c2cncc(C(=O)N[C@]34CCC[C@H]3OCC4)c2)cc1	ZINC000872276531	DG	On-Demand	Anodyne	SCN10A	40	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cnc2ccccn12	ZINC000872276538	CD	On-Demand	Anodyne	EPHB3	22	44
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	HTR1D	15	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	HTR1B	15	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	CCR3	83	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	CHRNA7	22	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	TERT	17	44
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276588	EH	On-Demand	Anodyne	MCHR1	16	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	HTR1D	15	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	HTR1B	15	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	CCR3	83	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	CHRNA7	22	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	TERT	17	44
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1	ZINC000872276589	EH	On-Demand	Anodyne	MCHR1	16	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	SLC6A1	99	36
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	LTA4H	47	44
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	SIGMAR1	27	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	PRCP	28	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	CCR3	34	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	CHRNA7	23	50
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC8	18	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC10	40	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC2	25	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC3	30	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC6	31	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	HDAC11	34	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	TERT	16	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276609	DG	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	SLC6A1	99	36
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	LTA4H	47	44
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	SIGMAR1	27	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	PRCP	28	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	CCR3	34	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	CHRNA7	23	50
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC8	18	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC10	40	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC2	25	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC3	30	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC6	31	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	HDAC11	34	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	TERT	16	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000872276610	DG	On-Demand	Anodyne	CYP2J2	43	31
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc2c(c1)CCC2	ZINC000872276618	EH	On-Demand	Anodyne	ACOX1	19	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc2c(c1)CCC2	ZINC000872276619	EH	On-Demand	Anodyne	ACOX1	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccnc1N1CCOCC1	ZINC000872276653	ED	On-Demand	Anodyne	SCN10A	21	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCC1CC1	ZINC000872276654	CD	On-Demand	Anodyne	CACNA1I	47	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCC1CC1	ZINC000872276655	CD	On-Demand	Anodyne	CACNA1I	47	37
O=[N+]([O-])c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276667	EG	On-Demand	Bother	HRH2	15	42
O=[N+]([O-])c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276667	EG	On-Demand	Bother	LTA4H	53	64
O=[N+]([O-])c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276667	EG	On-Demand	Bother	HRH3	34	47
O=[N+]([O-])c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276667	EG	On-Demand	Bother	PSMB1	40	37
O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276668	EG	On-Demand	Bother	HRH2	15	42
O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276668	EG	On-Demand	Bother	LTA4H	53	64
O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276668	EG	On-Demand	Bother	HRH3	34	47
O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276668	EG	On-Demand	Bother	PSMB1	40	37
C[C@H](C(=O)Nc1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276671	EH	On-Demand	Anodyne	CCR3	43	37
C[C@H](C(=O)Nc1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276673	EH	On-Demand	Anodyne	CCR3	43	37
C[C@H](CSCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872276692	DG	On-Demand	Anodyne	ACE	27	43
C[C@H](CSCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872276692	DG	On-Demand	Anodyne	MME	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000872276715	DD	On-Demand	Anodyne	NOS2	96	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1	ZINC000872276723	EF	On-Demand	Anodyne	SIGMAR1	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1	ZINC000872276723	EF	On-Demand	Anodyne	P2RX7	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1	ZINC000872276723	EF	On-Demand	Anodyne	LNPEP	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCCC1	ZINC000872276723	EF	On-Demand	Anodyne	EPHX2	16	44
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276763	FG	On-Demand	Anodyne	DRD4	16	51
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276763	FG	On-Demand	Anodyne	CCR3	42	38
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872276763	FG	On-Demand	Anodyne	MCHR1	40	41
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276764	FG	On-Demand	Anodyne	DRD4	16	51
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276764	FG	On-Demand	Anodyne	CCR3	42	38
CC(=O)Nc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872276764	FG	On-Demand	Anodyne	MCHR1	40	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	DRD4	26	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	KCNH2	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	CHRM3	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	SIGMAR1	41	58
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	SSTR5	44	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	CCR1	18	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	CCR3	94	51
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	MLNR	46	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	EPHX2	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	MCHR1	52	51
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872276777	EF	On-Demand	Anodyne	CACNA1G	43	51
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNc1ccccc1	ZINC000872276781	CE	On-Demand	Anodyne	CTSK	20	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNc1ccccc1	ZINC000872276781	CE	On-Demand	Anodyne	AMY2	43	30
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c(C)c1	ZINC000872276786	EG	On-Demand	Anodyne	ADRB2	15	56
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c(C)c1	ZINC000872276786	EG	On-Demand	Anodyne	ABCB1	66	47
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c(C)c1	ZINC000872276787	EG	On-Demand	Anodyne	ADRB2	15	56
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)c(C)c1	ZINC000872276787	EG	On-Demand	Anodyne	ABCB1	66	47
Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c(C)c1	ZINC000872276788	EG	On-Demand	Anodyne	ADRB2	15	56
Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)c(C)c1	ZINC000872276788	EG	On-Demand	Anodyne	ABCB1	66	47
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c(C)c1	ZINC000872276789	EG	On-Demand	Anodyne	ADRB2	15	56
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)c(C)c1	ZINC000872276789	EG	On-Demand	Anodyne	ABCB1	66	47
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276794	GI	On-Demand	Anodyne	KCNQ2	40	34
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276794	GI	On-Demand	Anodyne	EPHX2	18	40
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276794	GI	On-Demand	Anodyne	RBP4	81	41
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276794	GI	On-Demand	Anodyne	SCD	27	41
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276797	GI	On-Demand	Anodyne	KCNQ2	40	34
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276797	GI	On-Demand	Anodyne	EPHX2	18	40
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276797	GI	On-Demand	Anodyne	RBP4	81	41
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276797	GI	On-Demand	Anodyne	SCD	27	41
Cc1ccccc1CN(C)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872276806	EG	On-Demand	Anodyne	SLC6A1	71	36
Cc1ccccc1CN(C)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872276807	EG	On-Demand	Anodyne	SLC6A1	71	36
COc1ccccc1CNC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276834	FG	On-Demand	Anodyne	TACR1	24	46
COc1ccccc1CNC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872276834	FG	On-Demand	Anodyne	MBTPS1	45	33
COc1ccccc1CNC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276835	FG	On-Demand	Anodyne	TACR1	24	46
COc1ccccc1CNC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276835	FG	On-Demand	Anodyne	MBTPS1	45	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	CHRM1	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	DRD2	22	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	DRD4	27	54
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	HTR2A	19	54
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	OPRM1	28	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	OPRD1	16	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	CHRM3	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	LTA4H	24	47
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	SIGMAR1	60	63
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	CCR5	43	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	C3AR1	42	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	EPHX2	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	XIAP	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	CACNA1G	27	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	CYP2J2	45	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000872276873	EF	On-Demand	Anodyne	BIRC2	41	48
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000872276938	EE	On-Demand	Anodyne	DRD4	20	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000872276938	EE	On-Demand	Anodyne	SIGMAR1	25	53
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000872276938	EE	On-Demand	Anodyne	SSTR5	48	37
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000872276938	EE	On-Demand	Anodyne	EPHX2	18	40
FC(F)n1c(CN2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872276950	EI	On-Demand	Anodyne	GRM2	20	44
FC(F)n1c(CN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000872276951	EI	On-Demand	Anodyne	GRM2	20	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	DRD2	15	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	SLC6A1	45	38
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	GRIN2B	27	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	LTA4H	28	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	SIGMAR1	37	47
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	PREP	46	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	CACNA1G	42	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276953	DF	On-Demand	Anodyne	TMPRSS11D	48	32
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	DRD2	15	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	SLC6A1	45	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	GRIN2B	27	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	LTA4H	28	44
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	SIGMAR1	37	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	PREP	46	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	CACNA1G	42	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccc1	ZINC000872276954	DF	On-Demand	Anodyne	TMPRSS11D	48	32
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872276955	FI	On-Demand	Anodyne	RBP4	73	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872276956	FI	On-Demand	Anodyne	RBP4	73	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)c1cccnc1	ZINC000872276959	DC	On-Demand	Anodyne	TBXAS1	26	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)c1cccnc1	ZINC000872276959	DC	On-Demand	Anodyne	NAMPT	16	40
CCCCCNC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276975	DG	On-Demand	Anodyne	TPP2	18	44
CCCCCNC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872276975	DG	On-Demand	Anodyne	ASAH1	53	32
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000872276981	EE	On-Demand	Anodyne	CYP19A1	23	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000872276981	EE	On-Demand	Anodyne	CYP11B1	35	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000872276981	EE	On-Demand	Anodyne	TBXAS1	42	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000872276981	EE	On-Demand	Anodyne	CYP11B2	20	42
COc1cc2c(cc1OC)CN(CC(=O)N[C@]13CCC[C@H]1OCC3)CC2	ZINC000872276983	FD	On-Demand	Anodyne	ABCB1B	60	35
COc1cc2c(cc1OC)CN(CC(=O)N[C@]13CCC[C@H]1OCC3)CC2	ZINC000872276983	FD	On-Demand	Anodyne	ABCB1	22	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000872276984	EH	On-Demand	Anodyne	CHRNA7	44	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000872276984	EH	On-Demand	Anodyne	NAMPT	41	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2N2CCCCCC2)C1	ZINC000872276991	DG	On-Demand	Anodyne	KCNQ2	86	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	FKBP1A	37	44
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	LTA4H	20	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	SIGMAR1	41	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	CCR3	15	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	PREP	72	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277011	EG	On-Demand	Anodyne	CRTM	35	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	FKBP1A	37	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	LTA4H	20	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	SIGMAR1	41	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	CCR3	15	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	PREP	72	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCCc1ccccc1	ZINC000872277013	EG	On-Demand	Anodyne	CRTM	35	40
COc1ccc(OC)c([C@H](C)NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872277016	GG	On-Demand	Anodyne	AVPR1B	43	35
COc1ccc(OC)c([C@H](C)NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872277018	GG	On-Demand	Anodyne	AVPR1B	43	35
c1coc(-c2cc(CN3CCC[C@H](OC4CCC4)CC3)no2)c1	ZINC000872277040	DH	On-Demand	Anodyne	SCN5A	67	32
c1coc(-c2cc(CN3CCC[C@@H](OC4CCC4)CC3)no2)c1	ZINC000872277045	DH	On-Demand	Anodyne	SCN5A	67	32
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277055	EG	On-Demand	Anodyne	CCR3	76	38
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277055	EG	On-Demand	Anodyne	CCR5	15	41
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277055	EG	On-Demand	Anodyne	TACR3	18	41
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277055	EG	On-Demand	Anodyne	MLNR	42	38
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277055	EG	On-Demand	Anodyne	WNT3A	41	35
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277056	EG	On-Demand	Anodyne	CCR3	76	38
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277056	EG	On-Demand	Anodyne	CCR5	15	41
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277056	EG	On-Demand	Anodyne	TACR3	18	41
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277056	EG	On-Demand	Anodyne	MLNR	42	38
CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277056	EG	On-Demand	Anodyne	WNT3A	41	35
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277058	GE	On-Demand	Anodyne	SLC6A1	42	40
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277059	GE	On-Demand	Anodyne	SLC6A1	42	40
Fc1cccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)co2)c1	ZINC000872277076	EI	On-Demand	Anodyne	SCN5A	51	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	ACE	59	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	MME	88	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	ANPEP	47	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	PGC	49	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTRA_BOVIN	44	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	FCER2	53	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	KLK3	49	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTSB	64	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	PAPA1_CARPA	81	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CYSP_TRYCR	64	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTSK	50	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTSL	57	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	TIMP3	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CAPNS1	68	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	HLA-DRB1	94	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CELA2A	51	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	REN	71	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTSS	28	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CAPN1	93	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	MMP9	16	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CAPN2	120	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	ACE2	69	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	MMP1	19	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	FPR1	66	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	CTRB_BOVIN	50	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCNCC(C)(C)C1	ZINC000872277077	FE	On-Demand	Anodyne	PSMB8	56	33
Fc1cccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)co2)c1	ZINC000872277078	EI	On-Demand	Anodyne	SCN5A	51	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	ACE	59	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	MME	88	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	ANPEP	47	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	PGC	49	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTRA_BOVIN	44	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	FCER2	53	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	KLK3	49	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTSB	64	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	PAPA1_CARPA	81	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CYSP_TRYCR	64	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTSK	50	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTSL	57	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	TIMP3	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CAPNS1	68	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	HLA-DRB1	94	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CELA2A	51	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	REN	71	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTSS	28	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CAPN1	93	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	MMP9	16	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CAPN2	120	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	ACE2	69	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	MMP1	19	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	FPR1	66	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	CTRB_BOVIN	50	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCNCC(C)(C)C1	ZINC000872277079	FE	On-Demand	Anodyne	PSMB8	56	33
CN1CCN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872277085	FD	On-Demand	Anodyne	F2	21	42
CN1CCN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872277085	FD	On-Demand	Anodyne	L3MBTL3	72	44
CN1CCN(C(=O)c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872277085	FD	On-Demand	Anodyne	TMPRSS11D	65	35
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277088	EF	On-Demand	Mild	ABCB1	36	41
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277088	EF	On-Demand	Mild	MEN1	40	38
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277090	EF	On-Demand	Mild	ABCB1	36	41
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277090	EF	On-Demand	Mild	MEN1	40	38
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277092	EF	On-Demand	Mild	ABCB1	36	41
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277092	EF	On-Demand	Mild	MEN1	40	38
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277094	EF	On-Demand	Mild	ABCB1	36	41
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277094	EF	On-Demand	Mild	MEN1	40	38
Cc1cccc(C(C)C)c1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277105	FI	On-Demand	Anodyne	SLC6A1	41	37
Cc1cccc(C(C)C)c1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277105	FI	On-Demand	Anodyne	SOAT1	44	41
Cc1cccc(C(C)C)c1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277109	FI	On-Demand	Anodyne	SLC6A1	41	37
Cc1cccc(C(C)C)c1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277109	FI	On-Demand	Anodyne	SOAT1	44	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc21	ZINC000872277118	EF	On-Demand	Anodyne	DRD4	23	54
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc21	ZINC000872277119	EF	On-Demand	Anodyne	DRD4	23	54
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277147	FG	On-Demand	Anodyne	HTR1A	29	41
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277147	FG	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277147	FG	On-Demand	Anodyne	DRD4	30	45
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277147	FG	On-Demand	Anodyne	TACR1	15	40
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277147	FG	On-Demand	Anodyne	BIRC2	33	41
CC(C)(C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277170	CE	On-Demand	Anodyne	CACNA1I	22	46
CC(C)(C)NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277171	CE	On-Demand	Anodyne	CACNA1I	22	46
N#CCCN(C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872277173	FG	On-Demand	Mild	SLC6A1	50	40
N#CCCN(C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872277174	FG	On-Demand	Mild	SLC6A1	50	40
CCCCCNC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872277175	DG	On-Demand	Anodyne	TPP2	18	44
CCCCCNC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872277175	DG	On-Demand	Anodyne	ASAH1	53	32
CCCCCNC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277177	DG	On-Demand	Anodyne	TPP2	18	44
CCCCCNC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277177	DG	On-Demand	Anodyne	ASAH1	53	32
CCCCCNC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277178	DG	On-Demand	Anodyne	TPP2	18	44
CCCCCNC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277178	DG	On-Demand	Anodyne	ASAH1	53	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)C1	ZINC000872277183	FE	On-Demand	Anodyne	EPHX2	22	42
COc1ccc(C)cc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277210	EG	On-Demand	Anodyne	DRD4	21	48
COc1ccc(C)cc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277210	EG	On-Demand	Anodyne	HTR4	17	42
COc1ccc(C)cc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277211	EG	On-Demand	Anodyne	DRD4	21	48
COc1ccc(C)cc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277211	EG	On-Demand	Anodyne	HTR4	17	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277229	EH	On-Demand	Anodyne	DRD4	19	57
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277229	EH	On-Demand	Anodyne	CCR3	37	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277229	EH	On-Demand	Anodyne	GRM5	17	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277229	EH	On-Demand	Anodyne	EPHX2	17	51
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277229	EH	On-Demand	Anodyne	MCHR1	56	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277230	EH	On-Demand	Anodyne	DRD4	19	57
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277230	EH	On-Demand	Anodyne	CCR3	37	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277230	EH	On-Demand	Anodyne	GRM5	17	47
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277230	EH	On-Demand	Anodyne	EPHX2	17	51
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(Cl)c1	ZINC000872277230	EH	On-Demand	Anodyne	MCHR1	56	41
C[C@@H](CCCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872277244	DG	On-Demand	Anodyne	ACE	50	36
C[C@@H](CCCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872277244	DG	On-Demand	Anodyne	GHRHR	43	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000872277265	DF	On-Demand	Anodyne	P2RY1	43	41
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277277	FG	On-Demand	Anodyne	HTR1A	29	41
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277277	FG	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277277	FG	On-Demand	Anodyne	DRD4	30	45
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277277	FG	On-Demand	Anodyne	TACR1	15	40
COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277277	FG	On-Demand	Anodyne	BIRC2	33	41
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	ADRB1	46	43
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	HRH1	17	44
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	ACOX1	56	35
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	CCR3	20	44
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277279	GF	On-Demand	Anodyne	ABCB1	63	48
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	ADRB1	46	43
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	HRH1	17	44
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	ACOX1	56	35
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	CCR3	20	44
COC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277280	GF	On-Demand	Anodyne	ABCB1	63	48
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	ADRB1	46	43
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	HRH1	17	44
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	ACOX1	56	35
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	CCR3	20	44
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277281	GF	On-Demand	Anodyne	ABCB1	63	48
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	ADRB1	46	43
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	HRH1	17	44
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	ACOX1	56	35
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	CCR3	20	44
COC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277282	GF	On-Demand	Anodyne	ABCB1	63	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000872277313	FD	On-Demand	Anodyne	EPHX2	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000872277314	DD	On-Demand	Anodyne	STAT6	55	34
CC(=O)c1cc(C(=O)N[C@H]2CCNCC(C)(C)C2)ccc1OC(C)C	ZINC000872277341	EG	On-Demand	Anodyne	EZH2	50	39
CC(=O)c1cc(C(=O)N[C@@H]2CCNCC(C)(C)C2)ccc1OC(C)C	ZINC000872277342	EG	On-Demand	Anodyne	EZH2	50	39
Cc1ccccc1CNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277381	EG	On-Demand	Anodyne	DRD4	18	42
Cc1ccccc1CNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277381	EG	On-Demand	Anodyne	SLC6A1	63	36
Cc1ccccc1CNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277381	EG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccccc1CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277384	EG	On-Demand	Anodyne	DRD4	18	42
Cc1ccccc1CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277384	EG	On-Demand	Anodyne	SLC6A1	63	36
Cc1ccccc1CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277384	EG	On-Demand	Anodyne	P2RX7	22	44
CS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872277385	GE	On-Demand	Anodyne	CCR3	28	44
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277386	FI	On-Demand	Anodyne	DRD4	16	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277386	FI	On-Demand	Anodyne	SLC6A1	64	38
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277386	FI	On-Demand	Anodyne	HRH1	19	64
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277386	FI	On-Demand	Anodyne	KCNQ2	49	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277386	FI	On-Demand	Anodyne	PRCP	46	41
CS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872277388	GE	On-Demand	Anodyne	CCR3	28	44
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277389	FI	On-Demand	Anodyne	DRD4	16	40
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277389	FI	On-Demand	Anodyne	SLC6A1	64	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277389	FI	On-Demand	Anodyne	HRH1	19	64
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277389	FI	On-Demand	Anodyne	KCNQ2	49	40
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872277389	FI	On-Demand	Anodyne	PRCP	46	41
O=C(Cc1cccc(I)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872277436	FF	On-Demand	Anodyne	LUXR	26	41
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872277438	DG	On-Demand	Anodyne	SLC6A3	43	48
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	ESR1	44	37
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	SLC6A1	41	41
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	HRH1	18	44
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	KCNH2	16	41
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	LTA4H	74	51
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	HRH3	78	53
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	SIGMAR1	32	45
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	NPY1R	42	35
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	CHRNA10	51	42
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	PSMB2	44	43
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	PSMB1	48	44
c1ccc(OCCOCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277448	EH	On-Demand	Anodyne	MEN1	45	39
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	ESR1	44	37
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	SLC6A1	41	41
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	HRH1	18	44
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	KCNH2	16	41
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	LTA4H	74	51
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	HRH3	78	53
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	SIGMAR1	32	45
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	NPY1R	42	35
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	CHRNA10	51	42
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	PSMB2	44	43
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	PSMB1	48	44
c1ccc(OCCOCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277450	EH	On-Demand	Anodyne	MEN1	45	39
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277498	GG	On-Demand	Anodyne	SLC6A1	50	35
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277498	GG	On-Demand	Anodyne	HTR4	40	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277498	GG	On-Demand	Anodyne	CACNA1I	42	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277499	GG	On-Demand	Anodyne	SLC6A1	50	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277499	GG	On-Demand	Anodyne	HTR4	40	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872277499	GG	On-Demand	Anodyne	CACNA1I	42	35
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277500	GG	On-Demand	Anodyne	SLC6A1	50	35
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277500	GG	On-Demand	Anodyne	HTR4	40	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277500	GG	On-Demand	Anodyne	CACNA1I	42	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277501	GG	On-Demand	Anodyne	SLC6A1	50	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277501	GG	On-Demand	Anodyne	HTR4	40	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872277501	GG	On-Demand	Anodyne	CACNA1I	42	35
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872277505	DG	On-Demand	Anodyne	SLC6A3	43	48
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872277506	DG	On-Demand	Anodyne	SLC6A3	43	48
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872277507	DG	On-Demand	Anodyne	SLC6A3	43	48
COc1cc(C(=O)N[C@@H]2CCNCC(C)(C)C2)ccc1C#N	ZINC000872277522	DE	On-Demand	Mild	EZH2	65	52
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277532	FF	On-Demand	Mild	ABCB1	36	42
N#CCc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277533	FF	On-Demand	Mild	ABCB1	36	42
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277534	FF	On-Demand	Mild	ABCB1	36	42
N#CCc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277535	FF	On-Demand	Mild	ABCB1	36	42
O=C(Cc1ccc(F)cc1Cl)N[C@]12CCC[C@H]1OCC2	ZINC000872277536	CF	On-Demand	Anodyne	P2RX7	55	42
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277543	EF	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277543	EF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277543	EF	On-Demand	Anodyne	HRH1	17	46
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277543	EF	On-Demand	Anodyne	ACOX1	63	37
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277543	EF	On-Demand	Anodyne	ABCB1	56	48
O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277544	EF	On-Demand	Anodyne	ADRB2	20	43
O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277544	EF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277544	EF	On-Demand	Anodyne	HRH1	17	46
O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277544	EF	On-Demand	Anodyne	ACOX1	63	37
O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277544	EF	On-Demand	Anodyne	ABCB1	56	48
O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277545	EF	On-Demand	Anodyne	ADRB2	20	43
O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277545	EF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277545	EF	On-Demand	Anodyne	HRH1	17	46
O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277545	EF	On-Demand	Anodyne	ACOX1	63	37
O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277545	EF	On-Demand	Anodyne	ABCB1	56	48
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277546	EF	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277546	EF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277546	EF	On-Demand	Anodyne	HRH1	17	46
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277546	EF	On-Demand	Anodyne	ACOX1	63	37
O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277546	EF	On-Demand	Anodyne	ABCB1	56	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000872277551	GE	On-Demand	Anodyne	ETHR	50	46
CCCCCNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277554	CF	On-Demand	Anodyne	TPP2	17	40
CCCCCNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277554	CF	On-Demand	Anodyne	ASAH1	66	32
CCCCCNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277555	CF	On-Demand	Anodyne	TPP2	17	40
CCCCCNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277555	CF	On-Demand	Anodyne	ASAH1	66	32
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277576	EG	On-Demand	Anodyne	DRD4	36	58
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872277576	EG	On-Demand	Anodyne	TPP2	57	37
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277579	EG	On-Demand	Anodyne	DRD4	36	58
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872277579	EG	On-Demand	Anodyne	TPP2	57	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000872277583	FF	On-Demand	Anodyne	NAMPT	69	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000872277583	FF	On-Demand	Anodyne	KCNK3	53	42
c1ccc2oc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872277592	DH	On-Demand	Anodyne	SSTR5	35	45
c1ccc2oc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872277593	DH	On-Demand	Anodyne	SSTR5	35	45
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	ESR1	75	38
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	ESR2	50	38
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	LTA4H	69	50
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	HRH3	71	61
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	PSMB2	46	49
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	PSMB1	51	49
N#Cc1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277594	DG	On-Demand	Mild	MEN1	54	48
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	ESR1	75	38
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	ESR2	50	38
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	LTA4H	69	50
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	HRH3	71	61
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	PSMB2	46	49
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	PSMB1	51	49
N#Cc1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277595	DG	On-Demand	Mild	MEN1	54	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(-n2nccn2)nc1	ZINC000872277624	DD	On-Demand	Anodyne	SYK	23	42
Cn1cnc2cc(C(=O)N[C@]34CCC[C@H]3OCC4)ccc21	ZINC000872277686	CE	On-Demand	Anodyne	HPGD	41	33
CN(C)CCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872277703	EE	On-Demand	Anodyne	HRH2	29	40
CN(C)CCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872277703	EE	On-Demand	Anodyne	ROCK2	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000872277763	FE	On-Demand	Anodyne	NPY2R	45	46
CN(C)S(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872277830	FF	On-Demand	Anodyne	SIGMAR1	25	41
CN(C)S(=O)(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872277830	FF	On-Demand	Anodyne	SSTR5	18	42
CN(C)S(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872277831	FF	On-Demand	Anodyne	SIGMAR1	25	41
CN(C)S(=O)(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872277831	FF	On-Demand	Anodyne	SSTR5	18	42
C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872277834	EG	On-Demand	Anodyne	TACR1	31	44
C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277835	EG	On-Demand	Anodyne	TACR1	31	44
C[C@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872277836	EG	On-Demand	Anodyne	TACR1	31	44
C[C@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872277837	EG	On-Demand	Anodyne	TACR1	31	44
c1ccc(-c2cc(CN3CCC[C@H](OC4CCC4)CC3)no2)cc1	ZINC000872277842	EI	On-Demand	Anodyne	SCN5A	65	32
c1ccc(-c2cc(CN3CCC[C@@H](OC4CCC4)CC3)no2)cc1	ZINC000872277843	EI	On-Demand	Anodyne	SCN5A	65	32
COc1ccc(CN(C)C(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277851	FG	On-Demand	Anodyne	LTA4H	15	43
COc1ccc(CN(C)C(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277851	FG	On-Demand	Anodyne	HRH3	17	41
COc1ccc(CN(C)C(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872277851	FG	On-Demand	Anodyne	SIGMAR1	17	43
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277852	FG	On-Demand	Anodyne	LTA4H	15	43
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277852	FG	On-Demand	Anodyne	HRH3	17	41
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872277852	FG	On-Demand	Anodyne	SIGMAR1	17	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000872277871	DE	On-Demand	Anodyne	HPGDS	37	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)C1	ZINC000872277876	EE	On-Demand	Anodyne	PRNP	51	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)C1	ZINC000872277876	EE	On-Demand	Anodyne	RPS6KA3	21	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)C1	ZINC000872277876	EE	On-Demand	Anodyne	NAMPT	42	56
Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)C2)n1	ZINC000872277931	FE	On-Demand	Anodyne	GRM5	16	42
Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)C2)n1	ZINC000872277932	FE	On-Demand	Anodyne	GRM5	16	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNc1ccccn1	ZINC000872277989	CD	On-Demand	Anodyne	TBK1	50	33
O=C(N[C@]12CCC[C@H]1OCC2)[C@H](F)Cc1ccccc1	ZINC000872278007	CE	On-Demand	Anodyne	TIMP3	41	32
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H](F)Cc1ccccc1	ZINC000872278008	CE	On-Demand	Anodyne	TIMP3	41	32
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872278022	GH	On-Demand	Anodyne	ADAM17	25	42
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872278023	GH	On-Demand	Anodyne	ADAM17	25	42
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278030	DF	On-Demand	Bother	SLC27A4	42	31
O=S(=O)(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278063	FG	On-Demand	Anodyne	HRH3	19	54
O=S(=O)(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278063	FG	On-Demand	Anodyne	SIGMAR1	28	40
O=S(=O)(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278064	FG	On-Demand	Anodyne	HRH3	19	54
O=S(=O)(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278064	FG	On-Demand	Anodyne	SIGMAR1	28	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	SLC6A1	46	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	CELA1	19	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	GRIN2B	33	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	SIGMAR1	33	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	CTSL	21	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	PREP	48	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278072	DG	On-Demand	Anodyne	SLC12A5	65	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	SLC6A1	46	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	CELA1	19	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	GRIN2B	33	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	SIGMAR1	33	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	CTSL	21	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	PREP	48	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872278073	DG	On-Demand	Anodyne	SLC12A5	65	38
CS(=O)(=O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278076	FF	On-Demand	Anodyne	ESR1	40	39
CS(=O)(=O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278076	FF	On-Demand	Anodyne	LTA4H	53	44
CS(=O)(=O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278076	FF	On-Demand	Anodyne	HRH3	48	46
CS(=O)(=O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278076	FF	On-Demand	Anodyne	CHRNA10	51	37
CS(=O)(=O)c1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278076	FF	On-Demand	Anodyne	PSMB1	41	37
CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278077	FF	On-Demand	Anodyne	ESR1	40	39
CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278077	FF	On-Demand	Anodyne	LTA4H	53	44
CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278077	FF	On-Demand	Anodyne	HRH3	48	46
CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278077	FF	On-Demand	Anodyne	CHRNA10	51	37
CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278077	FF	On-Demand	Anodyne	PSMB1	41	37
COc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278078	FF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278078	FF	On-Demand	Anodyne	EBP	45	38
COc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278078	FF	On-Demand	Anodyne	CHRNA10	47	43
COc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278079	FF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278079	FF	On-Demand	Anodyne	EBP	45	38
COc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278079	FF	On-Demand	Anodyne	CHRNA10	47	43
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	ESR1	20	45
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	HTR3A	21	40
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	KCNH2	16	46
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	LTA4H	51	43
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	HRH3	117	57
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	SIGMAR1	21	48
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	HTR5A	19	41
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	EBP	21	46
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	PSMB1	42	39
CS(=O)(=O)c1ccc(OCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278094	GG	On-Demand	Anodyne	MEN1	48	43
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	ESR1	20	45
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	HTR3A	21	40
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	KCNH2	16	46
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	LTA4H	51	43
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	HRH3	117	57
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	SIGMAR1	21	48
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	HTR5A	19	41
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	EBP	21	46
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	PSMB1	42	39
CS(=O)(=O)c1ccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278095	GG	On-Demand	Anodyne	MEN1	48	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)C1	ZINC000872278105	ED	On-Demand	Anodyne	DRD4	22	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)C1	ZINC000872278105	ED	On-Demand	Anodyne	ACHE	30	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)C1	ZINC000872278105	ED	On-Demand	Anodyne	SIGMAR1	29	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)C1	ZINC000872278105	ED	On-Demand	Anodyne	CCR3	63	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)C1	ZINC000872278105	ED	On-Demand	Anodyne	MCHR1	43	41
CC[C@@H](C(=O)N[C@]12CCC[C@H]1OCC2)c1ccc(OC)cc1	ZINC000872278134	DG	On-Demand	Anodyne	KCNQ2	26	45
c1ccc2nc(CN3CCC[C@H](OC4CCC4)CC3)ccc2c1	ZINC000872278171	DI	On-Demand	Anodyne	SCN5A	53	35
c1ccc2nc(CN3CCC[C@@H](OC4CCC4)CC3)ccc2c1	ZINC000872278172	DI	On-Demand	Anodyne	SCN5A	53	35
Fc1cccc(-n2ccc(CN3CCC[C@H](OC4CCC4)CC3)n2)c1	ZINC000872278197	EH	On-Demand	Anodyne	SCN5A	70	35
Fc1cccc(-n2ccc(CN3CCC[C@@H](OC4CCC4)CC3)n2)c1	ZINC000872278198	EH	On-Demand	Anodyne	SCN5A	70	35
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278199	GF	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278199	GF	On-Demand	Anodyne	ADRB1	18	46
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278199	GF	On-Demand	Anodyne	HTR1A	18	49
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278199	GF	On-Demand	Anodyne	ABCB1	73	47
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278200	GF	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278200	GF	On-Demand	Anodyne	ADRB1	18	46
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278200	GF	On-Demand	Anodyne	HTR1A	18	49
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278200	GF	On-Demand	Anodyne	ABCB1	73	47
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278201	GF	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278201	GF	On-Demand	Anodyne	ADRB1	18	46
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278201	GF	On-Demand	Anodyne	HTR1A	18	49
COc1cccc(OC)c1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278201	GF	On-Demand	Anodyne	ABCB1	73	47
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278202	GF	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278202	GF	On-Demand	Anodyne	ADRB1	18	46
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278202	GF	On-Demand	Anodyne	HTR1A	18	49
COc1cccc(OC)c1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278202	GF	On-Demand	Anodyne	ABCB1	73	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000872278227	EE	On-Demand	Clean	STAT6	52	35
O=[N+]([O-])c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278251	DH	On-Demand	Bother	SIGMAR1	20	53
O=[N+]([O-])c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278251	DH	On-Demand	Bother	BIRC2	16	44
O=[N+]([O-])c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278251	DH	On-Demand	Bother	KCNJ1	51	63
O=[N+]([O-])c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278252	DH	On-Demand	Bother	SIGMAR1	20	53
O=[N+]([O-])c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278252	DH	On-Demand	Bother	BIRC2	16	44
O=[N+]([O-])c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278252	DH	On-Demand	Bother	KCNJ1	51	63
N#Cc1ccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278272	EF	On-Demand	Mild	LGMN	54	32
N#Cc1ccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278273	EF	On-Demand	Mild	LGMN	54	32
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278280	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278280	DH	On-Demand	Anodyne	ADRB3	34	40
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278281	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278281	DH	On-Demand	Anodyne	ADRB3	34	40
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278282	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278282	DH	On-Demand	Anodyne	ADRB3	34	40
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278283	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872278283	DH	On-Demand	Anodyne	ADRB3	34	40
O=S(=O)(NCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278285	FE	On-Demand	Anodyne	HTR2A	17	42
O=S(=O)(NCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278285	FE	On-Demand	Anodyne	HTR7	42	54
O=S(=O)(NCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278285	FE	On-Demand	Anodyne	SIGMAR1	17	52
O=S(=O)(NCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278285	FE	On-Demand	Anodyne	HTR6	24	41
O=S(=O)(NCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278286	FE	On-Demand	Anodyne	HTR2A	17	42
O=S(=O)(NCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278286	FE	On-Demand	Anodyne	HTR7	42	54
O=S(=O)(NCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278286	FE	On-Demand	Anodyne	SIGMAR1	17	52
O=S(=O)(NCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278286	FE	On-Demand	Anodyne	HTR6	24	41
CSCC[C@@H](NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1nc2ccccc2[nH]1	ZINC000872278335	EF	On-Demand	Anodyne	PTPN1	34	40
CSCC[C@H](NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1nc2ccccc2[nH]1	ZINC000872278336	EF	On-Demand	Anodyne	PTPN1	34	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278339	GF	On-Demand	Anodyne	HTR1A	25	51
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278339	GF	On-Demand	Anodyne	DRD2	17	50
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278339	GF	On-Demand	Anodyne	DRD4	37	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278339	GF	On-Demand	Anodyne	HTR7	20	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278340	GF	On-Demand	Anodyne	HTR1A	25	51
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278340	GF	On-Demand	Anodyne	DRD2	17	50
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278340	GF	On-Demand	Anodyne	DRD4	37	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCN(c2ccccn2)CC1	ZINC000872278340	GF	On-Demand	Anodyne	HTR7	20	47
COC(=O)c1cc(F)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872278369	EH	On-Demand	Anodyne	CCR3	52	39
COC(=O)c1cc(F)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278370	EH	On-Demand	Anodyne	CCR3	52	39
N#Cc1cccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278389	EF	On-Demand	Mild	CCR3	23	41
N#Cc1cccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278389	EF	On-Demand	Mild	MCHR1	30	42
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278390	EF	On-Demand	Mild	CCR3	23	41
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278390	EF	On-Demand	Mild	MCHR1	30	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000872278416	EE	On-Demand	Anodyne	DRD4	19	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000872278416	EE	On-Demand	Anodyne	HRH2	43	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000872278416	EE	On-Demand	Anodyne	SIGMAR1	24	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000872278416	EE	On-Demand	Anodyne	CCR3	44	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000872278416	EE	On-Demand	Anodyne	MCHR1	28	40
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	ESR1	74	48
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	ESR2	51	48
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	LTA4H	64	47
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	HRH3	85	50
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	PSMB2	45	46
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278430	FF	On-Demand	Anodyne	PSMB1	49	46
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	ESR1	74	48
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	ESR2	51	48
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	LTA4H	64	47
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	HRH3	85	50
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	PSMB2	45	46
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278431	FF	On-Demand	Anodyne	PSMB1	49	46
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccn1	ZINC000872278447	DE	On-Demand	Anodyne	SCN5A	40	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccccn1	ZINC000872278447	DE	On-Demand	Anodyne	SCD	17	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccn1	ZINC000872278448	DE	On-Demand	Anodyne	SCN5A	40	36
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccccn1	ZINC000872278448	DE	On-Demand	Anodyne	SCD	17	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	ACE	15	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTRA_BOVIN	64	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	KLK3	81	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTSB	62	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	PAPA1_CARPA	62	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CYSP_TRYCR	52	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTSG	43	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTSK	47	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTSL	49	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CAPNS1	65	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CELA2A	53	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	MMP11	47	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CTSS	30	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CAPN1	80	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	CAPN2	135	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	TPSAB1	41	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	NPR	73	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	PSMB5	41	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	SLC12A5	59	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278495	GE	On-Demand	Anodyne	Q9NAW4_PLAFA	36	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	ACE	15	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTRA_BOVIN	64	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	KLK3	81	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTSB	62	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	PAPA1_CARPA	62	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CYSP_TRYCR	52	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTSG	43	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTSK	47	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTSL	49	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CAPNS1	65	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CELA2A	53	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	MMP11	47	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CTSS	30	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CAPN1	80	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	CAPN2	135	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	TPSAB1	41	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	NPR	73	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	PSMB5	41	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	SLC12A5	59	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872278496	GE	On-Demand	Anodyne	Q9NAW4_PLAFA	36	41
O=c1cc(CN2CCC[C@@H](OC3CCC3)CC2)occ1O	ZINC000872278505	CE	On-Demand	Anodyne	PPO2	15	43
O=c1cc(CN2CCC[C@H](OC3CCC3)CC2)occ1O	ZINC000872278506	CE	On-Demand	Anodyne	PPO2	15	43
c1ccc(CCc2noc(CN3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000872278537	FH	On-Demand	Anodyne	SIGMAR1	21	41
c1ccc(CCc2noc(CN3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000872278538	FH	On-Demand	Anodyne	SIGMAR1	21	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccn2)CC1	ZINC000872278570	ED	On-Demand	Anodyne	L3MBTL3	34	40
CCOC(=O)CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872278581	CF	On-Demand	Anodyne	HTR4	22	41
CCOC(=O)CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278582	CF	On-Demand	Anodyne	HTR4	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000872278590	EE	On-Demand	Anodyne	PGA5	40	30
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000872278591	EE	On-Demand	Anodyne	PGA5	40	30
N#CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278594	DH	On-Demand	Mild	HRH3	32	46
N#CCOc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278594	DH	On-Demand	Mild	SIGMAR1	22	46
N#CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278595	DH	On-Demand	Mild	HRH3	32	46
N#CCOc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278595	DH	On-Demand	Mild	SIGMAR1	22	46
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	ESR1	64	33
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	KCNH2	20	43
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	ESR2	44	38
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	LTA4H	63	67
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	HRH3	61	64
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	PSMB2	43	46
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	PSMB1	48	46
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278598	EG	On-Demand	Bother	KCNJ1	22	41
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	ESR1	64	33
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	KCNH2	20	43
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	ESR2	44	38
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	LTA4H	63	67
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	HRH3	61	64
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	PSMB2	43	46
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	PSMB1	48	46
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278599	EG	On-Demand	Bother	KCNJ1	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000872278621	EE	On-Demand	Anodyne	HTR1A	19	51
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000872278621	EE	On-Demand	Anodyne	DRD3	16	49
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000872278621	EE	On-Demand	Anodyne	HTR7	34	48
Fc1ccc(-n2ccc(CN3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000872278663	EH	On-Demand	Anodyne	SCN5A	67	34
Fc1ccc(-n2ccc(CN3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000872278664	EH	On-Demand	Anodyne	SCN5A	67	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000872278671	DF	On-Demand	Anodyne	F2	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000872278672	DF	On-Demand	Anodyne	F2	19	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCC1CCC1	ZINC000872278679	CE	On-Demand	Anodyne	CACNA1I	48	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCC1CCC1	ZINC000872278680	CE	On-Demand	Anodyne	CACNA1I	48	37
c1cc2c(cc1CCN1CCC[C@H](OC3CCC3)CC1)CCO2	ZINC000872278703	DH	On-Demand	Anodyne	KCNJ1	45	40
c1cc2c(cc1CCN1CCC[C@@H](OC3CCC3)CC1)CCO2	ZINC000872278704	DH	On-Demand	Anodyne	KCNJ1	45	40
C/C(=C\C(=O)N[C@]12CCC[C@H]1OCC2)c1ccc([N+](=O)[O-])cc1	ZINC000872278709	DF	On-Demand	Bother	SLC27A4	43	31
C/C(=C/C(=O)N[C@]12CCC[C@H]1OCC2)c1ccc([N+](=O)[O-])cc1	ZINC000872278710	DF	On-Demand	Bother	SLC27A4	43	31
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCOCC1	ZINC000872278719	EE	On-Demand	Anodyne	SCN10A	15	45
C[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278729	DG	On-Demand	Anodyne	SLC6A1	60	34
C[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278729	DG	On-Demand	Anodyne	CHRM3	43	39
C[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278729	DG	On-Demand	Anodyne	AMY2	43	30
C[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278729	DG	On-Demand	Anodyne	CYP2J2	46	35
C[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278730	DG	On-Demand	Anodyne	SLC6A1	60	34
C[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278730	DG	On-Demand	Anodyne	CHRM3	43	39
C[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278730	DG	On-Demand	Anodyne	AMY2	43	30
C[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872278730	DG	On-Demand	Anodyne	CYP2J2	46	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278744	EH	On-Demand	Anodyne	DRD4	17	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278744	EH	On-Demand	Anodyne	LTA4H	15	48
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278744	EH	On-Demand	Anodyne	CCR1	15	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278744	EH	On-Demand	Anodyne	IMDH_CRYPV	15	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278745	EH	On-Demand	Anodyne	DRD4	17	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278745	EH	On-Demand	Anodyne	LTA4H	15	48
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278745	EH	On-Demand	Anodyne	CCR1	15	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000872278745	EH	On-Demand	Anodyne	IMDH_CRYPV	15	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)NCC1CCCCC1	ZINC000872278749	EG	On-Demand	Anodyne	CACNA1I	43	36
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)NCC1CCCCC1	ZINC000872278750	EG	On-Demand	Anodyne	CACNA1I	43	36
Cc1cccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278751	EG	On-Demand	Anodyne	DRD4	24	46
Cc1cccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872278751	EG	On-Demand	Anodyne	SIGMAR1	17	40
Cc1cccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278752	EG	On-Demand	Anodyne	DRD4	24	46
Cc1cccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872278752	EG	On-Demand	Anodyne	SIGMAR1	17	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278754	DE	On-Demand	Anodyne	CHRNA7	47	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278754	DE	On-Demand	Anodyne	SCD	18	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278754	DE	On-Demand	Anodyne	NAMPT	65	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278755	DE	On-Demand	Anodyne	CHRNA7	47	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278755	DE	On-Demand	Anodyne	SCD	18	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccnc1	ZINC000872278755	DE	On-Demand	Anodyne	NAMPT	65	42
COc1ccc2[nH]c(C(=O)N[C@]34CCC[C@H]3OCC4)cc2c1	ZINC000872278770	DF	On-Demand	Anodyne	PYGL	47	37
COc1ccc2[nH]c(C(=O)N[C@]34CCC[C@H]3OCC4)cc2c1	ZINC000872278770	DF	On-Demand	Anodyne	TUBB2B	40	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(c2ccccc2)CC1	ZINC000872278780	DF	On-Demand	Anodyne	EPHX2	27	48
O=C(C1=CCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872278791	BF	On-Demand	Anodyne	L3MBTL3	53	38
O=C(C1=CCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872278792	BF	On-Demand	Anodyne	L3MBTL3	53	38
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(CCN2CCOCC2)cc1	ZINC000872278798	EE	On-Demand	Anodyne	EPHX2	27	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(CCN2CCOCC2)cc1	ZINC000872278798	EE	On-Demand	Anodyne	L3MBTL3	25	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000872278818	FF	On-Demand	Anodyne	GRM4	68	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000872278818	FF	On-Demand	Anodyne	TYK2	45	34
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000872278818	FF	On-Demand	Anodyne	KCNK3	19	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC(=O)NCc2cccnc2)C1	ZINC000872278821	DC	On-Demand	Anodyne	NAMPT	56	41
c1ccc([C@@H]2C[C@H]2N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278852	CH	On-Demand	Anodyne	SLC18A3	58	43
c1ccc([C@@H]2C[C@@H]2N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278859	CH	On-Demand	Anodyne	SLC18A3	58	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000872278860	EE	On-Demand	Anodyne	HRH2	36	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000872278860	EE	On-Demand	Anodyne	CASR	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000872278860	EE	On-Demand	Anodyne	SIGMAR1	16	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000872278860	EE	On-Demand	Anodyne	CCR3	31	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000872278860	EE	On-Demand	Anodyne	EPHX2	24	49
c1ccc([C@@H]2C[C@H]2N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872278861	CH	On-Demand	Anodyne	SLC18A3	58	43
c1ccc([C@@H]2C[C@@H]2N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872278863	CH	On-Demand	Anodyne	SLC18A3	58	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	DRD4	40	31
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	PIK3CA	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	PLD1	46	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	MTOR	25	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	EPHX2	29	66
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	PIK3CG	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	PLD2	62	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000872278866	GD	On-Demand	Anodyne	HPGDS	25	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2N2CCC(O)CC2)C1	ZINC000872278885	DD	On-Demand	Anodyne	KCNQ2	69	38
N#CCCCn1cc(C(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872278910	EG	On-Demand	Mild	CNR1	22	41
N#CCCCn1cc(C(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872278910	EG	On-Demand	Mild	CNR2	38	41
O=C(c1cc(=NCc2ccccc2)cc[nH]1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872278943	GH	On-Demand	Anodyne	GRIN2B	39	45
O=C(c1cc(=NCc2ccccc2)cc[nH]1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872278944	GH	On-Demand	Anodyne	GRIN2B	39	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)Nc1cccnc1	ZINC000872278952	CD	On-Demand	Anodyne	NAMPT	41	46
Oc1nc2ccccc2n1CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872278971	EH	On-Demand	Anodyne	HRH1	35	41
Oc1nc2ccccc2n1CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872278971	EH	On-Demand	Anodyne	HRH3	18	40
Oc1nc2ccccc2n1CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872278971	EH	On-Demand	Anodyne	NPY1R	43	37
Oc1nc2ccccc2n1CCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872278971	EH	On-Demand	Anodyne	HNMT	45	32
Oc1nc2ccccc2n1CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278972	EH	On-Demand	Anodyne	HRH1	35	41
Oc1nc2ccccc2n1CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278972	EH	On-Demand	Anodyne	HRH3	18	40
Oc1nc2ccccc2n1CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278972	EH	On-Demand	Anodyne	NPY1R	43	37
Oc1nc2ccccc2n1CCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872278972	EH	On-Demand	Anodyne	HNMT	45	32
O=C(CN1CCC[C@H](OC2CCC2)CC1)NNC(=O)c1ccccc1Cl	ZINC000872278973	GF	On-Demand	Reactive	SLC6A1	80	38
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NNC(=O)c1ccccc1Cl	ZINC000872278974	GF	On-Demand	Reactive	SLC6A1	80	38
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	CHRM1	15	42
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	SLC6A1	116	44
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	SLC6A3	18	40
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	LTA4H	56	48
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	SIGMAR1	47	49
O=C(Cc1ccccc1)OCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279005	EG	On-Demand	Anodyne	CYP2J2	42	29
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	CHRM1	15	42
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	SLC6A1	116	44
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	SLC6A3	18	40
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	LTA4H	56	48
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	SIGMAR1	47	49
O=C(Cc1ccccc1)OCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279007	EG	On-Demand	Anodyne	CYP2J2	42	29
O=C(Nc1ccc(N2CCCC2)c(F)c1)[C@]12CCC[C@H]1CNC2	ZINC000872279018	DF	On-Demand	Anodyne	NPY2R	80	40
O=C(Nc1ccccc1)c1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872279020	FG	On-Demand	Anodyne	KCNK3	99	44
O=C(Nc1ccccc1)c1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872279020	FG	On-Demand	Anodyne	KCNK9	48	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)C1	ZINC000872279046	FE	On-Demand	Anodyne	NAMPT	79	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)C1	ZINC000872279053	FC	On-Demand	Anodyne	DRD4	40	31
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)C1	ZINC000872279053	FC	On-Demand	Anodyne	MTOR	19	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)C1	ZINC000872279053	FC	On-Demand	Anodyne	EPHX2	32	62
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)C1	ZINC000872279053	FC	On-Demand	Anodyne	PLD2	57	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)C1	ZINC000872279053	FC	On-Demand	Anodyne	HPGDS	25	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000872279098	CD	On-Demand	Anodyne	HTR1A	15	49
N#Cc1ccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279118	EF	On-Demand	Mild	PFKFB3	40	31
N#Cc1ccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279119	EF	On-Demand	Mild	PFKFB3	40	31
NC(=O)COc1ccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279120	GD	On-Demand	Anodyne	LGMN	45	33
NC(=O)COc1ccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279122	GD	On-Demand	Anodyne	LGMN	45	33
O=C(NCc1nc(CN2CCC[C@H](OC3CCC3)CC2)cs1)c1ccccc1	ZINC000872279130	GH	On-Demand	Anodyne	SCN5A	53	39
COc1cccc(C2=NO[C@H](C(=O)N[C@]34CCC[C@H]3OCC4)C2)c1	ZINC000872279131	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
O=C(NCc1nc(CN2CCC[C@@H](OC3CCC3)CC2)cs1)c1ccccc1	ZINC000872279132	GH	On-Demand	Anodyne	SCN5A	53	39
COc1cccc(C2=NO[C@@H](C(=O)N[C@]34CCC[C@H]3OCC4)C2)c1	ZINC000872279133	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1OCCN1CCOCC1	ZINC000872279137	GD	On-Demand	Anodyne	EPHX2	23	44
CC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279152	EG	On-Demand	Anodyne	DRD4	17	49
CC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279152	EG	On-Demand	Anodyne	CCR3	47	44
CC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279152	EG	On-Demand	Anodyne	KCNK3	41	33
CC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279154	EG	On-Demand	Anodyne	DRD4	17	49
CC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279154	EG	On-Demand	Anodyne	CCR3	47	44
CC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279154	EG	On-Demand	Anodyne	KCNK3	41	33
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc2nc(O)[nH]c2c1	ZINC000872279156	FF	On-Demand	Anodyne	MCHR1	20	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000872279157	DE	On-Demand	Anodyne	NOS2	87	39
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc2nc(O)[nH]c2c1	ZINC000872279158	FF	On-Demand	Anodyne	MCHR1	20	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000872279177	FF	On-Demand	Anodyne	NAMPT	25	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000872279177	FF	On-Demand	Anodyne	KCNK3	68	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)Nc1cccc2cccnc12	ZINC000872279216	EE	On-Demand	Anodyne	WNT3	17	41
CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000872279227	EH	On-Demand	Bother	SSTR5	85	45
CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000872279229	EH	On-Demand	Bother	SSTR5	85	45
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2cc(Cl)sc2[nH]1	ZINC000872279232	DG	On-Demand	Anodyne	PYGL	23	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(c2ccccc2)CC1	ZINC000872279247	DF	On-Demand	Anodyne	ADAM10	43	49
O=C(CN1CCC[C@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279254	GF	On-Demand	Reactive	DRD4	40	32
O=C(CN1CCC[C@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279254	GF	On-Demand	Reactive	SLC6A1	21	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279254	GF	On-Demand	Reactive	CACNA1I	59	47
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279256	GF	On-Demand	Reactive	DRD4	40	32
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279256	GF	On-Demand	Reactive	SLC6A1	21	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NNC(=O)c1cccc(Cl)c1	ZINC000872279256	GF	On-Demand	Reactive	CACNA1I	59	47
O[C@@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279258	DG	On-Demand	Anodyne	SLC18A2	64	42
O[C@@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279258	DG	On-Demand	Anodyne	LTA4H	15	40
O[C@@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279258	DG	On-Demand	Anodyne	SIGMAR1	26	42
O[C@@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279258	DG	On-Demand	Anodyne	ABCB1	50	51
O[C@@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279260	DG	On-Demand	Anodyne	SLC18A2	64	42
O[C@@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279260	DG	On-Demand	Anodyne	LTA4H	15	40
O[C@@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279260	DG	On-Demand	Anodyne	SIGMAR1	26	42
O[C@@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279260	DG	On-Demand	Anodyne	ABCB1	50	51
O[C@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279261	DG	On-Demand	Anodyne	SLC18A2	64	42
O[C@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279261	DG	On-Demand	Anodyne	LTA4H	15	40
O[C@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279261	DG	On-Demand	Anodyne	SIGMAR1	26	42
O[C@H](CCc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279261	DG	On-Demand	Anodyne	ABCB1	50	51
O[C@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279263	DG	On-Demand	Anodyne	SLC18A2	64	42
O[C@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279263	DG	On-Demand	Anodyne	LTA4H	15	40
O[C@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279263	DG	On-Demand	Anodyne	SIGMAR1	26	42
O[C@H](CCc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279263	DG	On-Demand	Anodyne	ABCB1	50	51
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000872279274	EG	On-Demand	Anodyne	CACNA1I	48	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000872279276	EG	On-Demand	Anodyne	CACNA1I	48	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000872279288	DD	On-Demand	Anodyne	NOS2	103	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000872279308	EG	On-Demand	Anodyne	F2	20	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000872279308	EG	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872279397	GI	On-Demand	Anodyne	CCR3	20	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872279397	GI	On-Demand	Anodyne	RBP4	69	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872279398	GI	On-Demand	Anodyne	CCR3	20	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000872279398	GI	On-Demand	Anodyne	RBP4	69	38
Cc1ccccc1CC(=O)NNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279399	FE	On-Demand	Reactive	SLC6A1	51	36
Cc1ccccc1CC(=O)NNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279400	FE	On-Demand	Reactive	SLC6A1	51	36
O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC[C@@H](OC2CCC2)CC1	ZINC000872279425	FG	On-Demand	Bother	L3MBTL3	21	45
O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC[C@H](OC2CCC2)CC1	ZINC000872279426	FG	On-Demand	Bother	L3MBTL3	21	45
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279430	EF	On-Demand	Anodyne	CELA1	19	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279430	EF	On-Demand	Anodyne	LTA4H	25	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279430	EF	On-Demand	Anodyne	PREP	43	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279430	EF	On-Demand	Anodyne	LGMN	40	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279431	EF	On-Demand	Anodyne	CELA1	19	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279431	EF	On-Demand	Anodyne	LTA4H	25	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279431	EF	On-Demand	Anodyne	PREP	43	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NOCc1ccccc1	ZINC000872279431	EF	On-Demand	Anodyne	LGMN	40	37
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872279446	EF	On-Demand	Clean	PDE7A	25	40
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872279446	EF	On-Demand	Clean	NPBWR1	78	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	ESR1	62	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	HRH2	45	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	ESR2	44	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	LTA4H	30	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	HRH3	33	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000872279451	GD	On-Demand	Anodyne	EPHX2	28	54
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279459	GJ	On-Demand	Anodyne	SLC6A1	57	37
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279459	GJ	On-Demand	Anodyne	HRH1	16	48
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279459	GJ	On-Demand	Anodyne	PRCP	46	40
O=C(CCc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872279462	EG	On-Demand	Anodyne	CCR2	41	34
O=C(CCc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872279462	EG	On-Demand	Anodyne	LUXR	30	54
Cc1c(F)cccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279466	EH	On-Demand	Anodyne	SLC6A1	45	34
Cc1c(F)cccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279466	EH	On-Demand	Anodyne	CCR3	48	38
Cc1c(F)cccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279468	EH	On-Demand	Anodyne	SLC6A1	45	34
Cc1c(F)cccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279468	EH	On-Demand	Anodyne	CCR3	48	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279469	GJ	On-Demand	Anodyne	SLC6A1	57	37
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279469	GJ	On-Demand	Anodyne	HRH1	16	48
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872279469	GJ	On-Demand	Anodyne	PRCP	46	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1nccs1	ZINC000872279473	DF	On-Demand	Anodyne	MAP1	120	56
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1nccs1	ZINC000872279473	DF	On-Demand	Anodyne	SLC27A1	34	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000872279474	EE	On-Demand	Anodyne	HCN1	53	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000872279474	EE	On-Demand	Anodyne	HCN4	52	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1nccs1	ZINC000872279476	DF	On-Demand	Anodyne	MAP1	120	56
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1nccs1	ZINC000872279476	DF	On-Demand	Anodyne	SLC27A1	34	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)NCc1cccnc1	ZINC000872279478	DD	On-Demand	Anodyne	TBXAS1	20	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)NCc1cccnc1	ZINC000872279478	DD	On-Demand	Anodyne	NAMPT	53	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000872279506	DF	On-Demand	Anodyne	KCNQ2	73	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000872279506	DF	On-Demand	Anodyne	SCN2A	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000872279506	DF	On-Demand	Anodyne	LNPEP	41	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000872279506	DF	On-Demand	Anodyne	SCN10A	15	44
N#Cc1c(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)sc2c1CCC2	ZINC000872279522	GH	On-Demand	Mild	VIPR1	31	49
N#Cc1c(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)sc2c1CCC2	ZINC000872279523	GH	On-Demand	Mild	VIPR1	31	49
C[C@H](C(=O)Nc1cccnc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872279537	FG	On-Demand	Anodyne	G2YM83_BOTF4	61	36
C[C@H](C(=O)Nc1cccnc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872279538	FG	On-Demand	Anodyne	G2YM83_BOTF4	61	36
O=C(N[C@]12CCC[C@H]1OCC2)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000872279570	EE	On-Demand	Anodyne	CCR2	43	37
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000872279572	EE	On-Demand	Anodyne	CCR2	43	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NNC(=O)c1ccccc1	ZINC000872279573	ED	On-Demand	Reactive	SLC6A1	81	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NNC(=O)c1ccccc1	ZINC000872279575	ED	On-Demand	Reactive	SLC6A1	81	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000872279579	DE	On-Demand	Anodyne	NPY2R	42	33
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279584	FE	On-Demand	Anodyne	LTA4H	26	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279584	FE	On-Demand	Anodyne	SIGMAR1	28	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279584	FE	On-Demand	Anodyne	CCR3	21	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)N1CCc2[nH]c3ccccc3c2C1	ZINC000872279586	GG	On-Demand	Anodyne	SSTR4	47	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279587	FE	On-Demand	Anodyne	LTA4H	26	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279587	FE	On-Demand	Anodyne	SIGMAR1	28	44
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)NCc1ccccc1	ZINC000872279587	FE	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279588	EG	On-Demand	Anodyne	DRD4	16	40
CC(=O)c1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279588	EG	On-Demand	Anodyne	SLC6A1	41	32
CC(=O)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279589	EG	On-Demand	Anodyne	DRD4	16	40
CC(=O)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279589	EG	On-Demand	Anodyne	SLC6A1	41	32
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279591	GE	On-Demand	Anodyne	HRH2	24	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279591	GE	On-Demand	Anodyne	EDNRA	36	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279591	GE	On-Demand	Anodyne	NOS2	42	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279591	GE	On-Demand	Anodyne	MCHR1	21	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279592	GE	On-Demand	Anodyne	HRH2	24	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279592	GE	On-Demand	Anodyne	EDNRA	36	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279592	GE	On-Demand	Anodyne	NOS2	42	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCOc1ccc2c(c1)OCO2	ZINC000872279592	GE	On-Demand	Anodyne	MCHR1	21	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)N1CCc2[nH]c3ccccc3c2C1	ZINC000872279595	GG	On-Demand	Anodyne	SSTR4	47	34
CN(C)CCOc1ccccc1CNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872279607	EE	On-Demand	Anodyne	AMY2	49	38
Cc1ccc(C(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279608	DH	On-Demand	Anodyne	SLC6A1	72	34
Cc1ccc(C(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279608	DH	On-Demand	Anodyne	CYP2J2	55	47
Cc1ccc(C(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279610	DH	On-Demand	Anodyne	SLC6A1	72	34
Cc1ccc(C(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279610	DH	On-Demand	Anodyne	CYP2J2	55	47
CN(C)[C@@H](CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872279615	FF	On-Demand	Anodyne	OPRK1	29	40
CN(C)[C@@H](CNC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872279617	FF	On-Demand	Anodyne	OPRK1	29	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000872279621	FF	On-Demand	Anodyne	HRH2	34	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000872279621	FF	On-Demand	Anodyne	SIGMAR1	26	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000872279621	FF	On-Demand	Anodyne	CCR3	55	46
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872279626	GF	On-Demand	Anodyne	DRD4	28	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872279626	GF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872279627	GF	On-Demand	Anodyne	DRD4	28	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872279627	GF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	SLC6A1	81	38
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	HRH1	19	41
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	CCR3	28	44
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	CCR5	18	44
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279636	FH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	SLC6A1	81	38
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	HRH1	19	41
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	CCR3	28	44
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	CCR5	18	44
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279638	FH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	SLC6A1	81	38
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	HRH1	19	41
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	CCR3	28	44
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	CCR5	18	44
O=C(c1ccccc1)N1CC[C@@H](CN2CCC[C@H](OC3CCC3)CC2)C1	ZINC000872279641	FH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	SLC6A1	81	38
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	HRH1	19	41
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	CCR3	28	44
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	CCR5	18	44
O=C(c1ccccc1)N1CC[C@H](CN2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000872279644	FH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(Cc1ccc(I)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872279651	FF	On-Demand	Anodyne	LUXR	30	45
Cc1cncc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279655	CG	On-Demand	Anodyne	SSTR5	35	45
Cc1cncc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279656	CG	On-Demand	Anodyne	SSTR5	35	45
O=C(COCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872279662	CD	On-Demand	Anodyne	CHRNA7	40	34
CN(C)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279667	FH	On-Demand	Anodyne	TERT	18	42
CN(C)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279669	FH	On-Demand	Anodyne	TERT	18	42
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279705	EG	On-Demand	Anodyne	DRD4	26	43
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279705	EG	On-Demand	Anodyne	ACHE	32	42
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279705	EG	On-Demand	Anodyne	SIGMAR1	49	45
c1ccc(Cn2cc(CN3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279705	EG	On-Demand	Anodyne	SCN5A	58	38
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279706	EG	On-Demand	Anodyne	DRD4	26	43
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279706	EG	On-Demand	Anodyne	ACHE	32	42
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279706	EG	On-Demand	Anodyne	SIGMAR1	49	45
c1ccc(Cn2cc(CN3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000872279706	EG	On-Demand	Anodyne	SCN5A	58	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872279709	FF	On-Demand	Anodyne	PRCP	19	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872279709	FF	On-Demand	Anodyne	GRM5	16	50
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872279709	FF	On-Demand	Anodyne	SMO	48	51
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872279709	FF	On-Demand	Anodyne	ETHR	63	41
N#Cc1cc(Cl)ccc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279711	DI	On-Demand	Mild	NOS3	15	43
N#Cc1cc(Cl)ccc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279712	DI	On-Demand	Mild	NOS3	15	43
c1cc(CCCN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872279722	CG	On-Demand	Anodyne	HRH3	26	40
c1cc(CCCN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872279722	CG	On-Demand	Anodyne	SIGMAR1	30	43
c1cc(CCCN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872279722	CG	On-Demand	Anodyne	L3MBTL3	20	41
c1cc(CCCN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872279723	CG	On-Demand	Anodyne	HRH3	26	40
c1cc(CCCN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872279723	CG	On-Demand	Anodyne	SIGMAR1	30	43
c1cc(CCCN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872279723	CG	On-Demand	Anodyne	L3MBTL3	20	41
C(#Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279726	CG	On-Demand	Mild	GRIN2C	18	48
C(#Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279727	CG	On-Demand	Mild	GRIN2C	18	48
COC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279734	FF	On-Demand	Anodyne	DRD4	16	48
COC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279734	FF	On-Demand	Anodyne	CCR3	37	42
COC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279734	FF	On-Demand	Anodyne	EPHX2	16	43
COC(=O)c1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279734	FF	On-Demand	Anodyne	HIF1A	15	43
COC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279738	FF	On-Demand	Anodyne	DRD4	16	48
COC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279738	FF	On-Demand	Anodyne	CCR3	37	42
COC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279738	FF	On-Demand	Anodyne	EPHX2	16	43
COC(=O)c1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279738	FF	On-Demand	Anodyne	HIF1A	15	43
O=C(Cc1nc(CN2CCC[C@H](OC3CCC3)CC2)cs1)Nc1ccccc1	ZINC000872279810	GI	On-Demand	Anodyne	SCN5A	53	38
O=C(Cc1nc(CN2CCC[C@@H](OC3CCC3)CC2)cs1)Nc1ccccc1	ZINC000872279811	GI	On-Demand	Anodyne	SCN5A	53	38
COC(=O)[C@@H](c1ccc(F)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872279813	EG	On-Demand	Anodyne	SLC6A3	25	46
COC(=O)[C@@H](c1ccc(F)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872279815	EG	On-Demand	Anodyne	SLC6A3	25	46
O[C@@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279819	DG	On-Demand	Anodyne	LTA4H	18	41
O[C@@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279819	DG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279819	DG	On-Demand	Anodyne	ABCB1	47	42
O[C@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279820	DG	On-Demand	Anodyne	LTA4H	18	41
O[C@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279820	DG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279820	DG	On-Demand	Anodyne	ABCB1	47	42
O[C@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279821	DG	On-Demand	Anodyne	LTA4H	18	41
O[C@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279821	DG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](Cc1ccccc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279821	DG	On-Demand	Anodyne	ABCB1	47	42
O[C@@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279822	DG	On-Demand	Anodyne	LTA4H	18	41
O[C@@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279822	DG	On-Demand	Anodyne	SIGMAR1	24	44
O[C@@H](Cc1ccccc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279822	DG	On-Demand	Anodyne	ABCB1	47	42
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279838	FF	On-Demand	Mild	CCR3	15	43
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279838	FF	On-Demand	Mild	CHRNA10	28	42
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279838	FF	On-Demand	Mild	MEN1	43	34
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279839	FF	On-Demand	Mild	CCR3	15	43
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279839	FF	On-Demand	Mild	CHRNA10	28	42
N#Cc1cccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279839	FF	On-Demand	Mild	MEN1	43	34
CN(CCC(=O)N[C@]12CCC[C@H]1OCC2)C(=O)OCc1ccccc1	ZINC000872279857	EE	On-Demand	Anodyne	SLC12A5	70	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	DRD4	34	44
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	SSTR5	40	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	CCR3	28	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	EPHX2	17	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	MCHR1	24	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279869	GF	On-Demand	Anodyne	KCNK3	48	33
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	DRD4	34	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	SSTR5	40	36
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	CCR3	28	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	EPHX2	17	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	MCHR1	24	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000872279872	GF	On-Demand	Anodyne	KCNK3	48	33
c1cncc(CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279883	CG	On-Demand	Anodyne	LTA4H	19	48
c1cncc(CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279883	CG	On-Demand	Anodyne	SIGMAR1	19	40
c1cncc(CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279883	CG	On-Demand	Anodyne	CHRNA7	45	39
c1cncc(CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279883	CG	On-Demand	Anodyne	ACHP_LYMST	29	42
c1cncc(CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279884	CG	On-Demand	Anodyne	LTA4H	19	48
c1cncc(CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279884	CG	On-Demand	Anodyne	SIGMAR1	19	40
c1cncc(CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279884	CG	On-Demand	Anodyne	CHRNA7	45	39
c1cncc(CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279884	CG	On-Demand	Anodyne	ACHP_LYMST	29	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000872279924	FG	On-Demand	Anodyne	TYK2	62	36
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000872279924	FG	On-Demand	Anodyne	KCNK3	92	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000872279924	FG	On-Demand	Anodyne	KCNK9	44	34
N#Cc1cccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279942	EG	On-Demand	Mild	CCR3	43	49
N#Cc1cccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872279942	EG	On-Demand	Mild	MCHR1	60	44
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279944	EG	On-Demand	Mild	CCR3	43	49
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872279944	EG	On-Demand	Mild	MCHR1	60	44
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279954	GG	On-Demand	Bother	HTR4	28	40
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872279954	GG	On-Demand	Bother	KCNMA1	20	44
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279955	GG	On-Demand	Bother	HTR4	28	40
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279955	GG	On-Demand	Bother	KCNMA1	20	44
O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279971	EG	On-Demand	Bother	KCNJ1	15	40
Cn1cccc1C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872279972	CF	On-Demand	Anodyne	SLC6A1	32	42
Cn1cccc1C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872279974	CF	On-Demand	Anodyne	SLC6A1	32	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000872279976	GD	On-Demand	Clean	TMPRSS11D	47	33
O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872279980	EG	On-Demand	Bother	KCNJ1	15	40
O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279982	EG	On-Demand	Bother	KCNJ1	15	40
O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872279984	EG	On-Demand	Bother	KCNJ1	15	40
c1ccc(CN2CCCO[C@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872279988	FH	On-Demand	Anodyne	DRD4	36	48
c1ccc(CN2CCCO[C@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872279988	FH	On-Demand	Anodyne	SIGMAR1	44	42
c1ccc(CN2CCCO[C@@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872279998	FH	On-Demand	Anodyne	DRD4	36	48
c1ccc(CN2CCCO[C@@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872279998	FH	On-Demand	Anodyne	SIGMAR1	44	42
c1ccc(CN2CCCO[C@@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872279999	FH	On-Demand	Anodyne	DRD4	36	48
c1ccc(CN2CCCO[C@@H](CN3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872279999	FH	On-Demand	Anodyne	SIGMAR1	44	42
c1ccc(CN2CCCO[C@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280000	FH	On-Demand	Anodyne	DRD4	36	48
c1ccc(CN2CCCO[C@H](CN3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280000	FH	On-Demand	Anodyne	SIGMAR1	44	42
N#CCSc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280021	FH	On-Demand	Mild	LGMN	53	33
N#CCSc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280029	FH	On-Demand	Mild	LGMN	53	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	DRD4	41	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	ACHE	33	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	SIGMAR1	50	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	PREP	27	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	FAAH	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	CACNA1G	30	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	NPFFR1	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000872280036	FD	On-Demand	Anodyne	TMPRSS11D	45	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	HTR1A	19	53
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	DRD2	21	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	DRD4	21	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	ACHE	15	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	HTR2A	18	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	SLC6A1	160	45
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	HRH1	22	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	CHRM4	17	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	CHRM3	16	46
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	LTA4H	32	40
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	HTR7	24	43
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	SIGMAR1	37	61
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	PREP	25	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280061	DH	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	HTR1A	19	53
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	DRD2	21	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	DRD4	21	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	ACHE	15	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	HTR2A	18	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	SLC6A1	160	45
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	HRH1	22	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	CHRM4	17	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	CHRM3	16	46
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	LTA4H	32	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	HTR7	24	43
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	SIGMAR1	37	61
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	PREP	25	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872280062	DH	On-Demand	Anodyne	CYP2J2	58	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(Cc2ccccn2)c1	ZINC000872280063	DE	On-Demand	Anodyne	RPS6KA3	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(Cc2ccccn2)c1	ZINC000872280063	DE	On-Demand	Anodyne	PANC	50	33
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280090	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280090	EF	On-Demand	Anodyne	CCR3	77	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280090	EF	On-Demand	Anodyne	CACNA1G	43	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000872280092	DE	On-Demand	Anodyne	RPS6KA3	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000872280092	DE	On-Demand	Anodyne	PANC	54	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280093	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280093	EF	On-Demand	Anodyne	CCR3	77	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc(F)cc1	ZINC000872280093	EF	On-Demand	Anodyne	CACNA1G	43	35
Cn1ccnc1-c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872280103	DF	On-Demand	Anodyne	CCR3	25	43
Cn1ccnc1-c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872280103	DF	On-Demand	Anodyne	CCKBR	56	39
O=C(CCCc1cccc(C(F)(F)F)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872280123	EH	On-Demand	Anodyne	LUXR	20	48
c1cn(C2CCCC2)nc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280125	DH	On-Demand	Anodyne	SCN5A	47	31
c1cn(C2CCCC2)nc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280130	DH	On-Demand	Anodyne	SCN5A	47	31
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	HTR1A	27	41
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	DRD4	32	48
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	DRD3	24	40
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	HTR4	17	50
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	CHRM3	16	40
COc1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280139	EG	On-Demand	Anodyne	CCR3	22	42
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	HTR1A	27	41
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	DRD4	32	48
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	DRD3	24	40
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	HTR4	17	50
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	CHRM3	16	40
COc1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280141	EG	On-Demand	Anodyne	CCR3	22	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc2c(c1)OCO2	ZINC000872280143	EF	On-Demand	Anodyne	MCHR1	24	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc2c(c1)OCO2	ZINC000872280144	EF	On-Demand	Anodyne	MCHR1	24	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	SLC6A1	83	38
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	HRH1	17	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	HTR4	31	43
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	CELA1	19	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	GRIN2B	42	38
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	LTA4H	34	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	SIGMAR1	47	40
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	PREP	61	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCN1CCC[C@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280167	EH	On-Demand	Anodyne	SLC12A5	64	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	SLC6A1	83	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	HRH1	17	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	HTR4	31	43
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	CELA1	19	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	GRIN2B	42	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	LTA4H	34	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	SIGMAR1	47	40
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	PREP	61	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)OCc1ccccc1	ZINC000872280168	EH	On-Demand	Anodyne	SLC12A5	64	38
COC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1C#N	ZINC000872280177	EG	On-Demand	Mild	CCR3	17	40
COC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1C#N	ZINC000872280178	EG	On-Demand	Mild	CCR3	17	40
CN1CCN(C(=O)c2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)CC1	ZINC000872280196	ED	On-Demand	Anodyne	EPHX2	20	53
CN1CCN(C(=O)c2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)CC1	ZINC000872280196	ED	On-Demand	Anodyne	L3MBTL3	47	40
O=C(c1cnc(Br)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280202	GI	On-Demand	Anodyne	L3MBTL3	45	36
O=C(c1cnc(Br)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280203	GI	On-Demand	Anodyne	L3MBTL3	45	36
CC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280216	FH	On-Demand	Anodyne	LTA4H	15	43
CC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280216	FH	On-Demand	Anodyne	CCR3	15	42
CC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280216	FH	On-Demand	Anodyne	TERT	16	42
CC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280217	FH	On-Demand	Anodyne	LTA4H	15	43
CC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280217	FH	On-Demand	Anodyne	CCR3	15	42
CC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280217	FH	On-Demand	Anodyne	TERT	16	42
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280271	FF	On-Demand	Anodyne	HRH3	24	43
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280271	FF	On-Demand	Anodyne	SIGMAR1	21	42
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280271	FF	On-Demand	Anodyne	SSTR5	15	42
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280271	FF	On-Demand	Anodyne	CASP7	42	33
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280273	FF	On-Demand	Anodyne	HRH3	24	43
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280273	FF	On-Demand	Anodyne	SIGMAR1	21	42
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280273	FF	On-Demand	Anodyne	SSTR5	15	42
CN(C)S(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280273	FF	On-Demand	Anodyne	CASP7	42	33
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(CCc2ccccc2)C1	ZINC000872280278	EF	On-Demand	Anodyne	SLC6A1	150	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(CCc2ccccc2)C1	ZINC000872280278	EF	On-Demand	Anodyne	OPRM1	17	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCCN(CCc2ccccc2)C1	ZINC000872280278	EF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(CCc2ccccc2)C1	ZINC000872280280	EF	On-Demand	Anodyne	SLC6A1	150	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(CCc2ccccc2)C1	ZINC000872280280	EF	On-Demand	Anodyne	OPRM1	17	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCCN(CCc2ccccc2)C1	ZINC000872280280	EF	On-Demand	Anodyne	SIGMAR1	21	43
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	DRD4	35	43
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	ACHE	25	42
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	HRH3	21	40
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	SIGMAR1	52	46
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	SLC18A3	33	41
c1ccc(CN2CC[C@@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280294	EH	On-Demand	Anodyne	L3MBTL3	39	40
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	DRD4	35	43
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	ACHE	25	42
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	HRH3	21	40
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	SIGMAR1	52	46
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	SLC18A3	33	41
c1ccc(CN2CC[C@H](N3CCC[C@H](OC4CCC4)CC3)C2)cc1	ZINC000872280296	EH	On-Demand	Anodyne	L3MBTL3	39	40
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	DRD4	35	43
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	ACHE	25	42
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	HRH3	21	40
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	SIGMAR1	52	46
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	SLC18A3	33	41
c1ccc(CN2CC[C@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280299	EH	On-Demand	Anodyne	L3MBTL3	39	40
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	DRD4	35	43
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	ACHE	25	42
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	HRH3	21	40
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	SIGMAR1	52	46
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	SLC18A3	33	41
c1ccc(CN2CC[C@@H](N3CCC[C@@H](OC4CCC4)CC3)C2)cc1	ZINC000872280302	EH	On-Demand	Anodyne	L3MBTL3	39	40
O=S(=O)(CCN1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872280314	FG	On-Demand	Anodyne	SLC6A1	46	35
O=S(=O)(CCN1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872280314	FG	On-Demand	Anodyne	SIGMAR1	36	40
O=S(=O)(CCN1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872280316	FG	On-Demand	Anodyne	SLC6A1	46	35
O=S(=O)(CCN1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872280316	FG	On-Demand	Anodyne	SIGMAR1	36	40
FCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280326	CI	On-Demand	Anodyne	HRH3	24	47
FCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280326	CI	On-Demand	Anodyne	SIGMAR1	38	43
FCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280327	CI	On-Demand	Anodyne	HRH3	24	47
FCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280327	CI	On-Demand	Anodyne	SIGMAR1	38	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)Nc1cccnc1	ZINC000872280332	DD	On-Demand	Anodyne	NAMPT	36	45
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872280343	DE	On-Demand	Anodyne	ACHE	32	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872280343	DE	On-Demand	Anodyne	SIGMAR1	55	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872280343	DE	On-Demand	Anodyne	CACNA1G	25	43
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872280347	DE	On-Demand	Anodyne	ACHE	32	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872280347	DE	On-Demand	Anodyne	SIGMAR1	55	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872280347	DE	On-Demand	Anodyne	CACNA1G	25	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNc1ccccc1	ZINC000872280354	CF	On-Demand	Anodyne	AMY2	44	31
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNc1ccccc1	ZINC000872280354	CF	On-Demand	Anodyne	TBK1	56	38
O=C(c1cnc(Cl)c(Cl)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280356	EH	On-Demand	Anodyne	L3MBTL3	53	38
O=C(c1cnc(Cl)c(Cl)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280359	EH	On-Demand	Anodyne	L3MBTL3	53	38
Fc1ccc(C#CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280365	DH	On-Demand	Mild	GRIN2C	18	41
FC(F)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280372	DJ	On-Demand	Anodyne	SLC6A3	26	45
FC(F)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280372	DJ	On-Demand	Anodyne	HRH3	15	41
FC(F)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280372	DJ	On-Demand	Anodyne	SIGMAR1	27	40
FC(F)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280374	DJ	On-Demand	Anodyne	SLC6A3	26	45
FC(F)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280374	DJ	On-Demand	Anodyne	HRH3	15	41
FC(F)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280374	DJ	On-Demand	Anodyne	SIGMAR1	27	40
Fc1ccc(C#CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280376	DH	On-Demand	Mild	GRIN2C	18	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000872280396	ED	On-Demand	Anodyne	ACHE	36	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000872280396	ED	On-Demand	Anodyne	SIGMAR1	31	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000872280396	ED	On-Demand	Anodyne	CCR3	67	46
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280397	GG	On-Demand	Anodyne	F10	15	48
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280397	GG	On-Demand	Anodyne	APP	51	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	DRD4	23	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	KCNH2	16	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	SIGMAR1	24	60
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	SSTR5	48	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	CCR3	49	48
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	EPHX2	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	MCHR1	52	52
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872280407	FF	On-Demand	Anodyne	CACNA1G	23	40
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280412	GG	On-Demand	Anodyne	F10	15	48
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280412	GG	On-Demand	Anodyne	APP	51	36
OCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280418	CG	On-Demand	Anodyne	ACHE	15	45
OCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280418	CG	On-Demand	Anodyne	HRH3	27	48
OCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280418	CG	On-Demand	Anodyne	SIGMAR1	43	43
OCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280422	CG	On-Demand	Anodyne	ACHE	15	45
OCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280422	CG	On-Demand	Anodyne	HRH3	27	48
OCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280422	CG	On-Demand	Anodyne	SIGMAR1	43	43
NC(=O)c1ccc(-c2nc(CN3CCC[C@H](OC4CCC4)CC3)cs2)cc1	ZINC000872280474	GH	On-Demand	Anodyne	CHEK2	40	37
NC(=O)c1ccc(-c2nc(CN3CCC[C@@H](OC4CCC4)CC3)cs2)cc1	ZINC000872280477	GH	On-Demand	Anodyne	CHEK2	40	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNc1ncccn1	ZINC000872280515	CD	On-Demand	Anodyne	TBK1	71	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(OCCn2cncn2)c1	ZINC000872280527	EE	On-Demand	Anodyne	EPHX2	18	47
Oc1nc(CN2CCC[C@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280528	EG	On-Demand	Anodyne	TNKS	48	33
Oc1nc(CN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280529	EG	On-Demand	Anodyne	TNKS	48	33
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280532	EH	On-Demand	Anodyne	SSTR2	42	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280532	EH	On-Demand	Anodyne	HTR4	15	50
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280532	EH	On-Demand	Anodyne	GRIN2B	15	65
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280533	EH	On-Demand	Anodyne	SSTR2	42	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280533	EH	On-Demand	Anodyne	HTR4	15	50
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2ccccc12	ZINC000872280533	EH	On-Demand	Anodyne	GRIN2B	15	65
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280541	FH	On-Demand	Anodyne	DRD4	15	45
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280541	FH	On-Demand	Anodyne	SLC6A1	28	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280541	FH	On-Demand	Anodyne	CCR3	46	36
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280542	FH	On-Demand	Anodyne	DRD4	15	45
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280542	FH	On-Demand	Anodyne	SLC6A1	28	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)cc1Cl	ZINC000872280542	FH	On-Demand	Anodyne	CCR3	46	36
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872280570	GG	On-Demand	Anodyne	HTR4	41	37
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1Cl	ZINC000872280570	GG	On-Demand	Anodyne	TERT	17	41
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872280571	GG	On-Demand	Anodyne	HTR4	41	37
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1Cl	ZINC000872280571	GG	On-Demand	Anodyne	TERT	17	41
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	HTR1A	86	51
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	DRD2	73	51
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	DRD4	36	43
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	ADRA1D	78	43
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	HTR2A	19	46
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	ADRA1A	69	43
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	ADRA1B	62	43
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	DRD3	70	43
COc1ccccc1N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872280612	EF	On-Demand	Anodyne	HTR7	51	41
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	ACHE	28	41
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	LTA4H	37	42
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	HRH3	34	49
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	CCR3	31	43
CC(=O)Oc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280632	DH	On-Demand	Anodyne	MLNR	18	40
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	ACHE	28	41
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	LTA4H	37	42
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	HRH3	34	49
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	CCR3	31	43
CC(=O)Oc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280633	DH	On-Demand	Anodyne	MLNR	18	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000872280641	FD	On-Demand	Anodyne	SSTR1	41	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000872280641	FD	On-Demand	Anodyne	ADAM10	43	46
Nc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872280654	CF	On-Demand	Anodyne	HRH3	17	43
Nc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872280654	CF	On-Demand	Anodyne	SSTR5	54	38
Nc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872280656	CF	On-Demand	Anodyne	HRH3	17	43
Nc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872280656	CF	On-Demand	Anodyne	SSTR5	54	38
c1ccc(-n2ncnc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280695	EG	On-Demand	Anodyne	SCN5A	48	37
c1ccc(-n2ncnc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280697	EG	On-Demand	Anodyne	SCN5A	48	37
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280708	FD	On-Demand	Reactive	CCR3	17	47
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280710	FD	On-Demand	Reactive	CCR3	17	47
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	SLC6A1	36	40
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	LTA4H	37	44
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	HRH3	57	53
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	SIGMAR1	56	45
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	NPY1R	41	35
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	GBA	21	42
c1ccc(COCCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280723	DI	On-Demand	Anodyne	GBA2	54	42
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	SLC6A1	36	40
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	LTA4H	37	44
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	HRH3	57	53
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	SIGMAR1	56	45
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	NPY1R	41	35
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	GBA	21	42
c1ccc(COCCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280724	DI	On-Demand	Anodyne	GBA2	54	42
C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280751	GH	On-Demand	Mild	VIPR1	26	41
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280752	GH	On-Demand	Mild	VIPR1	26	41
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280753	GH	On-Demand	Mild	VIPR1	26	41
C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280754	GH	On-Demand	Mild	VIPR1	26	41
Oc1nc(CCN2CCC[C@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280765	EG	On-Demand	Anodyne	HNMT	68	33
Oc1nc(CCN2CCC[C@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280765	EG	On-Demand	Anodyne	TNKS	47	32
NC(=O)c1ccccc1NC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872280768	EE	On-Demand	Anodyne	PARP1	18	41
Oc1nc(CCN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280769	EG	On-Demand	Anodyne	HNMT	68	33
Oc1nc(CCN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc12	ZINC000872280769	EG	On-Demand	Anodyne	TNKS	47	32
NC(=O)c1ccccc1NC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872280771	EE	On-Demand	Anodyne	PARP1	18	41
CN1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872280775	FD	On-Demand	Anodyne	AVPR2	32	41
CN1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872280775	FD	On-Demand	Anodyne	NPY2R	18	44
CN1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872280775	FD	On-Demand	Anodyne	MTOR	15	43
CN1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872280775	FD	On-Demand	Anodyne	EPHX2	25	54
CN1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872280775	FD	On-Demand	Anodyne	L3MBTL3	78	46
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872280816	FF	On-Demand	Anodyne	PSEN2	49	30
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280822	FF	On-Demand	Anodyne	LTA4H	17	41
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280822	FF	On-Demand	Anodyne	TERT	16	40
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280823	FF	On-Demand	Anodyne	LTA4H	17	41
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280823	FF	On-Demand	Anodyne	TERT	16	40
COCCOc1ccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280827	GF	On-Demand	Anodyne	LTA4H	38	41
COCCOc1ccc(CNC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872280827	GF	On-Demand	Anodyne	HRH3	44	43
COCCOc1ccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280829	GF	On-Demand	Anodyne	LTA4H	38	41
COCCOc1ccc(CNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872280829	GF	On-Demand	Anodyne	HRH3	44	43
COC(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)c(F)c1	ZINC000872280847	EH	On-Demand	Anodyne	CCR3	19	41
COC(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)c(F)c1	ZINC000872280850	EH	On-Demand	Anodyne	CCR3	19	41
C[C@@H](C(=O)Nc1nccs1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280852	DF	On-Demand	Anodyne	MAP1	108	39
C[C@@H](C(=O)Nc1nccs1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280852	DF	On-Demand	Anodyne	GCK	20	41
C[C@@H](C(=O)Nc1nccs1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280855	DF	On-Demand	Anodyne	MAP1	108	39
C[C@@H](C(=O)Nc1nccs1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280855	DF	On-Demand	Anodyne	GCK	20	41
C[C@H](C(=O)Nc1nccs1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280857	DF	On-Demand	Anodyne	MAP1	108	39
C[C@H](C(=O)Nc1nccs1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872280857	DF	On-Demand	Anodyne	GCK	20	41
C[C@H](C(=O)Nc1nccs1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280860	DF	On-Demand	Anodyne	MAP1	108	39
C[C@H](C(=O)Nc1nccs1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872280860	DF	On-Demand	Anodyne	GCK	20	41
N#CCn1c(CN2CCC[C@H](OC3CCC3)CC2)nc2ccccc2c1=O	ZINC000872280875	FF	On-Demand	Mild	HIF1A	19	41
N#CCn1c(CN2CCC[C@@H](OC3CCC3)CC2)nc2ccccc2c1=O	ZINC000872280877	FF	On-Demand	Mild	HIF1A	19	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280887	GF	On-Demand	Anodyne	DRD4	33	42
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280887	GF	On-Demand	Anodyne	MAPK14	23	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280887	GF	On-Demand	Anodyne	SIGMAR1	16	45
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280887	GF	On-Demand	Anodyne	SSTR5	43	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280887	GF	On-Demand	Anodyne	MCHR1	18	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280888	GF	On-Demand	Anodyne	DRD4	33	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280888	GF	On-Demand	Anodyne	MAPK14	23	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280888	GF	On-Demand	Anodyne	SIGMAR1	16	45
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280888	GF	On-Demand	Anodyne	SSTR5	43	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872280888	GF	On-Demand	Anodyne	MCHR1	18	41
Oc1nc(CN2CCC[C@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280890	FI	On-Demand	Anodyne	PIM1	21	54
Oc1nc(CN2CCC[C@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280890	FI	On-Demand	Anodyne	PIM2	15	54
Oc1nc(CN2CCC[C@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280890	FI	On-Demand	Anodyne	CDC7	23	54
Oc1nc(CN2CCC[C@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280890	FI	On-Demand	Anodyne	PIM3	27	54
Oc1nc(CN2CCC[C@@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280891	FI	On-Demand	Anodyne	PIM1	21	54
Oc1nc(CN2CCC[C@@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280891	FI	On-Demand	Anodyne	PIM2	15	54
Oc1nc(CN2CCC[C@@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280891	FI	On-Demand	Anodyne	CDC7	23	54
Oc1nc(CN2CCC[C@@H](OC3CCC3)CC2)nc2c1oc1ccccc12	ZINC000872280891	FI	On-Demand	Anodyne	PIM3	27	54
COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000872280893	GG	On-Demand	Bother	TAAR1	19	41
COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000872280894	GG	On-Demand	Bother	TAAR1	19	41
CC(=O)c1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280905	FH	On-Demand	Anodyne	CCR3	28	40
CC(=O)c1cccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872280906	FH	On-Demand	Anodyne	CCR3	28	40
CC(=O)c1cccc(NC(=O)[C@@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280907	FH	On-Demand	Anodyne	CCR3	28	40
CC(=O)c1cccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872280908	FH	On-Demand	Anodyne	CCR3	28	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	DRD4	24	48
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	SLC6A1	52	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	HRH1	15	49
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	KCNQ2	55	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	CCR3	19	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280909	EH	On-Demand	Anodyne	EPHB3	45	33
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	DRD4	24	48
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	SLC6A1	52	35
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	HRH1	15	49
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	KCNQ2	55	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	CCR3	19	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1Cl	ZINC000872280910	EH	On-Demand	Anodyne	EPHB3	45	33
O=c1cc(CN2CCC[C@H](OC3CCC3)CC2)c2ccc(O)cc2o1	ZINC000872280916	EG	On-Demand	Anodyne	HSD17B3	35	50
O=c1cc(CN2CCC[C@@H](OC3CCC3)CC2)c2ccc(O)cc2o1	ZINC000872280917	EG	On-Demand	Anodyne	HSD17B3	35	50
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cn2)C1	ZINC000872280921	FG	On-Demand	Anodyne	KLKB1	20	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cn2)C1	ZINC000872280921	FG	On-Demand	Anodyne	F10	54	53
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cn2)C1	ZINC000872280921	FG	On-Demand	Anodyne	G2YM83_BOTF4	50	32
O=C(CNC(=O)c1cccc(O)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872280923	DC	On-Demand	Anodyne	CCR2	43	36
CC(=O)OCC(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12	ZINC000872280941	EF	On-Demand	Anodyne	SSTR2	54	38
CC(=O)OCC(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12	ZINC000872280942	EF	On-Demand	Anodyne	SSTR2	54	38
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000872280959	GE	On-Demand	Anodyne	CCR3	17	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000872280959	GE	On-Demand	Anodyne	MCHR1	21	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000872280960	GE	On-Demand	Anodyne	CCR3	17	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000872280960	GE	On-Demand	Anodyne	MCHR1	21	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(Cc2cscn2)CC1	ZINC000872280970	DD	On-Demand	Anodyne	SCN5A	43	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2OCCn2ccnc2)C1	ZINC000872280979	EE	On-Demand	Anodyne	TBXAS1	28	45
O=C(NCc1ccnc(-n2ccnc2)c1)[C@]12CCC[C@H]1CNC2	ZINC000872280980	DD	On-Demand	Anodyne	NOS2	106	42
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872280987	GG	On-Demand	Anodyne	DRD4	18	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1C(=O)NC1CC1	ZINC000872280988	GG	On-Demand	Anodyne	DRD4	18	42
O=C(NCc1ccc(-n2ccnc2)cc1)[C@]12CCC[C@H]1CNC2	ZINC000872280990	DD	On-Demand	Anodyne	NOS2	84	39
O=C(N[C@]12CCC[C@H]1OCC2)C(=O)N1CCN(c2ccccc2)CC1	ZINC000872280995	ED	On-Demand	Anodyne	ADAM10	40	42
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281030	GG	On-Demand	Bother	KCNMA1	20	45
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281032	GG	On-Demand	Bother	KCNMA1	20	45
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281034	GG	On-Demand	Bother	KCNMA1	20	45
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281036	GG	On-Demand	Bother	KCNMA1	20	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2nc3c(s2)CCN(Cc2ccccc2)C3)C1	ZINC000872281042	FF	On-Demand	Anodyne	SLC27A1	28	40
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	DRD2	16	46
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	HRH2	22	42
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	SLC6A4	18	43
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	KCNH2	17	42
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	LTA4H	43	40
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	HRH3	98	50
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	SIGMAR1	25	42
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	NPY1R	41	34
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	CCR3	15	68
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	CHRNA10	82	55
N#Cc1cccc(OCCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281043	EH	On-Demand	Mild	MEN1	57	46
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	DRD2	16	46
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	HRH2	22	42
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	SLC6A4	18	43
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	KCNH2	17	42
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	LTA4H	43	40
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	HRH3	98	50
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	SIGMAR1	25	42
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	NPY1R	41	34
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	CCR3	15	68
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	CHRNA10	82	55
N#Cc1cccc(OCCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281044	EH	On-Demand	Mild	MEN1	57	46
N#Cc1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281058	EG	On-Demand	Mild	CCR3	17	43
N#Cc1ccc(NC(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281058	EG	On-Demand	Mild	TERT	16	40
N#Cc1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281059	EG	On-Demand	Mild	CCR3	17	43
N#Cc1ccc(NC(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281059	EG	On-Demand	Mild	TERT	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000872281072	DE	On-Demand	Anodyne	HRH3	21	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000872281072	DE	On-Demand	Anodyne	L3MBTL3	62	40
O=C(Nc1ccc(Cl)c(F)c1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872281083	EE	On-Demand	Anodyne	ENV	58	52
CC(=O)N1CCN(c2ccccc2CNC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872281087	FD	On-Demand	Anodyne	MC4R	35	41
CC(=O)N1CCN(c2ccccc2CNC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872281087	FD	On-Demand	Anodyne	KCNQ2	44	34
COC(=O)[C@@H](c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281097	DG	On-Demand	Anodyne	SLC6A3	21	46
COC(=O)[C@@H](c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281097	DG	On-Demand	Anodyne	NPY2R	27	45
COC(=O)[C@@H](c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281100	DG	On-Demand	Anodyne	SLC6A3	21	46
COC(=O)[C@@H](c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281100	DG	On-Demand	Anodyne	NPY2R	27	45
N#CCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281115	CH	On-Demand	Mild	HRH3	22	44
N#CCc1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281115	CH	On-Demand	Mild	SIGMAR1	20	40
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA2	48	42
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA6	18	41
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA1	48	42
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA7	32	42
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	HRH3	23	40
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA4	26	40
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA12	35	42
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA9	42	42
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CAH_METTE	19	41
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	NCE103	21	41
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	CA15	19	41
NS(=O)(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281120	FE	On-Demand	Anodyne	A6YCJ1_9METZ	25	41
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA2	48	42
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA6	18	41
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA1	48	42
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA7	32	42
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	HRH3	23	40
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA4	26	40
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA12	35	42
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA9	42	42
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CAH_METTE	19	41
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	NCE103	21	41
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	CA15	19	41
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281122	FE	On-Demand	Anodyne	A6YCJ1_9METZ	25	41
C[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)CN1CCOCC1	ZINC000872281128	CC	On-Demand	Anodyne	TPP2	15	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccnc(NC(=O)C2CC2)c1	ZINC000872281129	DD	On-Demand	Anodyne	TYK2	61	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000872281141	FF	On-Demand	Anodyne	KDM1A	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000872281141	FF	On-Demand	Anodyne	NAMPT	45	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1nc2c(s1)CCC2	ZINC000872281144	EF	On-Demand	Anodyne	SLC27A1	62	56
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1nc2c(s1)CCC2	ZINC000872281145	EF	On-Demand	Anodyne	SLC27A1	62	56
N#CCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281150	CH	On-Demand	Mild	HRH3	22	44
N#CCc1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281150	CH	On-Demand	Mild	SIGMAR1	20	40
COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872281163	GG	On-Demand	Anodyne	PDE4A	26	41
COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872281163	GG	On-Demand	Anodyne	PDE4B	15	40
COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](OC3CCC3)CC2)cc1OC	ZINC000872281163	GG	On-Demand	Anodyne	ENPP1	70	33
COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872281180	GG	On-Demand	Anodyne	PDE4A	26	41
COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872281180	GG	On-Demand	Anodyne	PDE4B	15	40
COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](OC3CCC3)CC2)cc1OC	ZINC000872281180	GG	On-Demand	Anodyne	ENPP1	70	33
c1ccc2c(c1)CC[C@@H]2N1CCC[C@H](OC2CCC2)CC1	ZINC000872281197	CI	On-Demand	Anodyne	ACHP_LYMST	30	42
c1ccc2c(c1)CC[C@H]2N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281198	CI	On-Demand	Anodyne	ACHP_LYMST	30	42
c1ccc2c(c1)CC[C@@H]2N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281199	CI	On-Demand	Anodyne	ACHP_LYMST	30	42
c1ccc2c(c1)CC[C@H]2N1CCC[C@H](OC2CCC2)CC1	ZINC000872281201	CI	On-Demand	Anodyne	ACHP_LYMST	30	42
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281212	FG	On-Demand	Anodyne	ADRB2	18	60
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281212	FG	On-Demand	Anodyne	ADRB1	23	52
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281212	FG	On-Demand	Anodyne	HTR1A	20	62
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281212	FG	On-Demand	Anodyne	SLC6A4	23	49
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281212	FG	On-Demand	Anodyne	ABCB1	59	44
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281214	FG	On-Demand	Anodyne	ADRB2	18	60
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281214	FG	On-Demand	Anodyne	ADRB1	23	52
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281214	FG	On-Demand	Anodyne	HTR1A	20	62
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281214	FG	On-Demand	Anodyne	SLC6A4	23	49
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281214	FG	On-Demand	Anodyne	ABCB1	59	44
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281215	FG	On-Demand	Anodyne	ADRB2	18	60
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281215	FG	On-Demand	Anodyne	ADRB1	23	52
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281215	FG	On-Demand	Anodyne	HTR1A	20	62
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281215	FG	On-Demand	Anodyne	SLC6A4	23	49
O[C@@H](COc1cccc2[nH]ccc12)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281215	FG	On-Demand	Anodyne	ABCB1	59	44
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281218	FG	On-Demand	Anodyne	ADRB2	18	60
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281218	FG	On-Demand	Anodyne	ADRB1	23	52
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281218	FG	On-Demand	Anodyne	HTR1A	20	62
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281218	FG	On-Demand	Anodyne	SLC6A4	23	49
O[C@H](COc1cccc2[nH]ccc12)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281218	FG	On-Demand	Anodyne	ABCB1	59	44
CC(=O)c1ccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281250	EG	On-Demand	Anodyne	LTA4H	16	54
CC(=O)c1ccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281251	EG	On-Demand	Anodyne	LTA4H	16	54
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281259	FG	On-Demand	Anodyne	HTR7	34	51
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281259	FG	On-Demand	Anodyne	PREP	47	39
O=C(CCN1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281259	FG	On-Demand	Anodyne	DPP8	16	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281262	FG	On-Demand	Anodyne	HTR7	34	51
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281262	FG	On-Demand	Anodyne	PREP	47	39
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000872281262	FG	On-Demand	Anodyne	DPP8	16	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000872281276	EE	On-Demand	Anodyne	CCR3	18	44
O=C(CCN1CCC[C@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281303	FF	On-Demand	Anodyne	SLC6A1	91	37
O=C(CCN1CCC[C@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281303	FF	On-Demand	Anodyne	SIGMAR1	19	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281303	FF	On-Demand	Anodyne	PRCP	27	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281303	FF	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281305	FF	On-Demand	Anodyne	SLC6A1	91	37
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281305	FF	On-Demand	Anodyne	SIGMAR1	19	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281305	FF	On-Demand	Anodyne	PRCP	27	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281305	FF	On-Demand	Anodyne	CYP2J2	49	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(OCCn3cncn3)c2)C1	ZINC000872281316	ED	On-Demand	Anodyne	EPHX2	23	45
CC(C)(C)CCNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281333	DF	On-Demand	Anodyne	CACNA1I	45	36
CC(C)(C)CCNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281335	DF	On-Demand	Anodyne	CACNA1I	45	36
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281336	EG	On-Demand	Mild	CCR3	23	41
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281336	EG	On-Demand	Mild	MCHR1	40	37
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281338	EG	On-Demand	Mild	CCR3	23	41
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281338	EG	On-Demand	Mild	MCHR1	40	37
O=C(c1ccc(Cl)nc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281339	EH	On-Demand	Anodyne	L3MBTL3	59	37
O=C(c1ccc(Cl)nc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281341	EH	On-Demand	Anodyne	L3MBTL3	59	37
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccnc1	ZINC000872281375	DF	On-Demand	Anodyne	CHRNA7	55	51
O=C(CCN1CCC[C@H](OC2CCC2)CC1)Nc1cccnc1	ZINC000872281375	DF	On-Demand	Anodyne	NAMPT	29	42
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccnc1	ZINC000872281376	DF	On-Demand	Anodyne	CHRNA7	55	51
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)Nc1cccnc1	ZINC000872281376	DF	On-Demand	Anodyne	NAMPT	29	42
c1nc(CCN2CCC[C@H](OC3CCC3)CC2)cs1	ZINC000872281403	CG	On-Demand	Anodyne	SCN5A	45	36
c1nc(CCN2CCC[C@@H](OC3CCC3)CC2)cs1	ZINC000872281405	CG	On-Demand	Anodyne	SCN5A	45	36
CCNc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1[N+](=O)[O-]	ZINC000872281407	FH	On-Demand	Bother	L3MBTL3	66	46
CCNc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1[N+](=O)[O-]	ZINC000872281413	FH	On-Demand	Bother	L3MBTL3	66	46
CC(C)(C)NC(=O)CNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281452	ED	On-Demand	Anodyne	CACNA1I	22	42
CC(C)(C)NC(=O)CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281454	ED	On-Demand	Anodyne	CACNA1I	22	42
N#C[C@@H](C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1nc(O)c2ccccc2n1	ZINC000872281461	GF	On-Demand	Mild	TNKS	49	35
N#C[C@H](C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1nc(O)c2ccccc2n1	ZINC000872281465	GF	On-Demand	Mild	TNKS	49	35
N#C[C@H](C(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1nc(O)c2ccccc2n1	ZINC000872281469	GF	On-Demand	Mild	TNKS	49	35
N#C[C@@H](C(=O)CN1CCC[C@H](OC2CCC2)CC1)c1nc(O)c2ccccc2n1	ZINC000872281472	GF	On-Demand	Mild	TNKS	49	35
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872281474	GH	On-Demand	Bother	L3MBTL3	70	51
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(=O)c2ccc(F)cc2o1	ZINC000872281475	DE	On-Demand	Anodyne	KCNH2	15	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)NC1CCCCC1	ZINC000872281476	FF	On-Demand	Anodyne	EPHX2	17	41
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281477	GH	On-Demand	Bother	L3MBTL3	70	51
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)NC1CCCCC1	ZINC000872281478	FF	On-Demand	Anodyne	EPHX2	17	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1cccnc1Cl	ZINC000872281489	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1cccnc1Cl	ZINC000872281492	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)Nc1ccccc1	ZINC000872281495	EF	On-Demand	Anodyne	LTA4H	25	49
O=C(CN1CCC[C@H](OC2CCC2)CC1)NC(=O)Nc1ccccc1	ZINC000872281495	EF	On-Demand	Anodyne	CCR3	52	42
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)Nc1ccccc1	ZINC000872281498	EF	On-Demand	Anodyne	LTA4H	25	49
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NC(=O)Nc1ccccc1	ZINC000872281498	EF	On-Demand	Anodyne	CCR3	52	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	DRD4	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	SLC6A1	43	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	OPRM1	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	HTR4	39	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	CHRM4	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	SIGMAR1	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	CCR3	33	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	CCR5	41	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872281512	EF	On-Demand	Anodyne	BIRC2	41	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	DRD4	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	SLC6A1	43	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	OPRM1	19	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	HTR4	39	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	CHRM4	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	SIGMAR1	37	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	CCR3	33	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	CCR5	41	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872281514	EF	On-Demand	Anodyne	BIRC2	41	43
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H](O)Cc1ccccc1	ZINC000872281521	CD	On-Demand	Anodyne	MME	42	37
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H](O)Cc1ccccc1	ZINC000872281521	CD	On-Demand	Anodyne	TIMP3	44	33
O=C(CCN1CCc2ccccc2C1)N[C@]12CCC[C@H]1OCC2	ZINC000872281532	DE	On-Demand	Anodyne	NOD2	41	34
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	ESR1	66	38
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	HTR1A	20	43
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	DRD2	17	49
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	SLC6A4	17	46
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	KCNH2	17	43
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	ESR2	47	44
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	LTA4H	58	57
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	HRH3	62	65
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	SIGMAR1	36	43
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	EBP	61	41
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	CHRNA10	70	53
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	PSMB2	41	41
COc1cccc(OCCN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872281575	DG	On-Demand	Anodyne	PSMB1	45	41
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	ESR1	66	38
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	HTR1A	20	43
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	DRD2	17	49
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	SLC6A4	17	46
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	KCNH2	17	43
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	ESR2	47	44
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	LTA4H	58	57
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	HRH3	62	65
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	SIGMAR1	36	43
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	EBP	61	41
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	CHRNA10	70	53
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	PSMB2	41	41
COc1cccc(OCCN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872281577	DG	On-Demand	Anodyne	PSMB1	45	41
c1ccc(-n2cnc(CN3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000872281583	EG	On-Demand	Anodyne	SCN5A	48	32
c1ccc(-n2cnc(CN3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000872281585	EG	On-Demand	Anodyne	SCN5A	48	32
C[C@@H](CNC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)Cn1ccnc1	ZINC000872281586	CC	On-Demand	Anodyne	TBXAS1	21	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000872281592	EG	On-Demand	Anodyne	CCR2	18	46
COc1ccccc1[C@H](C)N(C)C(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281605	FH	On-Demand	Anodyne	BIRC2	33	41
O=C(NCCOc1cccnc1)[C@]12CCC[C@H]1CNC2	ZINC000872281606	CC	On-Demand	Anodyne	CHRNA7	18	40
COc1ccccc1[C@H](C)N(C)C(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281611	FH	On-Demand	Anodyne	BIRC2	33	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	ZINC000872281655	GD	On-Demand	Anodyne	DGAT1	43	55
c1ccc(Cn2cncc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281660	EH	On-Demand	Anodyne	SIGMAR1	34	43
c1ccc(Cn2cncc2CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281660	EH	On-Demand	Anodyne	SCN5A	45	43
c1ccc(Cn2cncc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281661	EH	On-Demand	Anodyne	SIGMAR1	34	43
c1ccc(Cn2cncc2CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281661	EH	On-Demand	Anodyne	SCN5A	45	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2c(F)cccc2N2CCCC2)C1	ZINC000872281667	DE	On-Demand	Anodyne	KCNQ2	57	37
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	DRD2	29	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	DRD4	18	45
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	HTR2A	32	47
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	HTR2C	16	54
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	SLC6A1	78	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	HRH1	17	45
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	SIGMAR1	21	50
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	CCR3	40	38
O=C(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281693	DH	On-Demand	Anodyne	CYP2J2	50	35
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	DRD2	29	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	DRD4	18	45
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	HTR2A	32	47
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	HTR2C	16	54
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	SLC6A1	78	38
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	HRH1	17	45
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	SIGMAR1	21	50
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	CCR3	40	38
O=C(CCN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872281694	DH	On-Demand	Anodyne	CYP2J2	50	35
Fc1ccccc1-n1ccc(CN2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000872281695	EH	On-Demand	Anodyne	SCN5A	85	41
Fc1ccccc1-n1ccc(CN2CCC[C@H](OC3CCC3)CC2)n1	ZINC000872281696	EH	On-Demand	Anodyne	SCN5A	85	41
O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281705	GF	On-Demand	Bother	KCNJ1	26	40
O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281706	GF	On-Demand	Bother	KCNJ1	26	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281719	FF	On-Demand	Bother	ABCB1	71	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281720	FF	On-Demand	Bother	ABCB1	71	46
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281721	FF	On-Demand	Bother	ABCB1	71	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872281722	FF	On-Demand	Bother	ABCB1	71	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN(Cc3cccc(O)c3)CC2)C1	ZINC000872281734	DD	On-Demand	Anodyne	OPRM1	16	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN(Cc3cccc(O)c3)CC2)C1	ZINC000872281734	DD	On-Demand	Anodyne	OPRK1	17	40
CCOc1ccccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281754	FH	On-Demand	Anodyne	HRH1	15	55
CCOc1ccccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281754	FH	On-Demand	Anodyne	HTR4	22	56
CCOc1ccccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281754	FH	On-Demand	Anodyne	CHRM3	25	44
CCOc1ccccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281754	FH	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1NC(=O)CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281754	FH	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281755	FH	On-Demand	Anodyne	HRH1	15	55
CCOc1ccccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281755	FH	On-Demand	Anodyne	HTR4	22	56
CCOc1ccccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281755	FH	On-Demand	Anodyne	CHRM3	25	44
CCOc1ccccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281755	FH	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1NC(=O)CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281755	FH	On-Demand	Anodyne	HCN4	44	35
c1cn(CCCN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872281757	CF	On-Demand	Anodyne	TBXAS1	27	43
c1cn(CCCN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872281757	CF	On-Demand	Anodyne	QPCT	27	43
c1cn(CCCN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872281758	CF	On-Demand	Anodyne	TBXAS1	27	43
c1cn(CCCN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872281758	CF	On-Demand	Anodyne	QPCT	27	43
c1cn(CCN2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872281759	CE	On-Demand	Anodyne	TBXAS1	19	40
c1cn(CCN2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872281760	CE	On-Demand	Anodyne	TBXAS1	19	40
O=c1c2ccccc2ncn1CCN1CCC[C@H](OC2CCC2)CC1	ZINC000872281761	EF	On-Demand	Anodyne	HNMT	74	37
O=c1c2ccccc2ncn1CCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872281762	EF	On-Demand	Anodyne	HNMT	74	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(F)c(F)c1	ZINC000872281790	EG	On-Demand	Anodyne	CCR3	19	45
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(F)c(F)c1	ZINC000872281792	EG	On-Demand	Anodyne	CCR3	19	45
CNC(=O)[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281796	FE	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281796	FE	On-Demand	Anodyne	LGMN	43	32
CNC(=O)[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281796	FE	On-Demand	Anodyne	XIAP	49	42
CNC(=O)[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281796	FE	On-Demand	Anodyne	BIRC2	74	41
CNC(=O)[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281796	FE	On-Demand	Anodyne	BIRC8	53	31
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000872281797	FF	On-Demand	Anodyne	NAMPT	101	47
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281798	FE	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281798	FE	On-Demand	Anodyne	LGMN	43	32
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281798	FE	On-Demand	Anodyne	XIAP	49	42
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281798	FE	On-Demand	Anodyne	BIRC2	74	41
CNC(=O)[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872281798	FE	On-Demand	Anodyne	BIRC8	53	31
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281806	FE	On-Demand	Anodyne	NOS2	107	44
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281806	FE	On-Demand	Anodyne	PDE11A	40	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281806	FE	On-Demand	Anodyne	MCHR1	26	46
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281808	FE	On-Demand	Anodyne	NOS2	107	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281808	FE	On-Demand	Anodyne	PDE11A	40	34
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCc1ccc2c(c1)OCO2	ZINC000872281808	FE	On-Demand	Anodyne	MCHR1	26	46
N#Cc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1F	ZINC000872281810	DH	On-Demand	Mild	SIGMAR1	17	40
N#Cc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1F	ZINC000872281812	DH	On-Demand	Mild	SIGMAR1	17	40
O=[N+]([O-])c1ccc2oc(CN3CCC[C@H](OC4CCC4)CC3)nc2c1	ZINC000872281814	EH	On-Demand	Bother	SSTR5	28	48
O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H](OC4CCC4)CC3)nc2c1	ZINC000872281816	EH	On-Demand	Bother	SSTR5	28	48
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872281836	FI	On-Demand	Anodyne	DRD4	18	50
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872281836	FI	On-Demand	Anodyne	SLC6A1	42	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)C1	ZINC000872281841	EE	On-Demand	Anodyne	KCNK3	81	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872281857	FI	On-Demand	Anodyne	DRD4	18	50
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1c(Cl)cccc1Cl	ZINC000872281857	FI	On-Demand	Anodyne	SLC6A1	42	34
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281869	GF	On-Demand	Anodyne	MTOR	72	37
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281869	GF	On-Demand	Anodyne	EPHX2	18	43
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281869	GF	On-Demand	Anodyne	STAT6	50	31
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281873	GF	On-Demand	Anodyne	MTOR	72	37
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281873	GF	On-Demand	Anodyne	EPHX2	18	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000872281873	GF	On-Demand	Anodyne	STAT6	50	31
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281884	EG	On-Demand	Anodyne	TGM2	70	48
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281884	EG	On-Demand	Anodyne	F13A1	106	48
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872281884	EG	On-Demand	Anodyne	L3MBTL3	91	44
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281886	EG	On-Demand	Anodyne	TGM2	70	48
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281886	EG	On-Demand	Anodyne	F13A1	106	48
C=CC(=O)Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872281886	EG	On-Demand	Anodyne	L3MBTL3	91	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281952	EE	On-Demand	Anodyne	SLC6A1	72	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCC(=O)c1ccccc1	ZINC000872281953	EE	On-Demand	Anodyne	SLC6A1	72	36
O=C(CN1CCC[C@H](OC2CCC2)CC1)NCCc1nc2ccccc2s1	ZINC000872281962	GG	On-Demand	Anodyne	ACOX1	51	35
O=C(CN1CCC[C@@H](OC2CCC2)CC1)NCCc1nc2ccccc2s1	ZINC000872281963	GG	On-Demand	Anodyne	ACOX1	51	35
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cn1	ZINC000872281976	EG	On-Demand	Anodyne	F10	47	31
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cn1	ZINC000872281977	EG	On-Demand	Anodyne	F10	47	31
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](OC2CCC2)CC1	ZINC000872281983	FG	On-Demand	Bother	COLA	73	37
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](OC2CCC2)CC1	ZINC000872281986	FG	On-Demand	Bother	COLA	73	37
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282016	FE	On-Demand	Reactive	KCNK3	53	37
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282016	FE	On-Demand	Reactive	KCNK9	43	37
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282017	FE	On-Demand	Reactive	KCNK3	53	37
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282017	FE	On-Demand	Reactive	KCNK9	43	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000872282020	DF	On-Demand	Clean	F2	21	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000872282020	DF	On-Demand	Clean	CTSK	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000872282020	DF	On-Demand	Clean	TMPRSS11D	50	34
COc1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282043	FH	On-Demand	Anodyne	CYP19A1	15	52
COc1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282043	FH	On-Demand	Anodyne	CYP11B1	17	43
COc1ccc2c(CN3CCC[C@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282043	FH	On-Demand	Anodyne	MAOB	28	44
COc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872282044	CG	On-Demand	Anodyne	SSTR5	71	38
COc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872282045	CG	On-Demand	Anodyne	SSTR5	71	38
COc1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282046	FH	On-Demand	Anodyne	CYP19A1	15	52
COc1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282046	FH	On-Demand	Anodyne	CYP11B1	17	43
COc1ccc2c(CN3CCC[C@@H](OC4CCC4)CC3)cc(=O)oc2c1	ZINC000872282046	FH	On-Demand	Anodyne	MAOB	28	44
N#Cc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282054	EF	On-Demand	Mild	DRD4	15	50
N#Cc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282054	EF	On-Demand	Mild	CCR3	34	47
N#Cc1cccc(NC(=O)CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282054	EF	On-Demand	Mild	MCHR1	56	45
N#Cc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282057	EF	On-Demand	Mild	DRD4	15	50
N#Cc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282057	EF	On-Demand	Mild	CCR3	34	47
N#Cc1cccc(NC(=O)CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282057	EF	On-Demand	Mild	MCHR1	56	45
O=C(N[C@]12CCC[C@H]1OCC2)C1CCN(c2noc3ccc(Cl)cc23)CC1	ZINC000872282064	GH	On-Demand	Anodyne	PTGES	18	41
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	SLC6A1	47	43
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	SLC6A3	21	40
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	LTA4H	50	48
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	HRH3	32	48
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	SIGMAR1	48	45
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	GBA	16	40
c1ccc(COCCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282116	DH	On-Demand	Anodyne	GBA2	39	40
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	SLC6A1	47	43
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	SLC6A3	21	40
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	LTA4H	50	48
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	HRH3	32	48
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	SIGMAR1	48	45
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	GBA	16	40
c1ccc(COCCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282117	DH	On-Demand	Anodyne	GBA2	39	40
Cn1c(=O)c(CN2CCC[C@H](OC3CCC3)CC2)cc2ccccc21	ZINC000872282118	EG	On-Demand	Anodyne	NPSR1	35	46
Cn1c(=O)c(CN2CCC[C@@H](OC3CCC3)CC2)cc2ccccc21	ZINC000872282119	EG	On-Demand	Anodyne	NPSR1	35	46
c1ccc(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cn2)nc1	ZINC000872282125	EI	On-Demand	Anodyne	HRH3	20	41
c1ccc(-c2ccc(CN3CCC[C@H](OC4CCC4)CC3)cn2)nc1	ZINC000872282125	EI	On-Demand	Anodyne	SCN5A	47	32
c1ccc(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)nc1	ZINC000872282126	EI	On-Demand	Anodyne	HRH3	20	41
c1ccc(-c2ccc(CN3CCC[C@@H](OC4CCC4)CC3)cn2)nc1	ZINC000872282126	EI	On-Demand	Anodyne	SCN5A	47	32
CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872282134	CD	On-Demand	Anodyne	DRD2	32	42
CCN1CCCC[C@H]1CNC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872282135	CD	On-Demand	Anodyne	DRD2	32	42
O=C1CCc2cc(OC[C@@H](O)CN3CCC[C@H](OC4CCC4)CC3)ccc2N1	ZINC000872282138	GF	On-Demand	Anodyne	ACOX1	70	36
O=C1CCc2cc(OC[C@@H](O)CN3CCC[C@H](OC4CCC4)CC3)ccc2N1	ZINC000872282138	GF	On-Demand	Anodyne	ABCB1	40	36
O=C1CCc2cc(OC[C@H](O)CN3CCC[C@@H](OC4CCC4)CC3)ccc2N1	ZINC000872282139	GF	On-Demand	Anodyne	ACOX1	70	36
O=C1CCc2cc(OC[C@H](O)CN3CCC[C@@H](OC4CCC4)CC3)ccc2N1	ZINC000872282139	GF	On-Demand	Anodyne	ABCB1	40	36
O=C1CCc2cc(OC[C@H](O)CN3CCC[C@H](OC4CCC4)CC3)ccc2N1	ZINC000872282140	GF	On-Demand	Anodyne	ACOX1	70	36
O=C1CCc2cc(OC[C@H](O)CN3CCC[C@H](OC4CCC4)CC3)ccc2N1	ZINC000872282140	GF	On-Demand	Anodyne	ABCB1	40	36
O=C1CCc2cc(OC[C@@H](O)CN3CCC[C@@H](OC4CCC4)CC3)ccc2N1	ZINC000872282141	GF	On-Demand	Anodyne	ACOX1	70	36
O=C1CCc2cc(OC[C@@H](O)CN3CCC[C@@H](OC4CCC4)CC3)ccc2N1	ZINC000872282141	GF	On-Demand	Anodyne	ABCB1	40	36
N#Cc1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282163	CH	On-Demand	Mild	HRH3	33	50
N#Cc1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282163	CH	On-Demand	Mild	SIGMAR1	21	43
N#Cc1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282163	CH	On-Demand	Mild	KCNJ1	48	62
N#Cc1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282163	CH	On-Demand	Mild	MEN1	40	39
N#Cc1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282164	CH	On-Demand	Mild	HRH3	33	50
N#Cc1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282164	CH	On-Demand	Mild	SIGMAR1	21	43
N#Cc1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282164	CH	On-Demand	Mild	KCNJ1	48	62
N#Cc1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282164	CH	On-Demand	Mild	MEN1	40	39
COC(=O)c1ccc2nc(CN3CCC[C@H](OC4CCC4)CC3)[nH]c2c1	ZINC000872282177	FG	On-Demand	Anodyne	GRIN2B	18	45
COC(=O)c1ccc2nc(CN3CCC[C@@H](OC4CCC4)CC3)[nH]c2c1	ZINC000872282178	FG	On-Demand	Anodyne	GRIN2B	18	45
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872282183	GD	On-Demand	Anodyne	CCR8	44	34
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872282183	GD	On-Demand	Anodyne	SFRP1	105	36
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872282183	GD	On-Demand	Anodyne	WNT3	75	36
O=S(=O)(NC1CC1)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282191	GG	On-Demand	Anodyne	HRH3	19	46
O=S(=O)(NC1CC1)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282192	GG	On-Demand	Anodyne	HRH3	19	46
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA2	32	45
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA1	23	42
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA7	16	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA5B	34	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA4	27	42
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	CA5A	39	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282210	JI	On-Demand	Anodyne	NCE103	40	37
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA2	32	45
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA1	23	42
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA7	16	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA5B	34	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA4	27	42
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	CA5A	39	40
NS(=O)(=O)c1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282211	JI	On-Demand	Anodyne	NCE103	40	37
c1cc2nonc2cc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872282212	DG	On-Demand	Anodyne	SSTR5	60	40
c1cc2nonc2cc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282213	DG	On-Demand	Anodyne	SSTR5	60	40
NC(=O)[C@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282253	ED	On-Demand	Anodyne	CHRM2	29	44
NC(=O)[C@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282253	ED	On-Demand	Anodyne	SLC6A1	44	33
NC(=O)[C@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282253	ED	On-Demand	Anodyne	CHRM3	55	44
NC(=O)[C@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282253	ED	On-Demand	Anodyne	AMY2	43	30
NC(=O)[C@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282253	ED	On-Demand	Anodyne	CYP2J2	46	33
NC(=O)[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282254	ED	On-Demand	Anodyne	CHRM2	29	44
NC(=O)[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282254	ED	On-Demand	Anodyne	SLC6A1	44	33
NC(=O)[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282254	ED	On-Demand	Anodyne	CHRM3	55	44
NC(=O)[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282254	ED	On-Demand	Anodyne	AMY2	43	30
NC(=O)[C@@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282254	ED	On-Demand	Anodyne	CYP2J2	46	33
NC(=O)[C@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282255	ED	On-Demand	Anodyne	CHRM2	29	44
NC(=O)[C@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282255	ED	On-Demand	Anodyne	SLC6A1	44	33
NC(=O)[C@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282255	ED	On-Demand	Anodyne	CHRM3	55	44
NC(=O)[C@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282255	ED	On-Demand	Anodyne	AMY2	43	30
NC(=O)[C@](O)(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282255	ED	On-Demand	Anodyne	CYP2J2	46	33
NC(=O)[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282256	ED	On-Demand	Anodyne	CHRM2	29	44
NC(=O)[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282256	ED	On-Demand	Anodyne	SLC6A1	44	33
NC(=O)[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282256	ED	On-Demand	Anodyne	CHRM3	55	44
NC(=O)[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282256	ED	On-Demand	Anodyne	AMY2	43	30
NC(=O)[C@@](O)(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282256	ED	On-Demand	Anodyne	CYP2J2	46	33
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA2	41	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA1	32	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA7	16	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA5B	35	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA4	38	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	CA5A	40	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282301	JI	On-Demand	Anodyne	NCE103	42	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA2	41	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA1	32	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA7	16	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA5B	35	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA4	38	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	CA5A	40	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282302	JI	On-Demand	Anodyne	NCE103	42	39
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282312	IH	On-Demand	Anodyne	CA2	33	44
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282312	IH	On-Demand	Anodyne	CA1	23	41
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282312	IH	On-Demand	Anodyne	CA4	29	42
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282312	IH	On-Demand	Anodyne	NCE103	46	38
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282313	IH	On-Demand	Anodyne	CA2	33	44
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282313	IH	On-Demand	Anodyne	CA1	23	41
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282313	IH	On-Demand	Anodyne	CA4	29	42
NS(=O)(=O)c1ccc(F)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1	ZINC000872282313	IH	On-Demand	Anodyne	NCE103	46	38
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	DRD2	24	44
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	DRD4	39	41
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	ACHE	37	43
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	CHRM3	29	44
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	SSTR5	51	39
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	CCR3	53	48
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	CXCR3	17	42
CC(=O)c1cccc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282337	DH	On-Demand	Anodyne	MCHR1	33	40
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	DRD2	24	44
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	DRD4	39	41
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	ACHE	37	43
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	CHRM3	29	44
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	SSTR5	51	39
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	CCR3	53	48
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	CXCR3	17	42
CC(=O)c1cccc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282338	DH	On-Demand	Anodyne	MCHR1	33	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000872282342	GG	On-Demand	Anodyne	ITK	33	50
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000872282342	GG	On-Demand	Anodyne	HMOX2	44	35
c1ccc2c(c1)C[C@@H]2CN1CCC[C@H](OC2CCC2)CC1	ZINC000872282384	CH	On-Demand	Anodyne	ACHP_LYMST	16	43
c1ccc2c(c1)C[C@H]2CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282385	CH	On-Demand	Anodyne	ACHP_LYMST	16	43
c1ccc2c(c1)C[C@@H]2CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282386	CH	On-Demand	Anodyne	ACHP_LYMST	16	43
c1ccc2c(c1)C[C@H]2CN1CCC[C@H](OC2CCC2)CC1	ZINC000872282387	CH	On-Demand	Anodyne	ACHP_LYMST	16	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(F)ccc2N2CCCCC2)C1	ZINC000872282395	DF	On-Demand	Anodyne	KCNQ2	50	41
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HTR1A	37	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	CHRM1	16	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	DRD2	37	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	DRD4	25	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	ACHE	17	48
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HTR2A	33	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HTR2C	18	56
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	SLC6A1	160	45
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HRH1	23	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	DRD3	24	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	CHRM4	17	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	CHRM3	17	54
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HTR7	51	49
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	HRH3	30	41
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	SIGMAR1	47	56
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	PREP	25	45
O=C(CCCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282410	DI	On-Demand	Anodyne	CYP2J2	70	50
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HTR1A	37	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	CHRM1	16	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	DRD2	37	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	DRD4	25	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	ACHE	17	48
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HTR2A	33	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HTR2C	18	56
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	SLC6A1	160	45
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HRH1	23	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	DRD3	24	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	CHRM4	17	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	CHRM3	17	54
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HTR7	51	49
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	HRH3	30	41
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	SIGMAR1	47	56
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	PREP	25	45
O=C(CCCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282411	DI	On-Demand	Anodyne	CYP2J2	70	50
O=C1c2ccccc2C(=O)N1OCCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872282427	FG	On-Demand	Anodyne	HTR1A	17	41
O=C1c2ccccc2C(=O)N1OCCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872282427	FG	On-Demand	Anodyne	HRH3	44	38
O=C1c2ccccc2C(=O)N1OCCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282428	FG	On-Demand	Anodyne	HTR1A	17	41
O=C1c2ccccc2C(=O)N1OCCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282428	FG	On-Demand	Anodyne	HRH3	44	38
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1CN1CCOCC1	ZINC000872282429	FG	On-Demand	Anodyne	HRH3	28	55
c1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1CN1CCOCC1	ZINC000872282429	FG	On-Demand	Anodyne	SIGMAR1	32	42
c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1CN1CCOCC1	ZINC000872282430	FG	On-Demand	Anodyne	HRH3	28	55
c1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1CN1CCOCC1	ZINC000872282430	FG	On-Demand	Anodyne	SIGMAR1	32	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872282466	CE	On-Demand	Anodyne	TIMP3	70	36
Fc1cccc(CN2CCC[C@H](OC3CCC3)CC2)n1	ZINC000872282482	CG	On-Demand	Anodyne	SCN5A	77	37
Fc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000872282483	CG	On-Demand	Anodyne	SCN5A	77	37
O[C@@H](Cc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872282511	DG	On-Demand	Anodyne	SLC6A3	18	50
O[C@H](Cc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282512	DG	On-Demand	Anodyne	SLC6A3	18	50
O[C@H](Cc1ccc(F)cc1)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872282513	DG	On-Demand	Anodyne	SLC6A3	18	50
O[C@@H](Cc1ccc(F)cc1)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872282514	DG	On-Demand	Anodyne	SLC6A3	18	50
COCCc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282547	GG	On-Demand	Anodyne	ADRB2	18	50
COCCc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282547	GG	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282547	GG	On-Demand	Anodyne	ABCB1	56	45
COCCc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282548	GG	On-Demand	Anodyne	ADRB2	18	50
COCCc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282548	GG	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282548	GG	On-Demand	Anodyne	ABCB1	56	45
COCCc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282549	GG	On-Demand	Anodyne	ADRB2	18	50
COCCc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282549	GG	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@@H](O)CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282549	GG	On-Demand	Anodyne	ABCB1	56	45
COCCc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282550	GG	On-Demand	Anodyne	ADRB2	18	50
COCCc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282550	GG	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@@H](O)CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282550	GG	On-Demand	Anodyne	ABCB1	56	45
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	SLC6A1	70	41
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	SLC6A4	16	56
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	SLC6A3	39	56
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	GRIN2B	19	42
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	SIGMAR1	20	44
O[C@@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282558	DH	On-Demand	Anodyne	CCR5	41	42
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	SLC6A1	70	41
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	SLC6A4	16	56
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	SLC6A3	39	56
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	GRIN2B	19	42
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	SIGMAR1	20	44
O[C@@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282559	DH	On-Demand	Anodyne	CCR5	41	42
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	SLC6A1	70	41
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	SLC6A4	16	56
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	SLC6A3	39	56
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	GRIN2B	19	42
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	SIGMAR1	20	44
O[C@H](CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282560	DH	On-Demand	Anodyne	CCR5	41	42
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	SLC6A1	70	41
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	SLC6A4	16	56
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	SLC6A3	39	56
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	GRIN2B	19	42
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	SIGMAR1	20	44
O[C@H](CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872282561	DH	On-Demand	Anodyne	CCR5	41	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1nc(-c2ccncc2)cs1	ZINC000872282583	EF	On-Demand	Anodyne	ROCK1	20	41
Brc1cccc(CN2CCC[C@H](OC3CCC3)CC2)n1	ZINC000872282630	EH	On-Demand	Anodyne	SCN5A	71	39
Brc1cccc(CN2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000872282631	EH	On-Demand	Anodyne	SCN5A	71	39
COc1cccc(OCCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872282638	DE	On-Demand	Anodyne	MTNR1A	30	41
COc1cccc(OCCC(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872282638	DE	On-Demand	Anodyne	MTNR1B	30	41
COc1ccc(N2CCC(NC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872282772	EF	On-Demand	Clean	EPHX2	24	47
CNS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282789	FF	On-Demand	Anodyne	HRH3	25	43
CNS(=O)(=O)c1ccc(CN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872282789	FF	On-Demand	Anodyne	SSTR5	47	36
CNS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282790	FF	On-Demand	Anodyne	HRH3	25	43
CNS(=O)(=O)c1ccc(CN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872282790	FF	On-Demand	Anodyne	SSTR5	47	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000872282802	FE	On-Demand	Anodyne	SIGMAR1	24	51
Brc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872282827	EH	On-Demand	Anodyne	SSTR5	42	34
Brc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872282828	EH	On-Demand	Anodyne	SSTR5	42	34
O[C@@H]1CCC[C@H]1N1CCC[C@@H](OC2CCC2)CC1	ZINC000872282844	CE	On-Demand	Anodyne	SLC18A3	48	55
O[C@@H]1CCC[C@H]1N1CCC[C@H](OC2CCC2)CC1	ZINC000872282845	CE	On-Demand	Anodyne	SLC18A3	48	55
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2nc(-c3ccncc3)cs2)C1	ZINC000872282870	DD	On-Demand	Anodyne	ROCK1	21	41
O=C(Nc1ccc(N2CCOCC2)c(F)c1)[C@]12CCC[C@H]1CNC2	ZINC000872282878	ED	On-Demand	Anodyne	NPY2R	72	38
c1cc(CN2CCOCC2)cc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282917	FG	On-Demand	Anodyne	ACHE	16	41
c1cc(CN2CCOCC2)cc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282917	FG	On-Demand	Anodyne	HRH3	19	46
c1cc(CN2CCOCC2)cc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282917	FG	On-Demand	Anodyne	SIGMAR1	33	41
c1cc(CN2CCOCC2)cc(CN2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872282917	FG	On-Demand	Anodyne	SCN5A	67	36
c1cc(CN2CCOCC2)cc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282918	FG	On-Demand	Anodyne	ACHE	16	41
c1cc(CN2CCOCC2)cc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282918	FG	On-Demand	Anodyne	HRH3	19	46
c1cc(CN2CCOCC2)cc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282918	FG	On-Demand	Anodyne	SIGMAR1	33	41
c1cc(CN2CCOCC2)cc(CN2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872282918	FG	On-Demand	Anodyne	SCN5A	67	36
O=C(C[C@@]1(O)CCCN(Cc2ccccc2)C1)N[C@]12CCC[C@H]1OCC2	ZINC000872283023	FE	On-Demand	Anodyne	NPFFR1	41	42
O=C(C[C@]1(O)CCCN(Cc2ccccc2)C1)N[C@]12CCC[C@H]1OCC2	ZINC000872283024	FE	On-Demand	Anodyne	NPFFR1	41	42
c1ccc2c(-c3nnc(CN4CCC[C@H](OC5CCC5)CC4)o3)cccc2c1	ZINC000872283062	GJ	On-Demand	Anodyne	ALOX15	47	37
c1ccc2c(-c3nnc(CN4CCC[C@@H](OC5CCC5)CC4)o3)cccc2c1	ZINC000872283063	GJ	On-Demand	Anodyne	ALOX15	47	37
CN(C)CCOc1ccc(N(C)C(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872283064	EE	On-Demand	Anodyne	AMY2	50	38
CN(C)CCOc1ccc(N(C)C(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872283064	EE	On-Demand	Anodyne	ESRRG	47	35
CC(C)(C)CNC(=O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872283074	CF	On-Demand	Anodyne	CACNA1I	42	35
CC(C)(C)CNC(=O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872283075	CF	On-Demand	Anodyne	CACNA1I	42	35
N#Cc1ccccc1OC[C@@H](O)CN1CCNC(=O)CC12CCOCC2	ZINC000872283089	FC	On-Demand	Mild	ADRB1	47	39
N#Cc1ccccc1OC[C@H](O)CN1CCNC(=O)CC12CCOCC2	ZINC000872283090	FC	On-Demand	Mild	ADRB1	47	39
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2ccncc2)cc1	ZINC000872283094	EH	On-Demand	Anodyne	LTA4H	17	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2ccncc2)cc1	ZINC000872283094	EH	On-Demand	Anodyne	ADAM17	23	73
C[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283131	EG	On-Demand	Anodyne	SLC6A1	43	37
C[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283131	EG	On-Demand	Anodyne	PRCP	22	52
C[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283131	EG	On-Demand	Anodyne	XIAP	48	38
C[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283131	EG	On-Demand	Anodyne	BIRC2	62	42
C[C@@H](NC(=O)CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283131	EG	On-Demand	Anodyne	BIRC8	55	32
C[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283132	EG	On-Demand	Anodyne	SLC6A1	43	37
C[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283132	EG	On-Demand	Anodyne	PRCP	22	52
C[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283132	EG	On-Demand	Anodyne	XIAP	48	38
C[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283132	EG	On-Demand	Anodyne	BIRC2	62	42
C[C@@H](NC(=O)CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872283132	EG	On-Demand	Anodyne	BIRC8	55	32
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872283162	DC	On-Demand	Anodyne	SLC18A3	35	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872283178	DC	On-Demand	Anodyne	SLC18A3	35	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872283180	DC	On-Demand	Anodyne	SLC18A3	35	45
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872283181	DC	On-Demand	Anodyne	SLC18A3	35	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000872283197	EH	On-Demand	Anodyne	LTA4H	24	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000872283197	EH	On-Demand	Anodyne	CHRNA7	45	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000872283197	EH	On-Demand	Anodyne	ADAM17	25	58
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000872283197	EH	On-Demand	Anodyne	VCP	47	36
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000872283197	EH	On-Demand	Anodyne	NAMPT	57	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2ccc(F)cc12	ZINC000872283221	EH	On-Demand	Anodyne	HTR1A	18	40
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1c[nH]c2ccc(F)cc12	ZINC000872283221	EH	On-Demand	Anodyne	MPO	82	44
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2ccc(F)cc12	ZINC000872283222	EH	On-Demand	Anodyne	HTR1A	18	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1c[nH]c2ccc(F)cc12	ZINC000872283222	EH	On-Demand	Anodyne	MPO	82	44
CC(C)(C)OC(=O)N1CCC(CN2CCNC(=O)CC23CCOCC3)CC1	ZINC000872283237	GE	On-Demand	Anodyne	GPR119	30	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000872283254	EH	On-Demand	Anodyne	RAF1	16	47
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000872283254	EH	On-Demand	Anodyne	F13A1	29	46
O=C1CC2(CCOCC2)N(CCC(=O)OCc2ccccc2)CCN1	ZINC000872283262	ED	On-Demand	Anodyne	SLC12A5	61	33
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)C1	ZINC000872283279	FI	On-Demand	Anodyne	PDGFRB	33	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)C1	ZINC000872283279	FI	On-Demand	Anodyne	KDR	70	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)C1	ZINC000872283279	FI	On-Demand	Anodyne	PDGFRA	58	43
Brc1cccnc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872283305	EH	On-Demand	Anodyne	SCN5A	32	40
Brc1cccnc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872283306	EH	On-Demand	Anodyne	SCN5A	32	40
CN(C)CCOc1ccc(CCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872283364	EE	On-Demand	Anodyne	ESRRG	43	32
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872283428	ED	On-Demand	Anodyne	SLC6A3	19	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872283429	ED	On-Demand	Anodyne	SLC6A3	19	46
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872283474	EE	On-Demand	Anodyne	SIGMAR1	52	39
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872283476	EE	On-Demand	Anodyne	SIGMAR1	52	39
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872283477	EE	On-Demand	Anodyne	SIGMAR1	52	39
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	ZINC000872283544	GG	On-Demand	Anodyne	CYP11B2	22	44
Cn1c(=O)c(CN2CCNC(=O)CC23CCOCC3)cc2ccccc21	ZINC000872283611	FD	On-Demand	Anodyne	NPSR1	30	42
COC(=O)[C@@H](c1cccc(OC)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872283618	EG	On-Demand	Anodyne	KCNQ2	27	45
COC(=O)[C@@H](c1cccc(OC)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872283621	EG	On-Demand	Anodyne	KCNQ2	27	45
NC(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872283626	DF	On-Demand	Anodyne	HRH3	26	40
NC(=O)c1ccc(CCN2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872283626	DF	On-Demand	Anodyne	SIGMAR1	18	45
NC(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872283628	DF	On-Demand	Anodyne	HRH3	26	40
NC(=O)c1ccc(CCN2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872283628	DF	On-Demand	Anodyne	SIGMAR1	18	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(CCN2CCOCC2)c1	ZINC000872283638	ED	On-Demand	Anodyne	EPHX2	17	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(CCN2CCOCC2)c1	ZINC000872283638	ED	On-Demand	Anodyne	TBK1	27	46
FC(F)Cn1ccnc1CN1CCC[C@H](OC2CCC2)CC1	ZINC000872283716	DG	On-Demand	Anodyne	SCN5A	43	33
FC(F)Cn1ccnc1CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872283718	DG	On-Demand	Anodyne	SCN5A	43	33
COc1ccnc(N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)c1	ZINC000872283720	ED	On-Demand	Anodyne	NPBWR1	80	35
Fc1ccccc1-c1nc(CN2CCC[C@H](OC3CCC3)CC2)co1	ZINC000872283779	EI	On-Demand	Anodyne	SCN5A	68	36
Fc1ccccc1-c1nc(CN2CCC[C@@H](OC3CCC3)CC2)co1	ZINC000872283781	EI	On-Demand	Anodyne	SCN5A	68	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2nc3ccccc3o2)CC1	ZINC000872283859	EE	On-Demand	Anodyne	NPBWR1	54	44
CN(C)CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872283865	EF	On-Demand	Anodyne	S1PR4	15	41
CN(C)CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872283865	EF	On-Demand	Anodyne	AMY2	41	40
CC(C)(C)OC(=O)N1CC[C@H](CN2CCNC(=O)CC23CCOCC3)C1	ZINC000872283945	FD	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CC[C@@H](CN2CCNC(=O)CC23CCOCC3)C1	ZINC000872283946	FD	On-Demand	Anodyne	GPR119	22	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cn3)c(F)c2)C1	ZINC000872283947	GI	On-Demand	Anodyne	MET	38	42
O=C(N[C@]12CCC[C@H]1OCC2)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872283955	ED	On-Demand	Anodyne	L3MBTL3	61	36
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872283956	ED	On-Demand	Anodyne	L3MBTL3	61	36
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1C[C@H]1c1ccsc1	ZINC000872283972	CF	On-Demand	Anodyne	NPBWR1	56	33
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000872284014	DF	On-Demand	Anodyne	EPHX2	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000872284016	DF	On-Demand	Anodyne	EPHX2	18	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(Oc3ccncc3)c2)C1	ZINC000872284019	DF	On-Demand	Anodyne	EPHX2	20	46
CN(C)CCCOc1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872284029	DE	On-Demand	Anodyne	EPHX2	29	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000872284101	EH	On-Demand	Anodyne	CFTR	23	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000872284101	EH	On-Demand	Anodyne	F13A1	21	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000872284101	EH	On-Demand	Anodyne	LIMK2	17	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)c1ccccc1F	ZINC000872284129	DG	On-Demand	Anodyne	SLC6A1	109	43
O=C(CN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1F	ZINC000872284131	DG	On-Demand	Anodyne	SLC6A1	109	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)C1	ZINC000872284137	CC	On-Demand	Anodyne	SLC18A3	33	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)C1	ZINC000872284138	CC	On-Demand	Anodyne	SLC18A3	33	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)C1	ZINC000872284139	CC	On-Demand	Anodyne	SLC18A3	33	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)C1	ZINC000872284140	CC	On-Demand	Anodyne	SLC18A3	33	40
O=C1CC2(CCOCC2)N(CC(=O)c2c[nH]c3ccc(F)cc23)CCN1	ZINC000872284154	FD	On-Demand	Anodyne	MPO	56	33
O=C(Nc1ccc(OCc2cccnc2)cc1)[C@]12CCC[C@H]1CNC2	ZINC000872284170	EF	On-Demand	Anodyne	CHRNA7	33	41
O=C(Nc1ccc(OCc2cccnc2)cc1)[C@]12CCC[C@H]1CNC2	ZINC000872284170	EF	On-Demand	Anodyne	NAMPT	37	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)nc1	ZINC000872284178	DE	On-Demand	Anodyne	TYK2	46	34
O=C(Cc1cc2cc(Cl)ccc2[nH]1)N[C@]12CCC[C@H]1OCC2	ZINC000872284180	DG	On-Demand	Anodyne	PYGL	64	37
CO[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872284189	DH	On-Demand	Anodyne	SLC6A3	31	40
CO[C@@H](CN1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872284189	DH	On-Demand	Anodyne	LEF	20	42
CO[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872284190	DH	On-Demand	Anodyne	SLC6A3	31	40
CO[C@@H](CN1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872284190	DH	On-Demand	Anodyne	LEF	20	42
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2c(Br)cncc2s1	ZINC000872284228	FH	On-Demand	Anodyne	SELE	53	37
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2c(Br)cncc2s1	ZINC000872284228	FH	On-Demand	Anodyne	ICAM1	51	37
O=C(N[C@]12CCC[C@H]1OCC2)c1cc2c(Br)cncc2s1	ZINC000872284228	FH	On-Demand	Anodyne	VCAM1	40	33
C=CC(=O)Nc1ccc(C(=O)NC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872284250	EC	On-Demand	Anodyne	TGM2	64	35
C=CC(=O)Nc1ccc(C(=O)NC[C@@]23COCCN2C(=O)OC3)cc1	ZINC000872284250	EC	On-Demand	Anodyne	F13A1	82	35
C=CC(=O)Nc1ccc(C(=O)NC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872284251	EC	On-Demand	Anodyne	TGM2	64	35
C=CC(=O)Nc1ccc(C(=O)NC[C@]23COCCN2C(=O)OC3)cc1	ZINC000872284251	EC	On-Demand	Anodyne	F13A1	82	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000872284256	EH	On-Demand	Anodyne	LTA4H	20	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000872284256	EH	On-Demand	Anodyne	CFTR	25	41
Cn1nc(C(=O)N[C@]23CCC[C@H]2OCC3)c2ccccc21	ZINC000872284268	CE	On-Demand	Anodyne	HTR4	28	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(Oc3ccccn3)cc2)C1	ZINC000872284282	DF	On-Demand	Anodyne	LTA4H	23	41
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	HTR1A	52	47
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	DRD2	30	46
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	DRD4	26	41
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	ADRA1D	16	43
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	HTR2A	31	46
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	ADRA1B	15	43
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	DRD3	25	41
O=C1CC2(CCOCC2)N(CCCN2CCN(c3ccccc3)CC2)CCN1	ZINC000872284303	GD	On-Demand	Anodyne	HTR7	55	44
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872284386	FD	On-Demand	Anodyne	DRD4	27	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872284386	FD	On-Demand	Anodyne	P2RX3	28	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	ADRB2	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	ADRB3	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	ACOX1	52	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	CPT1A	50	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	CPT2	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872284393	GD	On-Demand	Anodyne	ABCB1	80	48
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(Cl)c(F)c2)CCN1	ZINC000872284454	FD	On-Demand	Anodyne	ENV	45	39
O=C1CC2(CCOCC2)N(CCC(=O)c2ccc(F)cc2)CCN1	ZINC000872284457	ED	On-Demand	Anodyne	DRD2	27	43
O=C1CC2(CCOCC2)N(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CCN1	ZINC000872284483	GE	On-Demand	Anodyne	LUCI_PHOPY	49	42
O=C1CC2(CCOCC2)N(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CCN1	ZINC000872284485	GE	On-Demand	Anodyne	LUCI_PHOPY	49	42
CN1CCC(N2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)CC1	ZINC000872284494	DD	On-Demand	Anodyne	SLC6A5	17	41
O[C@@]1(CN2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)C1	ZINC000872284536	FG	On-Demand	Anodyne	SIGMAR1	60	42
O[C@@]1(CN2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)C1	ZINC000872284538	FG	On-Demand	Anodyne	SIGMAR1	60	42
O[C@]1(CN2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)C1	ZINC000872284539	FG	On-Demand	Anodyne	SIGMAR1	60	42
O[C@]1(CN2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)C1	ZINC000872284540	FG	On-Demand	Anodyne	SIGMAR1	60	42
CN(C)CCOc1ccc(N(C)C(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1	ZINC000872284580	DD	On-Demand	Anodyne	ESRRG	45	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	ADRB2	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	ADRB3	17	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	ACOX1	52	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	CPT1A	50	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	CPT2	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872284618	GD	On-Demand	Anodyne	ABCB1	80	48
O=C1CC2(CCOCC2)N(Cc2ccc(CN3CCCCC3)cc2)CCN1	ZINC000872284643	FF	On-Demand	Anodyne	HRH3	15	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	F2	31	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	OPRK1	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	SLC6A3	23	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	HTR4	45	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	GRIN2B	15	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872284729	FE	On-Demand	Anodyne	CACNA1I	46	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	F2	31	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	OPRK1	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	SLC6A3	23	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	HTR4	45	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	GRIN2B	15	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872284730	FE	On-Demand	Anodyne	CACNA1I	46	35
O=C1CC2(CCOCC2)N(Cc2nc3ccccc3s2)CCN1	ZINC000872284731	EE	On-Demand	Anodyne	AKR1B1	16	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872284781	GD	On-Demand	Anodyne	HTR1A	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872284781	GD	On-Demand	Anodyne	DRD2	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872284781	GD	On-Demand	Anodyne	DRD4	40	31
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872284781	GD	On-Demand	Anodyne	PLD1	62	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872284781	GD	On-Demand	Anodyne	PLD2	78	36
COC(=O)CCCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872284839	CF	On-Demand	Anodyne	HTR4	19	41
COC(=O)CCCCN1CCC[C@H](OC2CCC2)CC1	ZINC000872284839	CF	On-Demand	Anodyne	PAOX	18	40
Cc1ccc(NCCCNC(=O)[C@@H]2CCCCC[C@@H]2N)nc1	ZINC000872284840	DE	On-Demand	Anodyne	TBK1	66	38
COC(=O)CCCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872284841	CF	On-Demand	Anodyne	HTR4	19	41
COC(=O)CCCCN1CCC[C@@H](OC2CCC2)CC1	ZINC000872284841	CF	On-Demand	Anodyne	PAOX	18	40
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1C[C@H]1c1cccnc1	ZINC000872284896	CE	On-Demand	Anodyne	NAMPT	24	44
O=C(N[C@]12CCC[C@H]1OCC2)c1cc(=O)c2cc(Br)ccc2o1	ZINC000872284912	GF	On-Demand	Anodyne	GPR35	46	32
CN(C)CCCOc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872284916	EF	On-Demand	Anodyne	AMY2	40	39
CC(=O)[C@](C#N)(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284955	FH	On-Demand	Mild	SLC6A1	40	34
CC(=O)[C@](C#N)(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284955	FH	On-Demand	Mild	CYP2J2	48	33
CC(=O)[C@](C#N)(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284962	FH	On-Demand	Mild	SLC6A1	40	34
CC(=O)[C@](C#N)(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284962	FH	On-Demand	Mild	CYP2J2	48	33
CC(=O)[C@@](C#N)(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284964	FH	On-Demand	Mild	SLC6A1	40	34
CC(=O)[C@@](C#N)(CCN1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284964	FH	On-Demand	Mild	CYP2J2	48	33
CC(=O)[C@@](C#N)(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284966	FH	On-Demand	Mild	SLC6A1	40	34
CC(=O)[C@@](C#N)(CCN1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872284966	FH	On-Demand	Mild	CYP2J2	48	33
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000872284968	DF	On-Demand	Bother	SLC27A4	45	35
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCCC2)c1	ZINC000872284973	EG	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCCC2)c1	ZINC000872284973	EG	On-Demand	Anodyne	ACHE	16	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCCC2)c1	ZINC000872284973	EG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(N[C@]12CCC[C@H]1OCC2)c1cccc(CN2CCCCC2)c1	ZINC000872284973	EG	On-Demand	Anodyne	BDKRB1	38	45
CN(C)CCOc1ccc(N(C)C(=O)[C@]23CCC[C@H]2CNC3)cc1	ZINC000872284981	ED	On-Demand	Anodyne	ESRRG	43	31
O=C1CC2(CCOCC2)N(CCCn2ccnc2)CCN1	ZINC000872284985	CC	On-Demand	Anodyne	QPCT	15	42
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285042	EF	On-Demand	Mild	ADRB2	16	48
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285042	EF	On-Demand	Mild	ADRB1	61	37
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285042	EF	On-Demand	Mild	ABCB1	72	45
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285043	EF	On-Demand	Mild	ADRB2	16	48
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285043	EF	On-Demand	Mild	ADRB1	61	37
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285043	EF	On-Demand	Mild	ABCB1	72	45
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285044	EF	On-Demand	Mild	ADRB2	16	48
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285044	EF	On-Demand	Mild	ADRB1	61	37
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H](OC2CCC2)CC1	ZINC000872285044	EF	On-Demand	Mild	ABCB1	72	45
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285045	EF	On-Demand	Mild	ADRB2	16	48
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285045	EF	On-Demand	Mild	ADRB1	61	37
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H](OC2CCC2)CC1	ZINC000872285045	EF	On-Demand	Mild	ABCB1	72	45
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285048	DE	On-Demand	Anodyne	DRD4	16	47
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285048	DE	On-Demand	Anodyne	GRIN2B	21	41
O=C(CN1CCC[C@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285048	DE	On-Demand	Anodyne	SLC27A1	34	40
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285049	DE	On-Demand	Anodyne	DRD4	16	47
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285049	DE	On-Demand	Anodyne	GRIN2B	21	41
O=C(CN1CCC[C@@H](OC2CCC2)CC1)Nc1ccccn1	ZINC000872285049	DE	On-Demand	Anodyne	SLC27A1	34	40
Cc1nc(CN2CCC(CNC(=O)[C@@H]3CCCCC[C@@H]3N)CC2)oc1C	ZINC000872285110	FF	On-Demand	Anodyne	CACNA1I	55	35
O=C(Cc1ccc(-n2ccnc2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872285150	DE	On-Demand	Anodyne	NOS2	41	34
CN(C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	ZINC000872285174	GH	On-Demand	Anodyne	LIPE	27	55
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000872285188	ED	On-Demand	Anodyne	L3MBTL3	65	37
CC(C)(C)OC(=O)N1CCC(CCN2CCNC(=O)CC23CCOCC3)CC1	ZINC000872285206	GE	On-Demand	Anodyne	GPR119	30	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872285210	FE	On-Demand	Anodyne	HRH3	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872285210	FE	On-Demand	Anodyne	NACHRBETA2	40	39
O=C1CC2(CCOCC2)N(Cc2ccc(F)cc2Cl)CCN1	ZINC000872285222	EE	On-Demand	Anodyne	P2RX7	37	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	DRD4	42	32
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	CHRNA7	17	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	PLD1	53	37
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	EPHX2	15	55
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	PLD2	69	37
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285284	FE	On-Demand	Anodyne	L3MBTL3	18	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)C1	ZINC000872285292	FD	On-Demand	Anodyne	DRD4	41	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)C1	ZINC000872285292	FD	On-Demand	Anodyne	PLD1	43	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)C1	ZINC000872285292	FD	On-Demand	Anodyne	PLD2	59	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)C1	ZINC000872285332	GF	On-Demand	Anodyne	NAMPT	43	42
O=C(CCCc1cccnc1)N[C@]12CCC[C@H]1OCC2	ZINC000872285342	CE	On-Demand	Anodyne	TBXAS1	29	41
O=C1CC2(CCOCC2)N(Cc2ccc(Cl)nc2)CCN1	ZINC000872285513	DD	On-Demand	Anodyne	Q8WSF8_APLCA	38	43
O=C1CC2(CCOCC2)N(Cc2ccc(Cl)nc2)CCN1	ZINC000872285513	DD	On-Demand	Anodyne	NACHRBETA2	43	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	F2	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	DRD4	41	32
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	PLD1	54	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	PLD2	71	37
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	L3MBTL3	15	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000872285577	GE	On-Demand	Anodyne	TMPRSS11D	54	34
O=C1CC2(CCOCC2)N(CCCC(=O)c2ccccc2)CCN1	ZINC000872285604	EE	On-Demand	Anodyne	DRD2	27	45
O=C1CC2(CCOCC2)N(CCCC(=O)c2ccccc2)CCN1	ZINC000872285604	EE	On-Demand	Anodyne	CYP2J2	49	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000872285634	DF	On-Demand	Anodyne	L3MBTL3	65	38
O=C1CC2(CCOCC2)N(CCC(=O)Nc2cccc3ccccc23)CCN1	ZINC000872285654	GF	On-Demand	Anodyne	PRKDC	72	37
O=C(Cc1ccc2cccnc2c1)N[C@]12CCC[C@H]1OCC2	ZINC000872285675	CF	On-Demand	Anodyne	CDK5	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000872285680	FE	On-Demand	Anodyne	SIGMAR1	18	42
O=C1CC2(CCOCC2)N(Cc2ccc(-n3ccnc3)cc2)CCN1	ZINC000872285707	ED	On-Demand	Anodyne	CYP2C19	15	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccc(NCCN2CCOCC2)c(F)c1	ZINC000872285708	GE	On-Demand	Anodyne	PLD2	47	35
O=C1CC2(CCOCC2)N(CCC(=O)Nc2cccc(C(F)(F)F)c2)CCN1	ZINC000872285709	GE	On-Demand	Anodyne	EPHX2	19	43
O=C1CC2(CCOCC2)N(CCC(=O)Nc2cccc(C(F)(F)F)c2)CCN1	ZINC000872285709	GE	On-Demand	Anodyne	BRAF	28	41
O=C(CCNC(=O)c1cc2ccccc2[nH]1)N[C@]12CCC[C@H]1OCC2	ZINC000872285821	EE	On-Demand	Anodyne	PYGL	44	35
O=C(CCNC(=O)c1cc2ccccc2[nH]1)N[C@]12CCC[C@H]1OCC2	ZINC000872285821	EE	On-Demand	Anodyne	PLD2	28	42
O=C1CC2(CCOCC2)N(Cc2cccc(C(=O)Nc3ccccc3)c2)CCN1	ZINC000872285827	GF	On-Demand	Anodyne	KCNK3	55	36
C=CC(=O)Nc1cccc(C(=O)N[C@]23CCC[C@H]2OCC3)c1	ZINC000872285833	DE	On-Demand	Anodyne	KCNK3	41	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000872285868	EE	On-Demand	Anodyne	P2RX7	29	47
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3ccccc3s2)CCN1	ZINC000872285869	FD	On-Demand	Anodyne	CSNK1D	33	44
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3ccccc3s2)CCN1	ZINC000872285869	FD	On-Demand	Anodyne	SLC27A1	28	50
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3c(s2)CCCC3)CCN1	ZINC000872285876	GD	On-Demand	Anodyne	SLC27A1	43	48
O=C1CC2(CCOCC2)N(CC(=O)Nc2nccs2)CCN1	ZINC000872285884	DC	On-Demand	Anodyne	MAP1	101	42
O=C1CC2(CCOCC2)N(CC(=O)Nc2cccnc2Cl)CCN1	ZINC000872285903	FD	On-Demand	Anodyne	G2YM83_BOTF4	60	35
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3c(s2)CCC3)CCN1	ZINC000872285925	FC	On-Demand	Anodyne	SLC27A1	42	48
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	HTR1A	62	47
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	DRD2	55	47
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	ADRA1D	66	38
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285926	EE	On-Demand	Anodyne	DRD3	57	38
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	HTR1A	62	47
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	DRD2	55	47
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	ADRA1D	66	38
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872285927	EE	On-Demand	Anodyne	DRD3	57	38
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(F)c(Cl)c2)CCN1	ZINC000872285929	FD	On-Demand	Anodyne	MCHR1	27	42
N#Cc1cccc(NC(=O)CCN2CCNC(=O)CC23CCOCC3)c1	ZINC000872285930	FD	On-Demand	Mild	MCHR1	31	41
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)C1	ZINC000872285936	GF	On-Demand	Anodyne	MCHR1	19	42
O=C(N[C@]12CCC[C@H]1OCC2)[C@H](Cc1cccnc1)C1CCCC1	ZINC000872285938	EG	On-Demand	Anodyne	C3AR1	41	41
O=C(N[C@]12CCC[C@H]1OCC2)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872285939	EG	On-Demand	Anodyne	C3AR1	41	41
O=C(Cc1ccc(OCc2ccncc2)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872285940	FG	On-Demand	Anodyne	ADAM17	15	45
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3ccc(F)cc3s2)CCN1	ZINC000872285950	GD	On-Demand	Anodyne	CSNK1D	42	37
O=C1CC2(CCOCC2)N(CC(=O)Nc2nc3ccc(F)cc3s2)CCN1	ZINC000872285950	GD	On-Demand	Anodyne	SLC27A1	29	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(Oc2cccnn2)c1	ZINC000872285962	EG	On-Demand	Anodyne	F13A1	21	40
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(Cl)cn2)CCN1	ZINC000872285975	FD	On-Demand	Anodyne	KLKB1	17	41
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(Cl)cn2)CCN1	ZINC000872285975	FD	On-Demand	Anodyne	F10	35	42
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccccc2OCC#N)C(C)(C)CC1	ZINC000872285983	GG	On-Demand	Mild	GPR119	23	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872286003	FF	On-Demand	Anodyne	HDAC1	20	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872286003	FF	On-Demand	Anodyne	HDAC2	16	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872286003	FF	On-Demand	Anodyne	RPS6KA3	21	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000872286003	FF	On-Demand	Anodyne	NAMPT	86	60
COc1ccc2c(CN3CCNC(=O)CC34CCOCC4)cc(=O)oc2c1	ZINC000872286011	FD	On-Demand	Anodyne	CYP19A1	15	52
COc1ccc2c(CN3CCNC(=O)CC34CCOCC4)cc(=O)oc2c1	ZINC000872286011	FD	On-Demand	Anodyne	CYP11B1	18	44
O=C(Cc1ccc(O)c(Cl)c1)N[C@]12CCC[C@H]1OCC2	ZINC000872286017	CE	On-Demand	Anodyne	NCE103	16	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC000872286021	EG	On-Demand	Anodyne	TNK2	28	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC000872286022	EG	On-Demand	Anodyne	TNK2	28	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	ESR1	69	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	DRD2	15	46
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	HRH2	18	42
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	HTR2A	16	52
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	SLC6A3	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	KCNH2	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	ESR2	48	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	LTA4H	62	51
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	HTR7	16	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	HRH3	51	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	CCR3	44	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	EPHX2	36	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	MCHR1	17	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	CACNA1G	29	44
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	PSMB2	40	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	PSMB1	45	39
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872286025	GF	On-Demand	Anodyne	MEN1	43	37
NC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCCC[C@H]3N)CC2)cc1	ZINC000872286039	ED	On-Demand	Anodyne	L3MBTL3	35	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000872286086	DE	On-Demand	Anodyne	L3MBTL3	97	52
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000872286087	DE	On-Demand	Anodyne	L3MBTL3	97	52
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccccc2-c2ccccc2)CCN1	ZINC000872286149	GF	On-Demand	Anodyne	PRKDC	24	42
CN1CCN(c2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)CC1	ZINC000872286159	DD	On-Demand	Anodyne	KCNQ2	73	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)C1	ZINC000872286197	EE	On-Demand	Anodyne	LUCI_LUCLA	38	46
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000872286209	EE	On-Demand	Anodyne	EPHX2	16	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000872286210	EE	On-Demand	Anodyne	EPHX2	16	41
O=C1CC2(CCOCC2)N(Cc2ccc(C(=O)Nc3ccccc3)cc2)CCN1	ZINC000872286247	GF	On-Demand	Anodyne	PRNP	49	37
O=C1CC2(CCOCC2)N(Cc2ccc(C(=O)Nc3ccccc3)cc2)CCN1	ZINC000872286247	GF	On-Demand	Anodyne	NOD1	18	41
O=C1CC2(CCOCC2)N(Cc2ccc(C(=O)Nc3ccccc3)cc2)CCN1	ZINC000872286247	GF	On-Demand	Anodyne	NOD2	46	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000872286259	DG	On-Demand	Anodyne	NAMPT	63	39
CCOc1ccccc1NC(=O)CCN1CCNC(=O)CC12CCOCC2	ZINC000872286260	GD	On-Demand	Anodyne	HCN1	49	37
COc1cc(NC2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc(OC)c1	ZINC000872286323	GG	On-Demand	Anodyne	SYK	19	40
COc1cc(NC2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc(OC)c1	ZINC000872286323	GG	On-Demand	Anodyne	ZAP70	15	40
COc1cc(NC2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc(OC)c1	ZINC000872286323	GG	On-Demand	Anodyne	NPBWR1	40	30
O=C1CC2(CCOCC2)N(Cc2cc(=O)oc3cc(O)ccc23)CCN1	ZINC000872286327	FD	On-Demand	Anodyne	HSD17B3	34	46
Cc1ccccc1[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286333	DF	On-Demand	Anodyne	DPP7	40	33
Cc1ccccc1[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286334	DF	On-Demand	Anodyne	DPP7	40	33
Cc1ccccc1[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286335	DF	On-Demand	Anodyne	DPP7	40	33
Cc1ccccc1[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286336	DF	On-Demand	Anodyne	DPP7	40	33
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc3ccccc3c2)CCN1	ZINC000872286345	FE	On-Demand	Anodyne	CALCRL	33	41
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc3ccccc3c2)CCN1	ZINC000872286345	FE	On-Demand	Anodyne	IMDH_CRYPV	17	43
CN1CCCN(c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872286346	EF	On-Demand	Anodyne	LCK	15	42
CN1CCCN(c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872286346	EF	On-Demand	Anodyne	PRNP	37	44
CN1CCCN(c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872286346	EF	On-Demand	Anodyne	HCK	15	42
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286356	GH	On-Demand	Anodyne	SLC6A3	17	48
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286356	GH	On-Demand	Anodyne	MC4R	39	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286357	GH	On-Demand	Anodyne	SLC6A3	17	48
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286357	GH	On-Demand	Anodyne	MC4R	39	43
CCOC(=O)[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286359	CC	On-Demand	Anodyne	DPP7	41	40
CCOC(=O)[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286361	CC	On-Demand	Anodyne	DPP7	41	40
CC(C)(C)OC(=O)N1CCN(C(=O)c2cncc(Cl)n2)C(C)(C)CC1	ZINC000872286364	FF	On-Demand	Anodyne	GPR119	28	40
O=C(c1cccc2c1CNC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286366	DF	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1cccc2c1CNC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286367	DF	On-Demand	Anodyne	L3MBTL3	63	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872286384	GE	On-Demand	Anodyne	DRD4	27	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872286384	GE	On-Demand	Anodyne	EBP	23	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872286385	GE	On-Demand	Anodyne	DRD4	27	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872286385	GE	On-Demand	Anodyne	EBP	23	41
C[C@H](N)c1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872286408	DG	On-Demand	Anodyne	L3MBTL3	90	46
C[C@H](N)c1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872286410	DG	On-Demand	Anodyne	L3MBTL3	90	46
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)CCN1	ZINC000872286420	GE	On-Demand	Anodyne	EPHX2	29	43
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000872286423	CE	On-Demand	Anodyne	L3MBTL3	82	46
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000872286424	CE	On-Demand	Anodyne	L3MBTL3	82	46
CN1CCN(c2ncccc2CNC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872286426	ED	On-Demand	Anodyne	SCN10A	15	40
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc(Cl)c(Cl)c2)CCN1	ZINC000872286430	GE	On-Demand	Anodyne	IMDH_CRYPV	22	41
N#CCCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286433	CD	On-Demand	Mild	DPP7	78	42
N#CCCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286433	CD	On-Demand	Mild	DPP8	19	43
N#CCCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286434	CD	On-Demand	Mild	DPP7	78	42
N#CCCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286434	CD	On-Demand	Mild	DPP8	19	43
N#CCCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286435	CD	On-Demand	Mild	DPP7	78	42
N#CCCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286435	CD	On-Demand	Mild	DPP8	19	43
N#CCCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286436	CD	On-Demand	Mild	DPP7	78	42
N#CCCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286436	CD	On-Demand	Mild	DPP8	19	43
O=C1CC2(CCOCC2)N(CC(=O)OCc2ccccc2)CCN1	ZINC000872286443	ED	On-Demand	Anodyne	SLC12A5	60	34
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)C1CCC1	ZINC000872286457	CE	On-Demand	Anodyne	DPP4	23	65
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)C1CCC1	ZINC000872286457	CE	On-Demand	Anodyne	DPP7	48	45
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)C1CCC1	ZINC000872286458	CE	On-Demand	Anodyne	DPP4	23	65
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)C1CCC1	ZINC000872286458	CE	On-Demand	Anodyne	DPP7	48	45
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)C1CCC1	ZINC000872286459	CE	On-Demand	Anodyne	DPP4	23	65
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)C1CCC1	ZINC000872286459	CE	On-Demand	Anodyne	DPP7	48	45
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)C1CCC1	ZINC000872286460	CE	On-Demand	Anodyne	DPP4	23	65
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)C1CCC1	ZINC000872286460	CE	On-Demand	Anodyne	DPP7	48	45
N#Cc1cccc(NC(=O)CN2CCNC(=O)CC23CCOCC3)c1	ZINC000872286478	EC	On-Demand	Mild	MCHR1	35	44
COc1cccc([C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286494	EF	On-Demand	Anodyne	DPP7	26	43
COc1cccc([C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286497	EF	On-Demand	Anodyne	DPP7	26	43
N#CCCCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286545	DE	On-Demand	Mild	DPP7	77	42
N#CCCCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286545	DE	On-Demand	Mild	DPP8	20	44
N#CCCCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286546	DE	On-Demand	Mild	DPP7	77	42
N#CCCCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286546	DE	On-Demand	Mild	DPP8	20	44
N#CCCCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286547	DE	On-Demand	Mild	DPP7	77	42
N#CCCCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286547	DE	On-Demand	Mild	DPP8	20	44
N#CCCCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286548	DE	On-Demand	Mild	DPP7	77	42
N#CCCCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286548	DE	On-Demand	Mild	DPP8	20	44
N[C@@H](CC1CCCCC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286564	DG	On-Demand	Anodyne	DPP7	73	51
N[C@H](CC1CCCCC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286565	DG	On-Demand	Anodyne	DPP7	73	51
N[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286566	DG	On-Demand	Anodyne	DPP7	73	51
N[C@H](CC1CCCCC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286567	DG	On-Demand	Anodyne	DPP7	73	51
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	HTR1A	69	60
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	DRD2	46	53
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	DRD4	47	38
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	HTR2A	43	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	HTR2C	21	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	ADRA1A	20	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	DRD3	59	48
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000872286576	ED	On-Demand	Anodyne	HTR7	61	43
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872286587	FF	On-Demand	Bother	CACNA1C	54	37
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872286587	FF	On-Demand	Bother	CACNA1D	82	37
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872286589	FF	On-Demand	Bother	CACNA1C	54	37
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000872286589	FF	On-Demand	Bother	CACNA1D	82	37
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1	ZINC000872286603	JJ	On-Demand	Anodyne	HDAC8	15	52
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1	ZINC000872286603	JJ	On-Demand	Anodyne	HDAC1	23	42
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1	ZINC000872286604	JJ	On-Demand	Anodyne	HDAC8	15	52
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1	ZINC000872286604	JJ	On-Demand	Anodyne	HDAC1	23	42
O=C1CC2(CCOCC2)N(CC(=O)Nc2cccc3ccccc23)CCN1	ZINC000872286617	FE	On-Demand	Anodyne	PRKDC	57	35
C=C(Cl)C[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286622	DE	On-Demand	Mild	DPP7	57	38
C=C(Cl)C[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286623	DE	On-Demand	Mild	DPP7	57	38
C=C(Cl)C[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286624	DE	On-Demand	Mild	DPP7	57	38
C=C(Cl)C[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286625	DE	On-Demand	Mild	DPP7	57	38
NC[C@@H]1CCCc2ccc(C(=O)N3CCC[C@@H](OC4CCC4)CC3)cc21	ZINC000872286633	FH	On-Demand	Anodyne	L3MBTL3	66	39
NC[C@@H]1CCCc2ccc(C(=O)N3CCC[C@H](OC4CCC4)CC3)cc21	ZINC000872286634	FH	On-Demand	Anodyne	L3MBTL3	66	39
NC[C@H]1CCCc2ccc(C(=O)N3CCC[C@H](OC4CCC4)CC3)cc21	ZINC000872286635	FH	On-Demand	Anodyne	L3MBTL3	66	39
NC[C@H]1CCCc2ccc(C(=O)N3CCC[C@@H](OC4CCC4)CC3)cc21	ZINC000872286636	FH	On-Demand	Anodyne	L3MBTL3	66	39
O=C(CN1CCNC(=O)CC12CCOCC2)NCc1ccc(Cl)cc1	ZINC000872286641	FD	On-Demand	Anodyne	DPOL_VZVD	40	37
O=C(CN1CCNC(=O)CC12CCOCC2)NCCOc1cccc(Cl)c1	ZINC000872286644	GD	On-Demand	Anodyne	AVPR1B	44	40
COC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286651	CC	On-Demand	Anodyne	DPP7	67	40
COC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286652	CC	On-Demand	Anodyne	DPP7	67	40
COC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286653	CC	On-Demand	Anodyne	DPP7	67	40
COC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286654	CC	On-Demand	Anodyne	DPP7	67	40
CN(C)CC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286658	CD	On-Demand	Anodyne	DPP7	89	46
CN(C)CC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286659	CD	On-Demand	Anodyne	DPP7	89	46
CN(C)CC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286660	CD	On-Demand	Anodyne	DPP7	89	46
CN(C)CC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286661	CD	On-Demand	Anodyne	DPP7	89	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	HTR1A	53	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	DRD2	38	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	HTR2A	42	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	HTR2C	28	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	ADRA1A	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	DRD3	55	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000872286699	FD	On-Demand	Anodyne	HTR7	40	40
O=C(c1cccc2c1CCNC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286706	EF	On-Demand	Anodyne	L3MBTL3	53	37
O=C(c1cccc2c1CCNC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286707	EF	On-Demand	Anodyne	L3MBTL3	53	37
NCCc1ccccc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286714	DF	On-Demand	Anodyne	L3MBTL3	45	42
NCCc1ccccc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286715	DF	On-Demand	Anodyne	L3MBTL3	45	42
CN1CCCN(c2ccc(NC(=O)[C@]34CCC[C@H]3CNC4)cc2)CC1	ZINC000872286724	EE	On-Demand	Anodyne	PRNP	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	HTR1A	51	54
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	DRD2	43	52
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	DRD4	23	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	HTR2A	36	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	HTR2C	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000872286743	FD	On-Demand	Anodyne	DRD3	57	44
NC1(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286766	GG	On-Demand	Anodyne	CHRM2	17	42
NC1(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286766	GG	On-Demand	Anodyne	CHRM3	17	42
NC1(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286766	GG	On-Demand	Anodyne	SIGMAR1	69	40
NC1(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286766	GG	On-Demand	Anodyne	NPFFR1	41	36
NC1(CC(=O)N2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286767	GG	On-Demand	Anodyne	CHRM2	17	42
NC1(CC(=O)N2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286767	GG	On-Demand	Anodyne	CHRM3	17	42
NC1(CC(=O)N2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286767	GG	On-Demand	Anodyne	SIGMAR1	69	40
NC1(CC(=O)N2CCC[C@H](OC3CCC3)CC2)CCN(Cc2ccccc2)CC1	ZINC000872286767	GG	On-Demand	Anodyne	NPFFR1	41	36
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c(O)c1	ZINC000872286789	DF	On-Demand	Anodyne	L3MBTL3	57	40
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c(O)c1	ZINC000872286791	DF	On-Demand	Anodyne	L3MBTL3	57	40
CN(c1ccccc1)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872286796	EG	On-Demand	Anodyne	CCR5	31	44
CN(c1ccccc1)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872286796	EG	On-Demand	Anodyne	AMY2	51	37
CN(c1ccccc1)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872286796	EG	On-Demand	Anodyne	SFRP1	60	33
CN(c1ccccc1)C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872286796	EG	On-Demand	Anodyne	WNT3	63	33
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000872286797	EE	On-Demand	Anodyne	DRD4	15	56
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000872286797	EE	On-Demand	Anodyne	SIGMAR1	17	53
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000872286797	EE	On-Demand	Anodyne	EPHX2	23	44
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000872286801	FH	On-Demand	Anodyne	LIPG	47	35
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000872286802	FH	On-Demand	Anodyne	LIPG	47	35
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000872286803	FH	On-Demand	Anodyne	LIPG	47	35
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000872286804	FH	On-Demand	Anodyne	LIPG	47	35
O=C(c1coc(C(F)F)c1)N1CCCCc2cccnc21	ZINC000872286824	CH	On-Demand	Anodyne	AVPR2	26	40
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)nc1	ZINC000872286825	CE	On-Demand	Anodyne	L3MBTL3	37	46
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)nc1	ZINC000872286827	CE	On-Demand	Anodyne	L3MBTL3	37	46
N#CCCn1cc(C(=O)CN2CCNC(=O)CC23CCOCC3)c2ccccc21	ZINC000872286833	GE	On-Demand	Mild	CNR2	19	42
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1CCCCc2cccnc21	ZINC000872286847	EI	On-Demand	Anodyne	C3AR1	45	43
O=C([C@H](Cc1cccnc1)C1CCCC1)N1CCCCc2cccnc21	ZINC000872286848	EI	On-Demand	Anodyne	C3AR1	45	43
CCOc1ccccc1NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872286901	FD	On-Demand	Anodyne	HCN1	49	38
CCOc1ccccc1NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872286901	FD	On-Demand	Anodyne	HCN4	40	31
CC(=O)N1CCC[C@@H]1C(=O)N1CCCCc2cccnc21	ZINC000872286926	CD	On-Demand	Anodyne	PREP	86	39
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286936	FD	On-Demand	Anodyne	ADRB1	17	44
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286936	FD	On-Demand	Anodyne	HTR1A	15	47
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286936	FD	On-Demand	Anodyne	SLC6A4	16	40
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286937	FD	On-Demand	Anodyne	ADRB1	17	44
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286937	FD	On-Demand	Anodyne	HTR1A	15	47
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3[nH]ccc23)CCN1	ZINC000872286937	FD	On-Demand	Anodyne	SLC6A4	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2ccncc2)CC1	ZINC000872286950	DD	On-Demand	Anodyne	ADAM10	34	40
O=C1CC2(CCOCC2)N(Cc2cnc(Cl)s2)CCN1	ZINC000872286952	DD	On-Demand	Anodyne	NACHRBETA2	15	42
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1F	ZINC000872286953	EF	On-Demand	Anodyne	DPP4	18	42
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1F	ZINC000872286954	EF	On-Demand	Anodyne	DPP4	18	42
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1F	ZINC000872286955	EF	On-Demand	Anodyne	DPP4	18	42
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1F	ZINC000872286956	EF	On-Demand	Anodyne	DPP4	18	42
Nc1ccc(Cl)c(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286963	DG	On-Demand	Anodyne	HRH1	20	45
Nc1ccc(Cl)c(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286963	DG	On-Demand	Anodyne	CCR3	25	45
Nc1ccc(Cl)c(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286963	DG	On-Demand	Anodyne	L3MBTL3	55	38
Nc1ccc(Cl)c(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286964	DG	On-Demand	Anodyne	HRH1	20	45
Nc1ccc(Cl)c(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286964	DG	On-Demand	Anodyne	CCR3	25	45
Nc1ccc(Cl)c(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286964	DG	On-Demand	Anodyne	L3MBTL3	55	38
Nc1cccc(CC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286972	DF	On-Demand	Anodyne	BRS3	15	40
Nc1cccc(CC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872286972	DF	On-Demand	Anodyne	MLNR	17	40
Nc1cccc(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286973	DF	On-Demand	Anodyne	BRS3	15	40
Nc1cccc(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872286973	DF	On-Demand	Anodyne	MLNR	17	40
Nc1cc(F)ccc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872286995	DF	On-Demand	Anodyne	L3MBTL3	53	47
Nc1cc(F)ccc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872286996	DF	On-Demand	Anodyne	L3MBTL3	53	47
CN1CCN(c2ccncc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)CC1	ZINC000872286997	DC	On-Demand	Anodyne	PIM3	16	42
CC(C)(C)NC(=O)CN1CCC(CNC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872287003	FD	On-Demand	Anodyne	CACNA1I	51	52
O=C(Cc1csc(COc2ccccc2)n1)N1CCCCc2cccnc21	ZINC000872287029	GI	On-Demand	Anodyne	CPT1A	37	40
C[C@H]1CN(c2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@@H](C)O1	ZINC000872287054	FH	On-Demand	Anodyne	AVPR2	30	49
C[C@H]1CN(c2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@H](C)O1	ZINC000872287056	FH	On-Demand	Anodyne	AVPR2	30	49
CCc1ccc(F)cc1C(=O)N1CCCCc2cccnc21	ZINC000872287094	CH	On-Demand	Anodyne	AVPR2	45	40
O=C1CC2(CCOCC2)N(CCCOc2ccccc2)CCN1	ZINC000872287175	DD	On-Demand	Anodyne	HRH3	18	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	HTR1A	77	52
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	DRD2	52	54
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	DRD4	47	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	HTR2A	45	51
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	HTR2C	20	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	SLC6A1	56	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	ADRA1A	18	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	DRD3	67	54
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	HTR7	70	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000872287179	ED	On-Demand	Anodyne	SIGMAR1	18	50
Nc1ccc(Cc2nc(C(=O)N3CCC[C@@H](OC4CCC4)CC3)cs2)cc1	ZINC000872287243	GH	On-Demand	Clean	TRPC6	41	37
Nc1ccc(Cc2nc(C(=O)N3CCC[C@H](OC4CCC4)CC3)cs2)cc1	ZINC000872287244	GH	On-Demand	Clean	TRPC6	41	37
O=C(CN1CCNC(=O)CC12CCOCC2)NCc1ccc2c(c1)OCO2	ZINC000872287246	GC	On-Demand	Anodyne	NOS2	98	39
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287265	FH	On-Demand	Anodyne	DPP4	22	48
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287265	FH	On-Demand	Anodyne	DPP7	28	46
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287266	FH	On-Demand	Anodyne	DPP4	22	48
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287266	FH	On-Demand	Anodyne	DPP7	28	46
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287267	FH	On-Demand	Anodyne	DPP4	22	48
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287267	FH	On-Demand	Anodyne	DPP7	28	46
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287268	FH	On-Demand	Anodyne	DPP4	22	48
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000872287268	FH	On-Demand	Anodyne	DPP7	28	46
O=C1CC2(CCOCC2)N(CC(=O)Nc2ccc3c(c2)CCC3)CCN1	ZINC000872287277	FD	On-Demand	Anodyne	CALCRL	51	42
O=C1CC2(CCOCC2)N(CC(=O)N[C@@H]2CCCc3ccccc32)CCN1	ZINC000872287308	FD	On-Demand	Anodyne	BDKRB1	51	40
O=C1CC2(CCOCC2)N(CC(=O)N[C@H]2CCCc3ccccc32)CCN1	ZINC000872287309	FD	On-Demand	Anodyne	BDKRB1	51	40
O=C([C@@H]1C[C@H]1c1ccsc1)N1CCCCc2cccnc21	ZINC000872287327	CH	On-Demand	Anodyne	NPBWR1	92	35
O=C1CC2(CCOCC2)N(CCCOc2ccc(F)cc2)CCN1	ZINC000872287345	ED	On-Demand	Anodyne	HRH3	17	40
NCCc1ccccc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287360	DC	On-Demand	Anodyne	HCN1	72	35
NCCc1ccccc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287360	DC	On-Demand	Anodyne	HCN4	49	32
NCCc1ccccc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287361	DC	On-Demand	Anodyne	HCN1	72	35
NCCc1ccccc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287361	DC	On-Demand	Anodyne	HCN4	49	32
CC(C)(C)OC(=O)N1CCN(C(=O)c2cnc(Cl)cn2)C(C)(C)CC1	ZINC000872287402	FF	On-Demand	Anodyne	GPR119	42	39
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	F2	25	44
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	OPRM1	30	42
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	OPRD1	24	42
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	TRY2_BOVIN	73	36
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	CCR3	16	41
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	DPP4	22	46
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	DPP7	78	57
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	ST14	71	37
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	DPP8	26	46
COc1cccc(C[C@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287414	EF	On-Demand	Anodyne	DPP9	18	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	F2	25	44
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	OPRM1	30	42
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	OPRD1	24	42
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	TRY2_BOVIN	73	36
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	CCR3	16	41
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	DPP4	22	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	DPP7	78	57
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	ST14	71	37
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	DPP8	26	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287415	EF	On-Demand	Anodyne	DPP9	18	46
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	F2	25	44
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	OPRM1	30	42
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	OPRD1	24	42
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	TRY2_BOVIN	73	36
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	CCR3	16	41
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	DPP4	22	46
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	DPP7	78	57
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	ST14	71	37
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	DPP8	26	46
COc1cccc(C[C@H](N)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287416	EF	On-Demand	Anodyne	DPP9	18	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	F2	25	44
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	OPRM1	30	42
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	OPRD1	24	42
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	TRY2_BOVIN	73	36
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	CCR3	16	41
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	DPP4	22	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	DPP7	78	57
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	ST14	71	37
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	DPP8	26	46
COc1cccc(C[C@@H](N)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287417	EF	On-Demand	Anodyne	DPP9	18	46
O=C1CC2(CCOCC2)N(C[C@H](O)c2cccc(Cl)c2)CCN1	ZINC000872287430	ED	On-Demand	Anodyne	CYP3A4	41	36
O=C1CC2(CCOCC2)N(C[C@@H](O)c2cccc(Cl)c2)CCN1	ZINC000872287431	ED	On-Demand	Anodyne	CYP3A4	41	36
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1c(F)cccc1F	ZINC000872287433	EF	On-Demand	Anodyne	DPP7	47	33
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1c(F)cccc1F	ZINC000872287434	EF	On-Demand	Anodyne	DPP7	47	33
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1c(F)cccc1F	ZINC000872287435	EF	On-Demand	Anodyne	DPP7	47	33
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1c(F)cccc1F	ZINC000872287436	EF	On-Demand	Anodyne	DPP7	47	33
CC(C)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287454	EH	On-Demand	Anodyne	AMY2	44	31
CC(C)(C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287455	EH	On-Demand	Anodyne	AMY2	44	31
CC(C)(C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287456	EH	On-Demand	Anodyne	AMY2	44	31
CC(C)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287457	EH	On-Demand	Anodyne	AMY2	44	31
C[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287470	EG	On-Demand	Anodyne	DPP4	22	42
C[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287470	EG	On-Demand	Anodyne	DPP7	56	36
C[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287472	EG	On-Demand	Anodyne	DPP4	22	42
C[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287472	EG	On-Demand	Anodyne	DPP7	56	36
C[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287475	EG	On-Demand	Anodyne	DPP4	22	42
C[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@H](N)c1ccccc1	ZINC000872287475	EG	On-Demand	Anodyne	DPP7	56	36
C[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287478	EG	On-Demand	Anodyne	DPP4	22	42
C[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)[C@@H](N)c1ccccc1	ZINC000872287478	EG	On-Demand	Anodyne	DPP7	56	36
NCc1cc(C(=O)N2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872287503	DE	On-Demand	Anodyne	L3MBTL3	74	38
NCc1cc(C(=O)N2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000872287503	DE	On-Demand	Anodyne	HPGD	40	33
NCc1cc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872287506	DE	On-Demand	Anodyne	L3MBTL3	74	38
NCc1cc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000872287506	DE	On-Demand	Anodyne	HPGD	40	33
N[C@@H](CC(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872287510	CD	On-Demand	Anodyne	DPP7	69	44
N[C@H](CC(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872287513	CD	On-Demand	Anodyne	DPP7	69	44
N[C@@H](CC(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872287514	CD	On-Demand	Anodyne	DPP7	69	44
N[C@H](CC(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872287515	CD	On-Demand	Anodyne	DPP7	69	44
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287528	DG	On-Demand	Anodyne	PREP	51	38
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287528	DG	On-Demand	Anodyne	DPP8	27	40
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287529	DG	On-Demand	Anodyne	PREP	51	38
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287529	DG	On-Demand	Anodyne	DPP8	27	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287531	DB	On-Demand	Anodyne	OPRM1	39	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287531	DB	On-Demand	Anodyne	OPRD1	31	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287531	DB	On-Demand	Anodyne	PSMB8	48	38
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287532	DG	On-Demand	Anodyne	PREP	51	38
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287532	DG	On-Demand	Anodyne	DPP8	27	40
N[C@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287533	DB	On-Demand	Anodyne	OPRM1	39	40
N[C@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287533	DB	On-Demand	Anodyne	OPRD1	31	40
N[C@H](Cc1ccccc1)C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872287533	DB	On-Demand	Anodyne	PSMB8	48	38
N[C@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287534	DB	On-Demand	Anodyne	OPRM1	39	40
N[C@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287534	DB	On-Demand	Anodyne	OPRD1	31	40
N[C@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287534	DB	On-Demand	Anodyne	PSMB8	48	38
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287535	DG	On-Demand	Anodyne	PREP	51	38
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287535	DG	On-Demand	Anodyne	DPP8	27	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287536	DB	On-Demand	Anodyne	OPRM1	39	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287536	DB	On-Demand	Anodyne	OPRD1	31	40
N[C@@H](Cc1ccccc1)C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872287536	DB	On-Demand	Anodyne	PSMB8	48	38
Nc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287541	CF	On-Demand	Anodyne	PREP	32	43
Nc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872287541	CF	On-Demand	Anodyne	L3MBTL3	85	49
O=C(c1ccc(C2CC2)cc1)N1CCCCc2cccnc21	ZINC000872287542	CH	On-Demand	Anodyne	AVPR2	46	45
Nc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287544	CF	On-Demand	Anodyne	PREP	32	43
Nc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872287544	CF	On-Demand	Anodyne	L3MBTL3	85	49
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872287547	DG	On-Demand	Anodyne	CCR3	16	43
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872287547	DG	On-Demand	Anodyne	L3MBTL3	59	40
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872287550	DG	On-Demand	Anodyne	CCR3	16	43
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1	ZINC000872287550	DG	On-Demand	Anodyne	L3MBTL3	59	40
COC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1C	ZINC000872287561	DG	On-Demand	Anodyne	AVPR2	84	45
COC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1C	ZINC000872287561	DG	On-Demand	Anodyne	AVPR1A	26	45
O=C(c1cccn1C1CCNCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872287585	EF	On-Demand	Anodyne	L3MBTL3	47	39
O=C(c1cccn1C1CCNCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872287588	EF	On-Demand	Anodyne	L3MBTL3	47	39
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287596	DF	On-Demand	Anodyne	DPP4	22	51
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287596	DF	On-Demand	Anodyne	DPP7	60	38
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287601	DF	On-Demand	Anodyne	DPP4	22	51
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287601	DF	On-Demand	Anodyne	DPP7	60	38
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287604	DF	On-Demand	Anodyne	DPP4	22	51
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287604	DF	On-Demand	Anodyne	DPP7	60	38
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287607	DF	On-Demand	Anodyne	DPP4	22	51
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872287607	DF	On-Demand	Anodyne	DPP7	60	38
O=C1CC2(CCOCC2)N(CC(=O)Nc2cccc(C(F)(F)F)c2)CCN1	ZINC000872287618	GE	On-Demand	Anodyne	EPHX2	19	42
O=C1CC2(CCOCC2)N(CC(=O)Nc2cccc(C(F)(F)F)c2)CCN1	ZINC000872287618	GE	On-Demand	Anodyne	BRAF	24	41
Nc1ccc(CC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872287621	DF	On-Demand	Clean	MLNR	25	44
Nc1ccc(CC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872287625	DF	On-Demand	Clean	MLNR	25	44
O=C1CC2(CCOCC2)N(CCC(=O)N[C@H]2CCCc3ccccc32)CCN1	ZINC000872287669	GD	On-Demand	Anodyne	BDKRB1	42	41
O=C1CC2(CCOCC2)N(CCC(=O)N[C@@H]2CCCc3ccccc32)CCN1	ZINC000872287670	GD	On-Demand	Anodyne	BDKRB1	42	41
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287683	GD	On-Demand	Anodyne	ADRB2	15	45
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287683	GD	On-Demand	Anodyne	ADRB1	17	42
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287683	GD	On-Demand	Anodyne	ABCB1	52	46
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287684	GD	On-Demand	Anodyne	ADRB2	15	45
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287684	GD	On-Demand	Anodyne	ADRB1	17	42
O=C1CC2(CCOCC2)N(C[C@H](O)COc2cccc3ccccc23)CCN1	ZINC000872287684	GD	On-Demand	Anodyne	ABCB1	52	46
O=C(c1cscc1Cl)N1CCCCc2cccnc21	ZINC000872287760	CH	On-Demand	Anodyne	AVPR2	26	43
O=C(c1ccc(C(=O)N2CCCCc3cccnc32)cc1)N1CCOCC1	ZINC000872287764	FF	On-Demand	Anodyne	AVPR2	32	46
O=C(c1ccc(C(=O)N2CCCCc3cccnc32)cc1)N1CCOCC1	ZINC000872287764	FF	On-Demand	Anodyne	LIPA	40	34
O=C(c1ccc(C(=O)N2CCCCc3cccnc32)cc1)N1CCOCC1	ZINC000872287764	FF	On-Demand	Anodyne	L3MBTL3	55	35
O=C1CC2(CCOCC2)N(CCOc2ccccc2)CCN1	ZINC000872287769	DD	On-Demand	Anodyne	LTA4H	19	40
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287817	EF	On-Demand	Anodyne	AVPR2	23	40
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287817	EF	On-Demand	Anodyne	AVPR1A	15	40
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287817	EF	On-Demand	Anodyne	SMO	36	41
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287817	EF	On-Demand	Anodyne	L3MBTL3	68	37
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287818	EF	On-Demand	Anodyne	AVPR2	23	40
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287818	EF	On-Demand	Anodyne	AVPR1A	15	40
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287818	EF	On-Demand	Anodyne	SMO	36	41
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872287818	EF	On-Demand	Anodyne	L3MBTL3	68	37
O=C(NC[C@@]12COCCN1C(=O)OC2)c1cccc2c1CCNC2	ZINC000872287843	EC	On-Demand	Anodyne	HCN1	52	33
O=C(NC[C@]12COCCN1C(=O)OC2)c1cccc2c1CCNC2	ZINC000872287845	EC	On-Demand	Anodyne	HCN1	52	33
O=C(NC[C@@]12COCCN1C(=O)OC2)c1cccc2c1CNC2	ZINC000872287903	DC	On-Demand	Anodyne	HCN1	58	34
O=C(NC[C@]12COCCN1C(=O)OC2)c1cccc2c1CNC2	ZINC000872287904	DC	On-Demand	Anodyne	HCN1	58	34
O=C(Cc1ccc(F)c(Cl)c1)N1CCCCc2cccnc21	ZINC000872287905	DH	On-Demand	Anodyne	OPRK1	27	42
Cn1cc(-c2ccc(C(=O)N3CCCCc4cccnc43)cc2)cn1	ZINC000872288027	EG	On-Demand	Anodyne	AVPR2	35	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cnn(C3CCNCC3)c2)C1	ZINC000872288049	CC	On-Demand	Anodyne	GRK5	42	33
O=C(c1ccc(C2CCOCC2)cc1)N1CCCCc2cccnc21	ZINC000872288051	EH	On-Demand	Anodyne	AVPR2	32	43
Nc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@H]1CCCCC[C@H]1N	ZINC000872288053	DF	On-Demand	Anodyne	BDKRB1	50	36
Nc1ccc2c(c1)CCC[C@H]2NC(=O)[C@H]1CCCCC[C@H]1N	ZINC000872288054	DF	On-Demand	Anodyne	BDKRB1	50	36
O=C(CCCc1cccnc1)N1CCCCc2cccnc21	ZINC000872288055	CG	On-Demand	Anodyne	TBXAS1	23	43
O=C(CCCc1cccnc1)N1CCCCc2cccnc21	ZINC000872288055	CG	On-Demand	Anodyne	PTAFR	23	40
O=C(CCCc1cccnc1)N1CCCCc2cccnc21	ZINC000872288055	CG	On-Demand	Anodyne	CHRNA7	40	37
O=C(CCCc1cccnc1)N1CCCCc2cccnc21	ZINC000872288055	CG	On-Demand	Anodyne	PREP	42	39
CN1C(=O)C(C)(C)c2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872288061	EG	On-Demand	Anodyne	AVPR2	44	39
Nc1ccc(Cl)c(C(=O)NC[C@@]23COCCN2C(=O)OC3)c1	ZINC000872288085	EC	On-Demand	Anodyne	P2RX7	22	51
Nc1ccc(Cl)c(C(=O)NC[C@]23COCCN2C(=O)OC3)c1	ZINC000872288087	EC	On-Demand	Anodyne	P2RX7	22	51
CS(=O)(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872288103	ED	On-Demand	Anodyne	AVPR2	49	38
CC[C@H](NC(=O)CN1CCNC(=O)CC12CCOCC2)c1ccc(Cl)cc1	ZINC000872288128	GE	On-Demand	Anodyne	AKT3	23	41
CC[C@@H](NC(=O)CN1CCNC(=O)CC12CCOCC2)c1ccc(Cl)cc1	ZINC000872288129	GE	On-Demand	Anodyne	AKT3	23	41
O=C(c1ccc(C(F)F)cc1F)N1CCCCc2cccnc21	ZINC000872288284	DI	On-Demand	Anodyne	AVPR2	25	43
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(C2CCNCC2)c1	ZINC000872288289	DD	On-Demand	Anodyne	ADRBK1	40	33
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cnn(C2CCNCC2)c1	ZINC000872288289	DD	On-Demand	Anodyne	GRK5	51	34
O=C(NCCC(=O)N1CCCCc2cccnc21)c1cc2ccccc2[nH]1	ZINC000872288290	FG	On-Demand	Anodyne	PLD1	34	40
O=C(NCCC(=O)N1CCCCc2cccnc21)c1cc2ccccc2[nH]1	ZINC000872288290	FG	On-Demand	Anodyne	PLD2	40	43
Nc1ccccc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872288304	CC	On-Demand	Anodyne	HCN1	75	37
Nc1ccccc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872288304	CC	On-Demand	Anodyne	HCN4	51	33
Nc1ccccc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872288305	CC	On-Demand	Anodyne	HCN1	75	37
Nc1ccccc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872288305	CC	On-Demand	Anodyne	HCN4	51	33
CN(C)c1ncc(C(=O)N2CCCCc3cccnc32)cc1Cl	ZINC000872288308	EG	On-Demand	Anodyne	AVPR2	36	43
O=C(c1cccc(S(=O)(=O)C(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872288313	GG	On-Demand	Anodyne	AKR1C3	57	37
O=C(c1ccc(Cn2ccnn2)cc1)N1CCCCc2cccnc21	ZINC000872288393	EF	On-Demand	Anodyne	AVPR2	29	41
CN(Cc1ccc(F)cc1)C(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872288537	FD	On-Demand	Anodyne	PLA2G7	43	39
CNc1ccc(C(F)(F)F)cc1C(=O)N1CCCCc2cccnc21	ZINC000872288547	EI	On-Demand	Anodyne	AVPR2	28	41
CNc1ccc(C(F)(F)F)cc1C(=O)N1CCCCc2cccnc21	ZINC000872288547	EI	On-Demand	Anodyne	TRPV1	38	41
O=C(Cc1ccc(NC(=O)C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872288553	GG	On-Demand	Anodyne	AVPR2	19	41
O=C(Cc1ccc(NC(=O)C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872288553	GG	On-Demand	Anodyne	TRPV1	19	42
O=C1CC2(CCOCC2)N(Cc2ccc(Br)cc2F)CCN1	ZINC000872288585	FE	On-Demand	Anodyne	AKR1B1	22	42
O=C([C@@H]1Cc2ccccc2CN1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288649	EF	On-Demand	Anodyne	PREP	40	40
O=C([C@@H]1Cc2ccccc2CN1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288650	EF	On-Demand	Anodyne	PREP	40	40
O=C([C@H]1Cc2ccccc2CN1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288651	EF	On-Demand	Anodyne	PREP	40	40
O=C([C@H]1Cc2ccccc2CN1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288652	EF	On-Demand	Anodyne	PREP	40	40
NCc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872288655	DF	On-Demand	Anodyne	L3MBTL3	95	48
NCc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872288656	DF	On-Demand	Anodyne	L3MBTL3	95	48
N[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872288660	EG	On-Demand	Anodyne	DPP7	44	40
N[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872288661	EG	On-Demand	Anodyne	DPP7	44	40
N[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872288662	EG	On-Demand	Anodyne	DPP7	44	40
N[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(Cl)c1	ZINC000872288663	EG	On-Demand	Anodyne	DPP7	44	40
O=C(CNc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288675	DG	On-Demand	Anodyne	DPP4	17	45
O=C(CNc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288675	DG	On-Demand	Anodyne	PREP	64	38
O=C(CNc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288675	DG	On-Demand	Anodyne	EPHX2	30	42
O=C(CNc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288675	DG	On-Demand	Anodyne	DPP7	22	42
O=C(CNc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288675	DG	On-Demand	Anodyne	SCD	24	47
O=C(CNc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288676	DG	On-Demand	Anodyne	DPP4	17	45
O=C(CNc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288676	DG	On-Demand	Anodyne	PREP	64	38
O=C(CNc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288676	DG	On-Demand	Anodyne	EPHX2	30	42
O=C(CNc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288676	DG	On-Demand	Anodyne	DPP7	22	42
O=C(CNc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288676	DG	On-Demand	Anodyne	SCD	24	47
O=C(c1ccc2c(c1)CCNCC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288690	EF	On-Demand	Anodyne	PREP	16	41
O=C(c1ccc2c(c1)CCNCC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288690	EF	On-Demand	Anodyne	L3MBTL3	89	43
O=C(c1ccc2c(c1)CCNCC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288691	EF	On-Demand	Anodyne	PREP	16	41
O=C(c1ccc2c(c1)CCNCC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288691	EF	On-Demand	Anodyne	L3MBTL3	89	43
COc1cc(N)c(Cl)cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288709	FG	On-Demand	Anodyne	DRD2	16	55
COc1cc(N)c(Cl)cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288709	FG	On-Demand	Anodyne	HTR4	118	56
COc1cc(N)c(Cl)cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288710	FG	On-Demand	Anodyne	DRD2	16	55
COc1cc(N)c(Cl)cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288710	FG	On-Demand	Anodyne	HTR4	118	56
O=C(c1ccc2c(c1)CNC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872288731	DF	On-Demand	Anodyne	L3MBTL3	92	42
O=C(c1ccc2c(c1)CNC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872288732	DF	On-Demand	Anodyne	L3MBTL3	92	42
Nc1ccc(C(=O)NC[C@@]23COCCN2C(=O)OC3)c(Cl)c1	ZINC000872288751	EC	On-Demand	Anodyne	SLC6A9	51	38
Nc1ccc(C(=O)NC[C@]23COCCN2C(=O)OC3)c(Cl)c1	ZINC000872288752	EC	On-Demand	Anodyne	SLC6A9	51	38
O=C(c1ccc(CF)cc1)N1CCCCc2cccnc21	ZINC000872288770	CH	On-Demand	Anodyne	AVPR2	42	46
O=C(c1ccc(C(F)(F)Br)nc1)N1CCCCc2cccnc21	ZINC000872288781	GH	On-Demand	Anodyne	AVPR2	35	42
Nc1cc2ccccc2cc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872288812	ED	On-Demand	Anodyne	HCN1	68	33
Nc1cc2ccccc2cc1C(=O)NC[C@]12COCCN1C(=O)OC2	ZINC000872288812	ED	On-Demand	Anodyne	HCN4	46	30
Nc1cc2ccccc2cc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872288813	ED	On-Demand	Anodyne	HCN1	68	33
Nc1cc2ccccc2cc1C(=O)NC[C@@]12COCCN1C(=O)OC2	ZINC000872288813	ED	On-Demand	Anodyne	HCN4	46	30
O=C(c1cccc(N2CCCC2)c1)N1CCCCc2cccnc21	ZINC000872288833	DH	On-Demand	Anodyne	AVPR2	33	49
NC[C@@H]1CN(C(=O)[C@@H]2CCCCC[C@@H]2N)C[C@H]1c1ccccc1	ZINC000872288834	DE	On-Demand	Anodyne	CCR5	46	55
O=C(c1ccc2c(c1)CCOC2)N1CCCCc2cccnc21	ZINC000872288844	DG	On-Demand	Anodyne	AVPR2	37	41
O=C(c1ccsc1Cl)N1CCCCc2cccnc21	ZINC000872288890	CH	On-Demand	Anodyne	AVPR2	37	41
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccccc2Cl)CCN1	ZINC000872288894	FD	On-Demand	Anodyne	CCR1	40	39
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccccc2Cl)CCN1	ZINC000872288894	FD	On-Demand	Anodyne	ABCB1	48	38
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccccc2Cl)CCN1	ZINC000872288895	FD	On-Demand	Anodyne	CCR1	40	39
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccccc2Cl)CCN1	ZINC000872288895	FD	On-Demand	Anodyne	ABCB1	48	38
CC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1OC(C)C	ZINC000872288908	FI	On-Demand	Anodyne	AVPR2	41	39
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccccc2F)CCN1	ZINC000872288917	FC	On-Demand	Anodyne	ABCB1	47	39
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccccc2F)CCN1	ZINC000872288918	FC	On-Demand	Anodyne	ABCB1	47	39
C[C@@H]1Cc2cc(C(=O)N3CCCCc4cccnc43)ccc2O1	ZINC000872288941	DG	On-Demand	Anodyne	AVPR2	36	40
C[C@H]1Cc2cc(C(=O)N3CCCCc4cccnc43)ccc2O1	ZINC000872288942	DG	On-Demand	Anodyne	AVPR2	36	40
N[C@H]1CCCCC[C@H]1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1	ZINC000872288961	DD	On-Demand	Anodyne	CCR5	40	53
O=C([C@@H]1CCc2ccccc2C1)N1CCCCc2cccnc21	ZINC000872289022	DH	On-Demand	Anodyne	FAAH	15	47
O=C([C@H]1CCc2ccccc2C1)N1CCCCc2cccnc21	ZINC000872289023	DH	On-Demand	Anodyne	FAAH	15	47
C[C@@H](CC(=O)N1CCCCc2cccnc21)n1ccnc1	ZINC000872289040	CF	On-Demand	Anodyne	CYP26A1	75	34
O=C(c1ccc(O[C@H]2CC2(F)F)cc1)N1CCCCc2cccnc21	ZINC000872289060	EH	On-Demand	Anodyne	AVPR2	25	40
O=C(c1ccc(O[C@@H]2CC2(F)F)cc1)N1CCCCc2cccnc21	ZINC000872289061	EH	On-Demand	Anodyne	AVPR2	25	40
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccc3ccccc3c2)CCN1	ZINC000872289192	GD	On-Demand	Anodyne	ACOX1	45	35
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccc3ccccc3c2)CCN1	ZINC000872289192	GD	On-Demand	Anodyne	ABCB1	30	41
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccc3ccccc3c2)CCN1	ZINC000872289193	GD	On-Demand	Anodyne	ACOX1	45	35
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccc3ccccc3c2)CCN1	ZINC000872289193	GD	On-Demand	Anodyne	ABCB1	30	41
O=C(NC[C@@]12COCCN1C(=O)OC2)c1ccccc1CC1CCNCC1	ZINC000872289216	FD	On-Demand	Anodyne	HCN1	65	36
O=C(NC[C@@]12COCCN1C(=O)OC2)c1ccccc1CC1CCNCC1	ZINC000872289216	FD	On-Demand	Anodyne	HCN4	48	31
O=C(NC[C@]12COCCN1C(=O)OC2)c1ccccc1CC1CCNCC1	ZINC000872289217	FD	On-Demand	Anodyne	HCN1	65	36
O=C(NC[C@]12COCCN1C(=O)OC2)c1ccccc1CC1CCNCC1	ZINC000872289217	FD	On-Demand	Anodyne	HCN4	48	31
CC(=O)c1cccc(OC[C@@H](O)CN2CCNC(=O)CC23CCOCC3)c1	ZINC000872289228	GD	On-Demand	Anodyne	ABCB1	35	49
CC(=O)c1cccc(OC[C@H](O)CN2CCNC(=O)CC23CCOCC3)c1	ZINC000872289229	GD	On-Demand	Anodyne	ABCB1	35	49
Cc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1N	ZINC000872289301	DG	On-Demand	Anodyne	L3MBTL3	90	47
Cc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1N	ZINC000872289302	DG	On-Demand	Anodyne	L3MBTL3	90	47
CC[C@@H](C)[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289305	CE	On-Demand	Anodyne	TPP2	29	44
CC[C@@H](C)[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289306	CE	On-Demand	Anodyne	TPP2	29	44
NC[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872289420	EF	On-Demand	Anodyne	DPP4	18	43
NC[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872289421	EF	On-Demand	Anodyne	DPP4	18	43
NC[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872289422	EF	On-Demand	Anodyne	DPP4	18	43
NC[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000872289423	EF	On-Demand	Anodyne	DPP4	18	43
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	ACE	18	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	SSTR2	65	38
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	OPRM1	28	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	OPRD1	16	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	GHRHR	27	40
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	MME	23	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	TACR1	32	47
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	CCKAR	56	43
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	MMP2	21	46
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	ECE1	53	38
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	MMP11	61	31
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	CCKBR	57	41
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	GHSR	61	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	MMP9	21	46
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	DPP7	63	37
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	AKT1	34	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289447	FF	On-Demand	Anodyne	SSSIM	26	40
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	ACE	18	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	SSTR2	65	38
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	OPRM1	28	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	OPRD1	16	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	GHRHR	27	40
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	MME	23	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	TACR1	32	47
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	CCKAR	56	43
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	MMP2	21	46
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	ECE1	53	38
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	MMP11	61	31
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	CCKBR	57	41
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	GHSR	61	42
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	MMP9	21	46
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	DPP7	63	37
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	AKT1	34	51
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289448	FF	On-Demand	Anodyne	SSSIM	26	40
Cc1c(C(=O)N2CCCCc3cccnc32)ccn1Cc1ccccc1	ZINC000872289475	EI	On-Demand	Anodyne	AVPR2	35	42
O=C1CC2(CCOCC2)N(Cc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000872289574	GG	On-Demand	Anodyne	ALOX5	17	42
O=C(c1ccc2c(c1)CCCN2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289575	EH	On-Demand	Anodyne	L3MBTL3	76	39
O=C(c1ccc2c(c1)CCCN2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289576	EH	On-Demand	Anodyne	L3MBTL3	76	39
N=c1cc[nH]cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289585	CE	On-Demand	Anodyne	L3MBTL3	64	37
N=c1cc[nH]cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289586	CE	On-Demand	Anodyne	L3MBTL3	64	37
O=C(c1ccc2c(c1)CCN2)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289601	DG	On-Demand	Anodyne	L3MBTL3	81	40
O=C(c1ccc2c(c1)CCN2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289602	DG	On-Demand	Anodyne	L3MBTL3	81	40
NCc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872289608	DF	On-Demand	Anodyne	PREP	39	41
NCc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872289608	DF	On-Demand	Anodyne	PARP1	15	41
NCc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872289608	DF	On-Demand	Anodyne	TPSAB1	38	43
NCc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872289608	DF	On-Demand	Anodyne	ST14	51	34
NCc1cccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000872289608	DF	On-Demand	Anodyne	L3MBTL3	77	46
NCc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872289609	DF	On-Demand	Anodyne	PREP	39	41
NCc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872289609	DF	On-Demand	Anodyne	PARP1	15	41
NCc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872289609	DF	On-Demand	Anodyne	TPSAB1	38	43
NCc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872289609	DF	On-Demand	Anodyne	ST14	51	34
NCc1cccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000872289609	DF	On-Demand	Anodyne	L3MBTL3	77	46
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	F2	36	54
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	ACE	57	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	OPRM1	58	48
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	OPRD1	47	47
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	MME	33	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	TRY1_BOVIN	45	38
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	DPP4	33	54
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	PREP	54	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	DPP7	95	49
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	AKT1	16	47
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	AMP1_PLAFQ	15	43
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	DPP8	48	53
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289615	DF	On-Demand	Anodyne	DPP9	25	53
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	F2	36	54
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	ACE	57	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	OPRM1	58	48
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	OPRD1	47	47
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	MME	33	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	TRY1_BOVIN	45	38
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	DPP4	33	54
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	PREP	54	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	DPP7	95	49
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	AKT1	16	47
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	AMP1_PLAFQ	15	43
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	DPP8	48	53
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289616	DF	On-Demand	Anodyne	DPP9	25	53
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	F2	36	54
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	ACE	57	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	OPRM1	58	48
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	OPRD1	47	47
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	MME	33	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	TRY1_BOVIN	45	38
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	DPP4	33	54
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	PREP	54	41
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	DPP7	95	49
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	AKT1	16	47
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	AMP1_PLAFQ	15	43
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	DPP8	48	53
N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289617	DF	On-Demand	Anodyne	DPP9	25	53
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	F2	36	54
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	ACE	57	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	OPRM1	58	48
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	OPRD1	47	47
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	MME	33	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	TRY1_BOVIN	45	38
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	DPP4	33	54
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	PREP	54	41
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	DPP7	95	49
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	AKT1	16	47
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	AMP1_PLAFQ	15	43
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	DPP8	48	53
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289618	DF	On-Demand	Anodyne	DPP9	25	53
O=C1CC2(CCOCC2)N(CCOc2cccc3ccccc23)CCN1	ZINC000872289622	FF	On-Demand	Anodyne	ALB	23	40
O=C1CC2(CCOCC2)N(CCOc2cccc3ccccc23)CCN1	ZINC000872289622	FF	On-Demand	Anodyne	MCL1	37	40
N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289648	GF	On-Demand	Anodyne	CPB2	40	45
N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289648	GF	On-Demand	Anodyne	DPP7	71	39
N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289649	GF	On-Demand	Anodyne	CPB2	40	45
N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289649	GF	On-Demand	Anodyne	DPP7	71	39
O=C1CC2(CCOCC2)N(CCc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000872289650	ED	On-Demand	Bother	KCNJ1	31	46
NCCC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289655	BD	On-Demand	Anodyne	PREP	15	42
NCCC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289689	BD	On-Demand	Anodyne	PREP	15	42
NCc1cc(C(=O)N2CCC[C@H](OC3CCC3)CC2)co1	ZINC000872289702	CE	On-Demand	Anodyne	L3MBTL3	49	36
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000872289736	GF	On-Demand	Anodyne	LIMK2	37	42
O=C(Cc1nsc2ccccc12)N1CCCCc2cccnc21	ZINC000872289745	DH	On-Demand	Anodyne	HTR1A	17	41
O=C(Cc1nsc2ccccc12)N1CCCCc2cccnc21	ZINC000872289745	DH	On-Demand	Anodyne	DRD2	20	41
O=C(c1cncc(Cl)c1)N1CCCCc2cccnc21	ZINC000872289755	CG	On-Demand	Anodyne	AVPR2	34	40
O=C(c1cncc(Cl)c1)N1CCCCc2cccnc21	ZINC000872289755	CG	On-Demand	Anodyne	SCN2A	17	41
O=C(c1cncc(Cl)c1)N1CCCCc2cccnc21	ZINC000872289755	CG	On-Demand	Anodyne	SCN10A	17	41
CC1(C)CCNCCN1C(=O)CCC(=O)c1ccc(Cl)cc1	ZINC000872289756	DF	On-Demand	Anodyne	ERG2	17	42
O=C1CC2(CCOCC2)N(CCOC(c2ccccc2)c2ccccc2)CCN1	ZINC000872289757	GG	On-Demand	Anodyne	SLC6A4	21	41
O=C1CC2(CCOCC2)N(CCOC(c2ccccc2)c2ccccc2)CCN1	ZINC000872289757	GG	On-Demand	Anodyne	SLC6A3	56	45
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872289759	GE	On-Demand	Anodyne	F13A1	30	40
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872289759	GE	On-Demand	Anodyne	L3MBTL3	16	43
CC1(C)CCNCCN1C(=O)Cc1cccc2ccccc12	ZINC000872289760	CF	On-Demand	Anodyne	FFAR2	56	33
COC(=O)c1sccc1NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872289771	GC	On-Demand	Anodyne	FAS	32	42
CC1(C)CCNCCN1C(=O)Cc1ccc(N)cc1	ZINC000872289812	CD	On-Demand	Clean	FFAR2	49	35
NCc1cc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)co1	ZINC000872289830	CE	On-Demand	Anodyne	L3MBTL3	49	36
O=C1CC2(CCOCC2)N(Cc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000872289846	DD	On-Demand	Bother	KCNJ1	22	50
NC[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289850	DF	On-Demand	Anodyne	CHRM1	15	47
NC[C@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289850	DF	On-Demand	Anodyne	DPP7	42	37
NC[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289851	DF	On-Demand	Anodyne	CHRM1	15	47
NC[C@@H](C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289851	DF	On-Demand	Anodyne	DPP7	42	37
NC[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289852	DF	On-Demand	Anodyne	CHRM1	15	47
NC[C@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289852	DF	On-Demand	Anodyne	DPP7	42	37
NC[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289853	DF	On-Demand	Anodyne	CHRM1	15	47
NC[C@@H](C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289853	DF	On-Demand	Anodyne	DPP7	42	37
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289862	DF	On-Demand	Anodyne	CHRM2	20	43
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289862	DF	On-Demand	Anodyne	CHRM1	22	43
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289862	DF	On-Demand	Anodyne	CHRM3	36	43
C[C@@](N)(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289862	DF	On-Demand	Anodyne	AMY2	57	34
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289864	DF	On-Demand	Anodyne	CHRM2	20	43
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289864	DF	On-Demand	Anodyne	CHRM1	22	43
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289864	DF	On-Demand	Anodyne	CHRM3	36	43
C[C@@](N)(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872289864	DF	On-Demand	Anodyne	AMY2	57	34
O=C(CNC1CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872289875	CD	On-Demand	Anodyne	DPP7	20	42
O=C(CNC1CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872289876	CD	On-Demand	Anodyne	DPP7	20	42
NCCCn1ccc2cc(C(=O)N3CCC[C@H](OC4CCC4)CC3)ccc21	ZINC000872289877	FH	On-Demand	Anodyne	L3MBTL3	57	37
NCCCn1ccc2cc(C(=O)N3CCC[C@@H](OC4CCC4)CC3)ccc21	ZINC000872289878	FH	On-Demand	Anodyne	L3MBTL3	57	37
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872289888	FF	On-Demand	Anodyne	TTK	32	40
O=C1CC2(CCOCC2)N(Cc2cccc(C(=O)N3CCCCC3)c2)CCN1	ZINC000872289911	GE	On-Demand	Anodyne	PARP1	15	43
NCc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)o1	ZINC000872289912	CE	On-Demand	Anodyne	L3MBTL3	35	45
NCc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)o1	ZINC000872289913	CE	On-Demand	Anodyne	L3MBTL3	35	45
O=C(c1cnn(C(F)F)c1)N1CCCCc2cccnc21	ZINC000872289919	CF	On-Demand	Anodyne	AVPR2	16	40
CC(=O)Nc1cccc(CC(=O)N2CCCCc3cccnc32)c1	ZINC000872289944	DF	On-Demand	Anodyne	OPRK1	16	40
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	ZINC000872289961	GE	On-Demand	Anodyne	AKR1C3	62	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCCc2cccnc21	ZINC000872289982	EF	On-Demand	Anodyne	KCNJ1	40	36
CCCCCNC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872290009	DC	On-Demand	Anodyne	ASAH1	44	37
CC1(C)CCNCCN1C(=O)C[C@@H](N)Cc1ccccc1	ZINC000872290011	CD	On-Demand	Anodyne	DPP4	28	43
CC1(C)CCNCCN1C(=O)C[C@@H](N)Cc1ccccc1	ZINC000872290011	CD	On-Demand	Anodyne	SLC12A5	41	32
CC1(C)CCNCCN1C(=O)C[C@H](N)Cc1ccccc1	ZINC000872290012	CD	On-Demand	Anodyne	DPP4	28	43
CC1(C)CCNCCN1C(=O)C[C@H](N)Cc1ccccc1	ZINC000872290012	CD	On-Demand	Anodyne	SLC12A5	41	32
CC1(C)CCNCCN1C(=O)c1cccc(C(F)(F)F)c1	ZINC000872290014	DF	On-Demand	Anodyne	CACNA1B	41	35
CC1(C)CCNCCN1C(=O)c1cccc(C(F)(F)F)c1	ZINC000872290014	DF	On-Demand	Anodyne	CCR2	45	35
O=C(c1csc(C2CCCCC2)n1)N1CCCCc2cccnc21	ZINC000872290017	EJ	On-Demand	Anodyne	TRPC6	42	34
O=C(c1csc(C2CCCCC2)n1)N1CCCCc2cccnc21	ZINC000872290017	EJ	On-Demand	Anodyne	TRPC3	40	34
Nc1ccccc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290064	CF	On-Demand	Anodyne	L3MBTL3	68	47
Nc1cc(C(=O)N2CCC[C@H](OC3CCC3)CC2)ccc1F	ZINC000872290085	DF	On-Demand	Anodyne	L3MBTL3	89	47
Nc1cc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1F	ZINC000872290086	DF	On-Demand	Anodyne	L3MBTL3	89	47
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290097	EF	On-Demand	Anodyne	F2	20	43
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290097	EF	On-Demand	Anodyne	DPP4	67	48
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290097	EF	On-Demand	Anodyne	PREP	55	39
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290097	EF	On-Demand	Anodyne	DPP8	34	43
N[C@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290097	EF	On-Demand	Anodyne	DPP9	24	43
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290098	EF	On-Demand	Anodyne	F2	20	43
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290098	EF	On-Demand	Anodyne	DPP4	67	48
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290098	EF	On-Demand	Anodyne	PREP	55	39
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290098	EF	On-Demand	Anodyne	DPP8	34	43
N[C@@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290098	EF	On-Demand	Anodyne	DPP9	24	43
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290099	EF	On-Demand	Anodyne	F2	20	43
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290099	EF	On-Demand	Anodyne	DPP4	67	48
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290099	EF	On-Demand	Anodyne	PREP	55	39
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290099	EF	On-Demand	Anodyne	DPP8	34	43
N[C@@H](CC(=O)N1CCC[C@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290099	EF	On-Demand	Anodyne	DPP9	24	43
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290100	EF	On-Demand	Anodyne	F2	20	43
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290100	EF	On-Demand	Anodyne	DPP4	67	48
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290100	EF	On-Demand	Anodyne	PREP	55	39
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290100	EF	On-Demand	Anodyne	DPP8	34	43
N[C@H](CC(=O)N1CCC[C@@H](OC2CCC2)CC1)Cc1ccccc1	ZINC000872290100	EF	On-Demand	Anodyne	DPP9	24	43
N[C@@H](CCC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872290101	EG	On-Demand	Anodyne	PREP	54	38
N[C@@H](CCC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872290102	EG	On-Demand	Anodyne	PREP	54	38
N[C@H](CCC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000872290103	EG	On-Demand	Anodyne	PREP	54	38
N[C@H](CCC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000872290104	EG	On-Demand	Anodyne	PREP	54	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	HTR1A	53	55
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	DRD2	49	52
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	DRD4	25	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	HTR2A	29	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	HTR2C	18	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000872290178	FD	On-Demand	Anodyne	DRD3	71	44
CCC[C@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290183	CE	On-Demand	Anodyne	DPP7	89	46
CCC[C@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290184	CE	On-Demand	Anodyne	DPP7	89	46
CCC[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290185	CE	On-Demand	Anodyne	DPP7	89	46
CCC[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290186	CE	On-Demand	Anodyne	DPP7	89	46
CN1CCC(CNC(=O)[C@@H]2CCCCC[C@@H]2N)(N2CCCCC2)CC1	ZINC000872290206	FD	On-Demand	Anodyne	HCN1	53	37
CN1CCC(CNC(=O)[C@@H]2CCCCC[C@@H]2N)(N2CCCCC2)CC1	ZINC000872290206	FD	On-Demand	Anodyne	HCN4	49	33
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000872290267	GE	On-Demand	Anodyne	EPHX2	16	41
Nc1cc2ccccc2cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290281	EH	On-Demand	Anodyne	GRIN2B	20	42
Nc1cc2ccccc2cc1C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290281	EH	On-Demand	Anodyne	L3MBTL3	52	42
Nc1cc2ccccc2cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290286	EH	On-Demand	Anodyne	GRIN2B	20	42
Nc1cc2ccccc2cc1C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290286	EH	On-Demand	Anodyne	L3MBTL3	52	42
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872290290	CF	On-Demand	Anodyne	PREP	15	42
Nc1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000872290290	CF	On-Demand	Anodyne	L3MBTL3	101	51
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872290291	CF	On-Demand	Anodyne	PREP	15	42
Nc1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000872290291	CF	On-Demand	Anodyne	L3MBTL3	101	51
O=C(c1ccccc1CC1CCNCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290325	FH	On-Demand	Anodyne	GRIN2B	47	41
O=C(c1ccccc1CC1CCNCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290325	FH	On-Demand	Anodyne	L3MBTL3	44	40
O=C(c1ccccc1CC1CCNCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290326	FH	On-Demand	Anodyne	GRIN2B	47	41
O=C(c1ccccc1CC1CCNCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290326	FH	On-Demand	Anodyne	L3MBTL3	44	40
C[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290376	BD	On-Demand	Anodyne	DPP4	21	44
C[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290376	BD	On-Demand	Anodyne	DPP7	34	44
C[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290376	BD	On-Demand	Anodyne	DPP8	15	44
C[C@@H](N)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000872290376	BD	On-Demand	Anodyne	DPP9	15	44
C[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290377	BD	On-Demand	Anodyne	DPP4	21	44
C[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290377	BD	On-Demand	Anodyne	DPP7	34	44
C[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290377	BD	On-Demand	Anodyne	DPP8	15	44
C[C@@H](N)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872290377	BD	On-Demand	Anodyne	DPP9	15	44
NCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872290382	CD	On-Demand	Anodyne	EPHX2	15	41
O=C(COCc1cccc(Cl)c1)N1CCCCc2cccnc21	ZINC000872290410	EH	On-Demand	Anodyne	MAOB	17	43
O=C([C@H]1C[C@@H]1c1ccccc1)N1CCCCc2cccnc21	ZINC000872290415	CH	On-Demand	Anodyne	NAMPT	22	40
CC1(C)CCNCCN1C(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	ZINC000872290430	GE	On-Demand	Anodyne	MAOA	23	50
COc1ccc(CC(=O)N2CCNCCC2(C)C)cc1OC	ZINC000872290441	DD	On-Demand	Anodyne	FFAR2	45	33
CC1(C)CCNCCN1C(=O)c1cc(=O)c2ccccc2o1	ZINC000872290444	DE	On-Demand	Anodyne	TNKS	26	40
O=C(Cc1cc2cc(Cl)ccc2[nH]1)N1CCCCc2cccnc21	ZINC000872290462	EI	On-Demand	Anodyne	PYGL	53	37
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872290465	GE	On-Demand	Anodyne	AKR1C3	62	40
CC1(C)CCNCCN1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000872290472	DF	On-Demand	Anodyne	MMP13	20	42
CC1(C)CCNCCN1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000872290472	DF	On-Demand	Anodyne	MMP2	23	42
CC1(C)CCNCCN1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000872290472	DF	On-Demand	Anodyne	EPHX2	46	37
C[C@@H]1CCn2ncc(C(=O)N3CCCCc4cccnc43)c2C1	ZINC000872290480	DF	On-Demand	Anodyne	AVPR2	25	42
CC1(C)CCNCCN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000872290482	CD	On-Demand	Bother	COLA	104	35
O=C(c1ccc(S(=O)(=O)C2CCC2)cc1)N1CCCCc2cccnc21	ZINC000872290492	FG	On-Demand	Anodyne	AVPR2	27	41
CC1(C)CCNCCN1C(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000872290607	DE	On-Demand	Anodyne	ITGAL	15	40
CC1(C)CCNCCN1C(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000872290607	DE	On-Demand	Anodyne	DYRK2	64	35
CC1(C)CCNCCN1C(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000872290608	DE	On-Demand	Anodyne	ITGAL	15	40
CC1(C)CCNCCN1C(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000872290608	DE	On-Demand	Anodyne	DYRK2	64	35
Cc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)N1CCOCC1	ZINC000872290611	GD	On-Demand	Anodyne	CNR2	17	53
O=C(c1cccc(S(=O)(=O)C(F)F)c1)N1CCCCc2cccnc21	ZINC000872290612	FG	On-Demand	Anodyne	AKR1C3	52	35
CC1(C)CCNCCN1C(=O)Cc1cccc(C(F)(F)F)c1	ZINC000872290632	DF	On-Demand	Anodyne	TACR1	24	43
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872290646	GC	On-Demand	Anodyne	AKR1C3	57	47
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000872290675	GE	On-Demand	Anodyne	F13A1	30	40
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000872290675	GE	On-Demand	Anodyne	L3MBTL3	16	43
CC1(C)CCNCCN1C(=O)COc1ccc2ccccc2c1	ZINC000872290680	DF	On-Demand	Anodyne	HTR1B	17	41
CC1(C)CCNCCN1C(=O)COc1ccc2ccccc2c1	ZINC000872290680	DF	On-Demand	Anodyne	CPT1A	64	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](N2CCNCC2)C1	ZINC000872290695	CC	On-Demand	Anodyne	L3MBTL3	52	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](N2CCNCC2)C1	ZINC000872290696	CC	On-Demand	Anodyne	L3MBTL3	52	39
Cc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)N1CCCCC1	ZINC000872290707	GE	On-Demand	Anodyne	CNR2	15	62
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872290715	FD	On-Demand	Anodyne	F13A1	32	41
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000872290739	GC	On-Demand	Anodyne	AKR1C3	66	41
CC1(C)CCNCCN1C(=O)CCc1ccc(Cl)cc1Cl	ZINC000872290748	EH	On-Demand	Anodyne	MC4R	20	43
CC1(C)CCNCCN1C(=O)CCc1ccc(Cl)cc1Cl	ZINC000872290748	EH	On-Demand	Anodyne	FFAR2	42	36
O=C(c1ccc2nsnc2c1)N1CCCCc2cccnc21	ZINC000872290752	DG	On-Demand	Anodyne	AVPR2	40	44
CN1C(=O)CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872290775	EF	On-Demand	Anodyne	AVPR2	46	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290778	GE	On-Demand	Anodyne	CPT1A	96	34
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290778	GE	On-Demand	Anodyne	CPT2	43	33
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290778	GE	On-Demand	Anodyne	PREP	49	37
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290779	GE	On-Demand	Anodyne	CPT1A	96	34
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290779	GE	On-Demand	Anodyne	CPT2	43	33
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000872290779	GE	On-Demand	Anodyne	PREP	49	37
O=C([C@H]1CCCN(CC(F)(F)F)C1)N1CCCCc2cccnc21	ZINC000872290791	EG	On-Demand	Anodyne	SLC6A1	96	34
O=C([C@@H]1CCCN(CC(F)(F)F)C1)N1CCCCc2cccnc21	ZINC000872290792	EG	On-Demand	Anodyne	SLC6A1	96	34
O=C(c1cc(F)c(Cl)cc1F)N1CCCCc2cccnc21	ZINC000872290800	DH	On-Demand	Anodyne	AVPR2	34	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(C(F)F)cc1	ZINC000872290809	CG	On-Demand	Anodyne	PROC	40	32
COCCOc1cc(C(=O)N2CCCCc3cccnc32)ccn1	ZINC000872290822	EE	On-Demand	Anodyne	AVPR2	44	39
O=C(c1ncccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872290832	DG	On-Demand	Anodyne	TRPV1	33	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872290835	DF	On-Demand	Anodyne	FKBP1A	18	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872290835	DF	On-Demand	Anodyne	GRIN2B	60	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872290835	DF	On-Demand	Anodyne	CHRNA7	49	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872290835	DF	On-Demand	Anodyne	C3AR1	49	48
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872290835	DF	On-Demand	Anodyne	ACHP_LYMST	27	44
CN(C)c1cc(C(=O)N2CCCCc3cccnc32)c2ccccc2n1	ZINC000872290837	EH	On-Demand	Anodyne	AVPR2	32	42
O=C(Cc1cccc(OCc2cccnc2)c1)N1CCCCc2cccnc21	ZINC000872290844	FH	On-Demand	Anodyne	PARP2	23	40
O=C(Cc1cccc(OCc2cccnc2)c1)N1CCCCc2cccnc21	ZINC000872290844	FH	On-Demand	Anodyne	PARP3	20	40
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCNCCC1(C)C	ZINC000872290867	FF	On-Demand	Anodyne	P2RX7	21	42
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000872290883	GF	On-Demand	Anodyne	TRPV1	26	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000872290884	GF	On-Demand	Anodyne	TRPV1	26	42
Cn1cnc(-c2ccc(C(=O)N3CCCCc4cccnc43)cc2)n1	ZINC000872290886	EF	On-Demand	Anodyne	AVPR2	39	42
N#CC1(c2ccc(C(=O)N3CCCCc4cccnc43)cc2)CC1	ZINC000872290894	DH	On-Demand	Mild	AVPR2	27	42
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000872290898	EE	On-Demand	Anodyne	CCR5	19	43
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000872290898	EE	On-Demand	Anodyne	L3MBTL3	86	42
O=C(c1cncc(N2CCOCC2)c1)N1CCCCc2cccnc21	ZINC000872290903	EE	On-Demand	Anodyne	AVPR2	18	43
O=C(c1cncc(N2CCOCC2)c1)N1CCCCc2cccnc21	ZINC000872290903	EE	On-Demand	Anodyne	SCN10A	18	42
CC1(C)CCNCCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000872290908	DD	On-Demand	Bother	CACNA1C	56	36
CC1(C)CCNCCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000872290908	DD	On-Demand	Bother	CACNA1D	87	36
CC1(C)CCNCCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000872290908	DD	On-Demand	Bother	CPT1A	34	42
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1Cl	ZINC000872290924	DI	On-Demand	Anodyne	AVPR2	51	41
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1Cl	ZINC000872290924	DI	On-Demand	Anodyne	G2YM83_BOTF4	47	35
CC[C@@H](C(=O)N1CCCCc2cccnc21)c1ccc(OC)cc1	ZINC000872290942	DH	On-Demand	Anodyne	KCNQ2	26	45
CC[C@H](C(=O)N1CCCCc2cccnc21)c1ccc(OC)cc1	ZINC000872290943	DH	On-Demand	Anodyne	KCNQ2	26	45
CC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)c(F)c1	ZINC000872290955	DG	On-Demand	Anodyne	AVPR2	43	41
Cc1cc(C#N)ccc1C(=O)N1CCCCc2cccnc21	ZINC000872290959	CG	On-Demand	Mild	AVPR2	40	44
COc1ccc(-n2nc(C(=O)N3CCCCc4cccnc43)cc2C)cc1	ZINC000872290976	FH	On-Demand	Anodyne	RPA1	17	41
CC1(C)CCNCCN1C(=O)Cn1c(O)nc2ccccc21	ZINC000872290977	DD	On-Demand	Anodyne	PDE6D	49	32
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2ccoc2)CC1	ZINC000872290980	ED	On-Demand	Anodyne	L3MBTL3	47	38
Cc1ccc(C(=O)N2CCNCCC2(C)C)cc1NC(=O)c1ccccc1	ZINC000872290984	FG	On-Demand	Anodyne	FSHR	28	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	P2RY12	59	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CTRA_BOVIN	50	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	KLK3	75	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CTSB	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	PAPA1_CARPA	60	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CYSP_TRYCR	55	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CTSK	42	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CTSL	52	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CAPNS1	61	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CELA2A	43	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CTSS	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CAPN1	76	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	CAPN2	119	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	TGM2	25	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	TPSAB1	46	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290988	GG	On-Demand	Anodyne	NPR	54	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	P2RY12	59	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CTRA_BOVIN	50	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	KLK3	75	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CTSB	57	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	PAPA1_CARPA	60	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CYSP_TRYCR	55	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CTSK	42	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CTSL	52	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CAPNS1	61	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CELA2A	43	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CTSS	20	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CAPN1	76	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	CAPN2	119	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	TGM2	25	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	TPSAB1	46	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872290989	GG	On-Demand	Anodyne	NPR	54	32
O=C(c1ccc(CCC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872291004	EJ	On-Demand	Anodyne	AVPR2	33	42
CCCOc1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872291015	CF	On-Demand	Anodyne	PLA2G4B	43	42
C[C@@H](Cc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872291019	CH	On-Demand	Anodyne	ACE	40	39
C[C@@H](Cc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872291019	CH	On-Demand	Anodyne	MME	52	39
C[C@@H](Cc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872291019	CH	On-Demand	Anodyne	ACE2	69	33
CC(C)(C)OC(=O)N1CCN(Cc2ncccn2)C(C)(C)CC1	ZINC000872291044	DF	On-Demand	Anodyne	GPR119	36	46
O=C(c1cc(Cl)ncc1Br)N1CCCCc2cccnc21	ZINC000872291048	FH	On-Demand	Anodyne	AVPR2	21	40
O=C1CCCCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872291063	EH	On-Demand	Anodyne	AVPR2	43	45
CCOC(=O)CC(C)(C)CC(=O)N1CCCCc2cccnc21	ZINC000872291077	DG	On-Demand	Anodyne	AVPR2	25	41
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872291081	GE	On-Demand	Anodyne	F2	18	41
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872291081	GE	On-Demand	Anodyne	HTR7	19	45
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872291081	GE	On-Demand	Anodyne	TRY2_BOVIN	65	41
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872291081	GE	On-Demand	Anodyne	HTR6	15	41
O=C(c1cnc(Cl)c(Br)c1)N1CCCCc2cccnc21	ZINC000872291088	FH	On-Demand	Anodyne	AVPR2	36	40
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1cccc(Cl)c1	ZINC000872291098	FD	On-Demand	Anodyne	HTR6	20	44
COc1ccccc1N1C[C@@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291102	ED	On-Demand	Anodyne	HTR1A	42	44
COc1ccccc1N1C[C@@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291102	ED	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1N1C[C@@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291102	ED	On-Demand	Anodyne	ADRA1D	33	42
COc1ccccc1N1C[C@@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291102	ED	On-Demand	Anodyne	HTR7	25	44
COc1ccccc1N1C[C@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291103	ED	On-Demand	Anodyne	HTR1A	42	44
COc1ccccc1N1C[C@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291103	ED	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1N1C[C@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291103	ED	On-Demand	Anodyne	ADRA1D	33	42
COc1ccccc1N1C[C@H](C(=O)N2CCNCCC2(C)C)CC1=O	ZINC000872291103	ED	On-Demand	Anodyne	HTR7	25	44
CC(C)(C)OC(=O)N1CCN(Cc2ccc(S(C)(=O)=O)o2)C(C)(C)CC1	ZINC000872291106	GF	On-Demand	Anodyne	GPR119	43	41
O=C(C1CCN(CC(F)(F)F)CC1)N1CCCCc2cccnc21	ZINC000872291110	EG	On-Demand	Anodyne	HPGDS	38	43
CC1(C)CCNCCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000872291113	DD	On-Demand	Bother	SLC27A4	49	32
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	ZINC000872291129	GE	On-Demand	Anodyne	SFRP1	109	35
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	ZINC000872291129	GE	On-Demand	Anodyne	WNT3	65	35
CC1(C)CCNCCN1C(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000872291135	EF	On-Demand	Anodyne	MMP13	21	43
CC1(C)CCNCCN1C(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000872291135	EF	On-Demand	Anodyne	MMP2	24	43
CC1(C)CCNCCN1C(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000872291135	EF	On-Demand	Anodyne	MMP10	22	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2cc(N3CCOCC3)ncn2)CC1	ZINC000872291141	GC	On-Demand	Anodyne	ADK	16	41
COCCNS(=O)(=O)c1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872291149	FC	On-Demand	Anodyne	AKR1C3	15	41
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000872291154	GE	On-Demand	Anodyne	MLNR	26	40
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000872291155	GE	On-Demand	Anodyne	MLNR	26	40
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872291170	FE	On-Demand	Anodyne	GRIN2B	15	44
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872291170	FE	On-Demand	Anodyne	C3AR1	39	43
CC1(C)CCNCCN1C(=O)Cc1ccc(-n2cnnn2)cc1	ZINC000872291175	DC	On-Demand	Anodyne	KCNJ1	68	52
CC1(C)CCNCCN1C(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872291176	DD	On-Demand	Anodyne	INHA	17	40
CC1(C)CCNCCN1C(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000872291177	DD	On-Demand	Anodyne	INHA	17	40
COc1cccc(SCC(=O)N2CCNCCC2(C)C)c1	ZINC000872291181	DE	On-Demand	Anodyne	MTNR1B	15	42
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	ZINC000872291190	GF	On-Demand	Anodyne	CFTR	40	32
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	ZINC000872291191	GF	On-Demand	Anodyne	CFTR	40	32
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCCc2cccnc21	ZINC000872291208	EH	On-Demand	Bother	AVPR2	40	41
CC1(C)CCNCCN1C(=O)CCNC(=O)c1ccc2ccccc2c1	ZINC000872291212	FF	On-Demand	Anodyne	DRD4	40	32
CC1(C)CCNCCN1C(=O)CCNC(=O)c1ccc2ccccc2c1	ZINC000872291212	FF	On-Demand	Anodyne	DRD3	16	41
CC1(C)CCNCCN1C(=O)CCNC(=O)c1ccc2ccccc2c1	ZINC000872291212	FF	On-Demand	Anodyne	PLD1	43	46
CC1(C)CCNCCN1C(=O)CCNC(=O)c1ccc2ccccc2c1	ZINC000872291212	FF	On-Demand	Anodyne	PLD2	68	46
Cc1ccc(NC(=O)N2CCN(C(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)CC2)cc1Cl	ZINC000872291237	GE	On-Demand	Anodyne	EPHX2	23	46
CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2cnccn2)C(C)(C)CC1	ZINC000872291246	FE	On-Demand	Anodyne	GPR119	28	45
CC1(C)CCNCCN1C(=O)Cc1ccc2ccccc2c1	ZINC000872291265	CF	On-Demand	Anodyne	FFAR2	68	33
CC1(C)CCNCCN1C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000872291270	GF	On-Demand	Anodyne	HTR6	18	44
CC1(C)CCNCCN1C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000872291270	GF	On-Demand	Anodyne	AKR1C3	33	42
Cc1oc(-c2ccccc2)nc1C(=O)N1CCNCCC1(C)C	ZINC000872291273	DF	On-Demand	Anodyne	PPARG	42	36
Cc1oc(-c2ccccc2)nc1C(=O)N1CCNCCC1(C)C	ZINC000872291273	DF	On-Demand	Anodyne	PPARA	43	37
Cc1oc(-c2ccccc2)nc1C(=O)N1CCNCCC1(C)C	ZINC000872291273	DF	On-Demand	Anodyne	PDE8B	51	31
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872291291	EG	On-Demand	Anodyne	SLC18A3	40	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872291291	EG	On-Demand	Anodyne	WNT3A	47	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872291291	EG	On-Demand	Anodyne	L3MBTL3	63	39
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000872291319	GE	On-Demand	Anodyne	CPT1A	93	34
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000872291319	GE	On-Demand	Anodyne	CPT2	40	32
Cc1cccc(NC(=O)NCC(=O)N2CCNCCC2(C)C)c1	ZINC000872291323	DD	On-Demand	Anodyne	CCKAR	23	42
Cc1cccc(NC(=O)NCC(=O)N2CCNCCC2(C)C)c1	ZINC000872291323	DD	On-Demand	Anodyne	CCKBR	35	40
N#CCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872291326	CG	On-Demand	Mild	AVPR2	39	44
COc1cccc(C(C)(C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872291334	DF	On-Demand	Anodyne	AMY2	45	31
COc1cccc(C(C)(C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872291334	DF	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(C(C)(C)CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872291334	DF	On-Demand	Anodyne	MTNR1B	36	41
O=C(NC1CC1)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872291357	EF	On-Demand	Anodyne	AVPR2	59	47
O=C(NC1CC1)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872291357	EF	On-Demand	Anodyne	AVPR1A	22	47
COc1cc(C)ccc1C(=O)N1CCCCc2cccnc21	ZINC000872291381	CG	On-Demand	Anodyne	AVPR2	40	43
O=C(c1cncnc1)N1CCCCc2cccnc21	ZINC000872291387	CD	On-Demand	Anodyne	AVPR2	34	42
O=C(c1cc(Br)ncc1Cl)N1CCCCc2cccnc21	ZINC000872291395	FH	On-Demand	Anodyne	AVPR2	25	43
O=C(c1cc(Br)ncc1Cl)N1CCCCc2cccnc21	ZINC000872291395	FH	On-Demand	Anodyne	GPBAR1	15	43
CSc1cc(C(=O)N2CCCCc3cccnc32)ccc1F	ZINC000872291435	DH	On-Demand	Anodyne	AVPR2	40	39
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872291436	GE	On-Demand	Anodyne	AKR1C3	52	40
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872291437	GE	On-Demand	Anodyne	AKR1C3	52	40
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872291441	GI	On-Demand	Anodyne	AVPR2	41	44
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000872291453	FD	On-Demand	Anodyne	CPT1A	132	40
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000872291453	FD	On-Demand	Anodyne	CPT2	50	38
CC1(C)CCNCCN1C(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000872291475	FD	On-Demand	Anodyne	SFRP1	96	36
CC1(C)CCNCCN1C(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000872291475	FD	On-Demand	Anodyne	WNT3	46	35
COc1ccc(C(=O)N2CCNCCC2(C)C)c(C)c1	ZINC000872291487	CE	On-Demand	Anodyne	MMP10	48	35
CC1(C)CCNCCN1C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	ZINC000872291519	GE	On-Demand	Anodyne	HTR1B	19	42
CC1(C)CCNCCN1C(=O)c1cccc(-n2cnnn2)c1	ZINC000872291521	DC	On-Demand	Anodyne	KCNJ1	40	34
CCCOc1cc(OC)ccc1C(=O)N1CCCCc2cccnc21	ZINC000872291541	EH	On-Demand	Anodyne	AVPR2	26	40
COc1ccc(O[C@H](C)C(=O)N2CCNCCC2(C)C)cc1	ZINC000872291544	DE	On-Demand	Anodyne	MMP10	42	38
COc1ccc(O[C@@H](C)C(=O)N2CCNCCC2(C)C)cc1	ZINC000872291545	DE	On-Demand	Anodyne	MMP10	42	38
CC(C)(C)OC(=O)N1CCN(Cc2cnsn2)C(C)(C)CC1	ZINC000872291550	EF	On-Demand	Anodyne	GPR119	28	40
CC1(C)CCNCCN1C(=O)c1cccc(C(F)(F)F)c1F	ZINC000872291563	DG	On-Demand	Anodyne	P2RX7	28	40
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872291565	GG	On-Demand	Anodyne	CHRM2	23	41
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872291565	GG	On-Demand	Anodyne	L3MBTL3	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872291572	FD	On-Demand	Anodyne	GRIN2B	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872291572	FD	On-Demand	Anodyne	CHRNA7	40	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872291572	FD	On-Demand	Anodyne	C3AR1	44	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872291572	FD	On-Demand	Anodyne	SCD	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872291572	FD	On-Demand	Anodyne	NAMPT	91	49
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000872291575	FE	On-Demand	Anodyne	L3MBTL3	52	39
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000872291577	FE	On-Demand	Anodyne	L3MBTL3	52	39
O=C(c1ccc(C(F)(F)F)c(F)c1)N1CCCCc2cccnc21	ZINC000872291597	EI	On-Demand	Anodyne	AVPR2	45	41
O=C(COc1cc(F)cc(F)c1)N1CCCCc2cccnc21	ZINC000872291616	DG	On-Demand	Anodyne	CPT1A	55	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2Nc2ccccc2)C1	ZINC000872291617	DG	On-Demand	Anodyne	AKR1C2	29	41
CC(C)(C)C(=O)NCc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872291618	GI	On-Demand	Anodyne	AVPR2	44	43
O=C1CCCN1c1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872291619	FH	On-Demand	Anodyne	AVPR2	20	44
Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCNCCC3(C)C)C2)cc1	ZINC000872291625	FE	On-Demand	Anodyne	L3MBTL3	52	39
O=C(c1ccc(Cl)c(F)c1)N1CCCCc2cccnc21	ZINC000872291629	DH	On-Demand	Anodyne	CNR1	49	31
O=C(c1ccc(Cl)c(F)c1)N1CCCCc2cccnc21	ZINC000872291629	DH	On-Demand	Anodyne	AVPR2	55	42
O=C(c1ccc(F)c(Cl)c1F)N1CCCCc2cccnc21	ZINC000872291631	DH	On-Demand	Anodyne	AVPR2	27	41
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000872291639	FG	On-Demand	Anodyne	HTR1F	41	38
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000872291639	FG	On-Demand	Anodyne	PRNP	48	36
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000872291639	FG	On-Demand	Anodyne	TAAR1	51	39
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000872291639	FG	On-Demand	Anodyne	KCNK3	103	51
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000872291639	FG	On-Demand	Anodyne	KCNK9	56	40
CCC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1F	ZINC000872291645	EH	On-Demand	Anodyne	AVPR2	47	41
CC1(C)CCNCCN1C(=O)Cc1ccc2c(c1)OCO2	ZINC000872291648	CD	On-Demand	Anodyne	FFAR2	56	36
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000872291660	FE	On-Demand	Anodyne	MMP10	47	35
CC1(C)CCNCCN1C(=O)CCCc1nc(-c2cccs2)no1	ZINC000872291674	EF	On-Demand	Anodyne	ETHR	56	43
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000872291682	FE	On-Demand	Anodyne	PREP	59	38
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000872291683	FE	On-Demand	Anodyne	PREP	59	38
O=C(COCc1cccnc1)N1CCCCc2cccnc21	ZINC000872291685	CE	On-Demand	Anodyne	CHRNA7	40	35
Cc1ncc(CN2CCN(C(=O)OC(C)(C)C)CCC2(C)C)cn1	ZINC000872291687	EG	On-Demand	Anodyne	GPR119	34	41
CC1(C)CCNCCN1C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000872291690	GE	On-Demand	Anodyne	EPHX2	84	49
O=C([C@@H]1C[C@H]1c1ccccc1)N1CCCCc2cccnc21	ZINC000872291693	CH	On-Demand	Anodyne	NAMPT	22	40
O=C(c1ccccc1OC1CC1)N1CCCCc2cccnc21	ZINC000872291716	DH	On-Demand	Anodyne	GPBAR1	24	43
CC(C)(C)OC(=O)N1CCN(C[C@@H]2CCN(S(C)(=O)=O)C2)C(C)(C)CC1	ZINC000872291725	GD	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CCN(C[C@H]2CCN(S(C)(=O)=O)C2)C(C)(C)CC1	ZINC000872291726	GD	On-Demand	Anodyne	GPR119	33	44
CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872291727	GF	On-Demand	Anodyne	OPRK1	29	41
CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872291729	GF	On-Demand	Anodyne	OPRK1	29	41
CC1(C)CCNCCN1C(=O)c1ccc(OCC(N)=O)cc1	ZINC000872291756	DC	On-Demand	Anodyne	PLA2G4B	40	33
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000872291789	FD	On-Demand	Anodyne	SFRP1	98	36
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000872291789	FD	On-Demand	Anodyne	WNT3	49	35
COC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)c(F)c1	ZINC000872291800	EF	On-Demand	Anodyne	AVPR2	48	41
O=C(Nc1cc(C(=O)N2CCCCc3cccnc32)ccn1)C1CC1	ZINC000872291801	EF	On-Demand	Anodyne	TYK2	67	43
Cc1ccnc2ccc(C(=O)N3CCCCc4cccnc43)cc12	ZINC000872291804	DH	On-Demand	Anodyne	AVPR2	42	39
Cc1ccc(N2CCCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)nn1	ZINC000872291805	ED	On-Demand	Anodyne	SCD1	15	45
CC1(C)CCNCCN1C(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000872291816	DD	On-Demand	Anodyne	LOX1.1	45	37
CC1(C)CCNCCN1C(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000872291816	DD	On-Demand	Anodyne	O49150_SOLTU	53	37
O=C(c1sccc1Cl)N1CCCCc2cccnc21	ZINC000872291823	CH	On-Demand	Anodyne	AVPR2	22	40
CC1(C)CCNCCN1C(=O)Cc1csc2ccccc12	ZINC000872291850	DG	On-Demand	Anodyne	FFAR2	96	49
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCCc2cccnc21	ZINC000872291856	EF	On-Demand	Anodyne	PREP	20	45
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCCc2cccnc21	ZINC000872291856	EF	On-Demand	Anodyne	GPR119	26	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000872291860	GE	On-Demand	Anodyne	ETHR	36	41
CC1(C)CCNCCN1C(=O)CCc1ccc(Cl)cc1	ZINC000872291862	CF	On-Demand	Anodyne	FFAR2	59	38
CC1(C)CCNCCN1C(=O)c1cccc2c[nH]nc12	ZINC000872291874	CD	On-Demand	Anodyne	PARP2	15	40
CN(C)c1cc(C(=O)N2CCCCc3cccnc32)nc2ccccc12	ZINC000872291957	EH	On-Demand	Anodyne	AVPR2	28	40
CC(C)(C)OC(=O)N1CCN(Cc2ccncc2C#N)C(C)(C)CC1	ZINC000872292000	EG	On-Demand	Mild	GPR119	49	59
CC1(C)CCNCCN1C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872292014	GD	On-Demand	Anodyne	EPHX2	20	46
CC1(C)CCNCCN1C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872292014	GD	On-Demand	Anodyne	TGM2	51	37
CC1(C)CCNCCN1C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872292014	GD	On-Demand	Anodyne	F13A1	61	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000872292017	ED	On-Demand	Anodyne	CACNA1H	34	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000872292017	ED	On-Demand	Anodyne	TRPM8	46	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1	ZINC000872292026	FE	On-Demand	Anodyne	EPHX2	23	41
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1-n1cnnn1	ZINC000872292087	FE	On-Demand	Anodyne	AVPR2	42	38
O=C(c1cc(Cl)ncc1Cl)N1CCCCc2cccnc21	ZINC000872292088	DH	On-Demand	Anodyne	AVPR2	29	44
O=C(c1cc(Cl)ncc1Cl)N1CCCCc2cccnc21	ZINC000872292088	DH	On-Demand	Anodyne	GPBAR1	28	45
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	RARA	17	42
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	FSHR	41	39
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	AVPR2	73	46
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	AVPR1A	43	46
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	PRNP	70	42
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	NOD2	41	35
CC1(C)CCNCCN1C(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000872292103	FG	On-Demand	Anodyne	KCNK3	55	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	DRD4	21	56
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	SIGMAR1	25	52
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	SSTR5	48	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	CHRNA7	46	36
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	C3AR1	50	48
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000872292104	EE	On-Demand	Anodyne	MCHR1	31	45
CC1(C)CCNCCN1C(=O)Cc1ccc(C(F)(F)F)cc1	ZINC000872292125	DF	On-Demand	Anodyne	FFAR2	56	45
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCCC1	ZINC000872292140	EG	On-Demand	Anodyne	KCNQ2	73	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCCC1	ZINC000872292140	EG	On-Demand	Anodyne	SCN2A	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCCC1	ZINC000872292140	EG	On-Demand	Anodyne	LNPEP	41	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1N1CCCCC1	ZINC000872292140	EG	On-Demand	Anodyne	SCN10A	15	44
CC(C)(C)OC(=O)NCc1cc(C(=O)N2CCCCc3cccnc32)ccn1	ZINC000872292154	GG	On-Demand	Anodyne	AVPR2	36	44
C[C@@H](Cc1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872292168	CE	On-Demand	Anodyne	ACE	42	37
C[C@@H](Cc1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872292168	CE	On-Demand	Anodyne	MME	54	37
C[C@@H](Cc1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872292168	CE	On-Demand	Anodyne	ACE2	55	33
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	HTR1D	27	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	HTR1B	22	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	HRH3	18	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	CCR3	53	38
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	EPHX2	19	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	MCHR1	21	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000872292177	EG	On-Demand	Anodyne	L3MBTL3	20	43
CC1(C)CCNCCN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000872292201	CD	On-Demand	Bother	CACNA1C	61	38
CC1(C)CCNCCN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000872292201	CD	On-Demand	Bother	CACNA1D	93	38
CC1(C)CCNCCN1C(=O)CCCOc1ccc(F)cc1	ZINC000872292211	DF	On-Demand	Anodyne	PLA2G4B	40	31
O=C(c1csc(Cl)c1)N1CCCCc2cccnc21	ZINC000872292214	CH	On-Demand	Anodyne	AVPR2	37	40
CC1(C)CCNCCN1C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	ZINC000872292218	ED	On-Demand	Anodyne	SCARB1	22	40
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N2CCCCc3cccnc32)c1	ZINC000872292224	FH	On-Demand	Anodyne	MTNR1B	18	41
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N2CCCCc3cccnc32)c1	ZINC000872292226	FH	On-Demand	Anodyne	MTNR1B	18	41
CC1(C)CCNCCN1C(=O)Cc1ccccc1C(F)(F)F	ZINC000872292250	DF	On-Demand	Anodyne	FFAR2	50	36
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872292254	EG	On-Demand	Anodyne	GPR119	52	47
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872292254	EG	On-Demand	Anodyne	SFRP1	15	40
CC(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1C	ZINC000872292271	DG	On-Demand	Anodyne	AVPR2	41	39
CC(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1C	ZINC000872292271	DG	On-Demand	Anodyne	G2YM83_BOTF4	63	38
O=C(c1ccc2c(c1)CCC=C2)N1CCCCc2cccnc21	ZINC000872292282	DI	On-Demand	Anodyne	AVPR2	31	41
NC(=O)c1ccc(CC(=O)N2CCCCc3cccnc32)cc1	ZINC000872292316	DE	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N(C)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872292318	DG	On-Demand	Anodyne	AVPR2	43	43
O=C(NCCOCC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872292324	FE	On-Demand	Anodyne	AVPR2	25	40
CC1(C)CCNCCN1C(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000872292336	DG	On-Demand	Anodyne	MAPKAPK2	26	41
Cc1nc2ccc(C(=O)N3CCCCc4cccnc43)cc2n1C	ZINC000872292339	DG	On-Demand	Anodyne	HPGD	42	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(Cc2cscn2)CC1	ZINC000872292369	EE	On-Demand	Anodyne	SCN5A	41	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1	ZINC000872292371	GG	On-Demand	Anodyne	EPHX2	23	45
Cn1cc(CCN2CCN(C(=O)OC(C)(C)C)CCC2(C)C)cn1	ZINC000872292377	EF	On-Demand	Anodyne	GPR119	29	40
COc1ccc2c(NC(=O)[C@@H]3CCCCC[C@@H]3N)n[nH]c2c1	ZINC000872292402	DE	On-Demand	Anodyne	GSK3B	15	45
COc1ccc2c(NC(=O)[C@@H]3CCCCC[C@@H]3N)n[nH]c2c1	ZINC000872292402	DE	On-Demand	Anodyne	GSK3A	41	45
COCCOc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872292403	FH	On-Demand	Anodyne	AVPR2	53	48
CC1(C)CCNCCN1C(=O)CCCCC(=O)c1ccccc1	ZINC000872292453	DG	On-Demand	Anodyne	CYP2J2	46	33
CC1(C)CCNCCN1C(=O)c1cccc(OC[C@@H]2CCCO2)c1	ZINC000872292460	EE	On-Demand	Anodyne	CHRNA10	41	39
CC1(C)CCNCCN1C(=O)c1cccc(OC[C@H]2CCCO2)c1	ZINC000872292473	EE	On-Demand	Anodyne	CHRNA10	41	39
CC1(C)CCNCCN1C(=O)c1cc(-c2ccccc2Cl)[nH]n1	ZINC000872292485	EF	On-Demand	Anodyne	ALPL	15	40
CCOc1ccccc1C(=O)NCCCC(=O)N1CCNCCC1(C)C	ZINC000872292486	FE	On-Demand	Anodyne	KCNA3	32	43
CCOc1ccccc1C(=O)NCCCC(=O)N1CCNCCC1(C)C	ZINC000872292486	FE	On-Demand	Anodyne	HCN1	94	55
CCOc1ccccc1C(=O)NCCCC(=O)N1CCNCCC1(C)C	ZINC000872292486	FE	On-Demand	Anodyne	HCN4	66	44
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872292491	GI	On-Demand	Anodyne	AVPR2	35	44
COc1ccc2c(C)c(CCC(=O)N3CCNCCC3(C)C)c(=O)oc2c1	ZINC000872292495	FF	On-Demand	Anodyne	MAOB	32	45
COc1ccc2c(C)c(CCC(=O)N3CCNCCC3(C)C)c(=O)oc2c1	ZINC000872292495	FF	On-Demand	Anodyne	NQO1	30	44
O=C(c1cc(C(F)(F)F)cnc1Cl)N1CCCCc2cccnc21	ZINC000872292513	FI	On-Demand	Anodyne	TRPV1	25	42
COc1cccc(OCC(=O)N2CCNCCC2(C)C)c1	ZINC000872292534	CD	On-Demand	Anodyne	CPT1A	52	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cccc(-c2ncco2)c1	ZINC000872292537	CG	On-Demand	Anodyne	TYK2	42	33
CC1(C)CCNCCN1C(=O)CCCOCc1ccccc1	ZINC000872292540	DF	On-Demand	Anodyne	SLC12A5	64	35
CC1(C)CCNCCN1C(=O)[C@H]1COc2ccc(Cl)cc2C1	ZINC000872292543	DE	On-Demand	Anodyne	ROCK2	20	43
CC1(C)CCNCCN1C(=O)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000872292544	DE	On-Demand	Anodyne	ROCK2	20	43
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)NC1CC1	ZINC000872292551	GD	On-Demand	Anodyne	ADRA1D	22	41
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)NC1CC1	ZINC000872292551	GD	On-Demand	Anodyne	ADRA1A	15	41
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)NC1CC1	ZINC000872292551	GD	On-Demand	Anodyne	ADRA1B	17	41
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1S(=O)(=O)NC1CC1	ZINC000872292551	GD	On-Demand	Anodyne	SFRP1	48	33
O=C(NC1CCC(C(=O)N2CCCCc3cccnc32)CC1)C1CC1	ZINC000872292554	EF	On-Demand	Anodyne	EPHX2	23	40
COCCNS(=O)(=O)c1ccc(C(=O)N2CCNCCC2(C)C)cc1	ZINC000872292562	FC	On-Demand	Anodyne	MMP10	44	35
CC(C)(C#N)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872292572	DH	On-Demand	Mild	AVPR2	34	41
C[C@@H](CC(=O)N1CCCCc2cccnc21)c1c[nH]c2ccccc12	ZINC000872292578	EI	On-Demand	Anodyne	SSTR2	48	32
O=C(c1ccc(COC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872292582	FI	On-Demand	Anodyne	AVPR2	34	42
CC1(C)CCNCCN1C(=O)CCc1nc(-c2cccs2)no1	ZINC000872292588	EE	On-Demand	Anodyne	ETHR	57	44
CC(C)(C)OC(=O)N1CCN(Cc2ncc(C3CC3)o2)C(C)(C)CC1	ZINC000872292593	EH	On-Demand	Anodyne	GPR119	45	42
CC1(C)CCNCCN1C(=O)Cc1noc2ccccc12	ZINC000872292600	CD	On-Demand	Anodyne	FFAR2	55	33
O=C(C1CCN(C2CC2)CC1)N1CCCCc2cccnc21	ZINC000872292610	CF	On-Demand	Anodyne	L3MBTL3	60	35
CC1(C)CCNCCN1C(=O)COc1cccc(N2CCCC2=O)c1	ZINC000872292632	ED	On-Demand	Anodyne	CPT1A	39	46
O=C(c1cc(C2CC2)cnc1Cl)N1CCCCc2cccnc21	ZINC000872292634	EH	On-Demand	Anodyne	GPBAR1	17	41
O=C(c1ccoc1Cl)N1CCCCc2cccnc21	ZINC000872292648	CG	On-Demand	Anodyne	AVPR2	22	41
COc1ccccc1-n1ncc(C(=O)N2CCCCc3cccnc32)c1C	ZINC000872292656	FH	On-Demand	Anodyne	HTR1A	15	44
COc1ccccc1-n1ncc(C(=O)N2CCCCc3cccnc32)c1C	ZINC000872292656	FH	On-Demand	Anodyne	GPBAR1	23	42
CC(C)(C)OC(=O)N1CCN(CCCn2ccnc2)C(C)(C)CC1	ZINC000872292658	EF	On-Demand	Anodyne	TBXAS1	24	41
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000872292667	FF	On-Demand	Anodyne	EPHX2	22	41
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000872292668	FF	On-Demand	Anodyne	EPHX2	22	41
CC1(C)CCNCCN1C(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872292675	GE	On-Demand	Anodyne	TGM2	22	42
CC1(C)CCNCCN1C(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872292675	GE	On-Demand	Anodyne	F13A1	27	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000872292676	EC	On-Demand	Anodyne	L3MBTL3	64	43
O=C1c2ccccc2C(=O)N1CCCCC(=O)N1CCCCc2cccnc21	ZINC000872292683	GG	On-Demand	Anodyne	CHRM2	20	45
O=C([C@@H]1CCN(CC(F)(F)F)C1)N1CCCCc2cccnc21	ZINC000872292689	EF	On-Demand	Anodyne	HPGDS	35	40
O=C([C@H]1CCN(CC(F)(F)F)C1)N1CCCCc2cccnc21	ZINC000872292690	EF	On-Demand	Anodyne	HPGDS	35	40
CC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1C	ZINC000872292691	DH	On-Demand	Anodyne	AVPR2	82	47
CC(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1C	ZINC000872292691	DH	On-Demand	Anodyne	AVPR1A	25	47
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccs2)c1	ZINC000872292698	FG	On-Demand	Anodyne	KCNK3	57	50
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccs2)c1	ZINC000872292698	FG	On-Demand	Anodyne	KCNK9	35	50
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1-n1ccnc1	ZINC000872292705	DE	On-Demand	Anodyne	NOS2	64	33
O=C(C1Cc2ccccc2C1)N1CCCCc2cccnc21	ZINC000872292720	CG	On-Demand	Anodyne	FAAH	17	43
O=C(Cc1ccc(Cl)c(F)c1)N1CCCCc2cccnc21	ZINC000872292725	DH	On-Demand	Anodyne	OPRK1	25	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000872292730	FD	On-Demand	Anodyne	L3MBTL3	57	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000872292730	FD	On-Demand	Anodyne	HPGD	43	36
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)C2CC2)c1	ZINC000872292786	DE	On-Demand	Anodyne	EPHX2	18	45
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1C1CC1	ZINC000872292819	DH	On-Demand	Anodyne	AVPR2	53	38
O=C(c1ccc(-c2noc(C(F)F)n2)cc1)N1CCCCc2cccnc21	ZINC000872292824	FI	On-Demand	Anodyne	AVPR2	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000872292835	GG	On-Demand	Anodyne	EPHX2	20	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccccc1O	ZINC000872292836	CD	On-Demand	Anodyne	MTNR1A	15	40
CC1(C)CCNCCN1C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000872292850	FD	On-Demand	Anodyne	SFRP1	69	34
Cn1cc(CN2CCN(C(=O)OC(C)(C)C)CCC2(C)C)nn1	ZINC000872292866	DE	On-Demand	Anodyne	KDM1A	17	41
O=C(c1ccc(O[C@@H]2CCOC2)cc1)N1CCCCc2cccnc21	ZINC000872292895	EG	On-Demand	Anodyne	AVPR2	19	40
O=C(c1ccc(O[C@@H]2CCOC2)cc1)N1CCCCc2cccnc21	ZINC000872292895	EG	On-Demand	Anodyne	CPT2	16	40
O=C(c1ccc(O[C@H]2CCOC2)cc1)N1CCCCc2cccnc21	ZINC000872292896	EG	On-Demand	Anodyne	AVPR2	19	40
O=C(c1ccc(O[C@H]2CCOC2)cc1)N1CCCCc2cccnc21	ZINC000872292896	EG	On-Demand	Anodyne	CPT2	16	40
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	DRD4	15	44
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	AVPR2	43	44
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	LTA4H	21	42
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	HRH3	24	45
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	SIGMAR1	15	43
O=C(c1ccc(CN2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872292902	EI	On-Demand	Anodyne	NOD2	42	36
Cn1nc(CC(=O)N2CCNCCC2(C)C)c2ccccc2c1=O	ZINC000872292935	ED	On-Demand	Anodyne	IMDH_CRYPV	29	44
CC(C)(C)OC(=O)N1CCN(Cc2ccnc(N)c2)C(C)(C)CC1	ZINC000872292939	EF	On-Demand	Anodyne	GPR119	45	42
O=C(C1CCC(C(F)(F)F)CC1)N1CCCCc2cccnc21	ZINC000872292945	EI	On-Demand	Anodyne	TRPV1	15	40
Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCNCCC1(C)C	ZINC000872292946	EF	On-Demand	Anodyne	FFAR2	43	31
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA2	64	46
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA1	60	42
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA7	35	40
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA4	45	40
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA12	40	42
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	CA9	47	40
CC1(C)CCNCCN1C(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000872292948	EC	On-Demand	Anodyne	NCE103	18	46
CC1(C)CCNCCN1C(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	ZINC000872292956	FC	On-Demand	Anodyne	SLC12A5	48	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCCN(C(=O)Nc3ccc(Cl)cc3)CC2)C1	ZINC000872292969	GF	On-Demand	Anodyne	EPHX2	24	45
O=C(c1cccc(Cn2ccnc2)c1)N1CCCCc2cccnc21	ZINC000872292973	EG	On-Demand	Anodyne	CYP19A1	15	52
O=C(c1cccc(Cn2ccnc2)c1)N1CCCCc2cccnc21	ZINC000872292973	EG	On-Demand	Anodyne	CYP11B1	46	44
O=C(c1cccc(Cn2ccnc2)c1)N1CCCCc2cccnc21	ZINC000872292973	EG	On-Demand	Anodyne	TBXAS1	30	49
O=C(c1cccc(Cn2ccnc2)c1)N1CCCCc2cccnc21	ZINC000872292973	EG	On-Demand	Anodyne	CYP11B2	23	41
O=C(c1ccc(S(=O)(=O)CC2CC2)cc1)N1CCCCc2cccnc21	ZINC000872292989	FG	On-Demand	Anodyne	AVPR2	30	41
CC1(C)CCNCCN1C(=O)COc1cccc(C(F)(F)F)c1	ZINC000872293020	EF	On-Demand	Anodyne	CPT1A	27	42
CC1(C)CCNCCN1C(=O)COc1cccc(C(F)(F)F)c1	ZINC000872293020	EF	On-Demand	Anodyne	PDS	42	38
CC1(C)CCNCCN1C(=O)Cc1ccc2c(c1)OCCO2	ZINC000872293021	DD	On-Demand	Anodyne	FFAR2	46	37
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccc(F)cc2)CCN1	ZINC000872293028	FC	On-Demand	Anodyne	ABCB1	16	43
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccc(F)cc2)CCN1	ZINC000872293029	FC	On-Demand	Anodyne	ABCB1	16	43
CCCOc1ccc(OCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293054	DE	On-Demand	Anodyne	PLA2G4B	92	39
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872293055	FH	On-Demand	Bother	TRPV1	20	41
CC(C)(C)OC(=O)N1CCN(Cc2ccc(C#N)o2)C(C)(C)CC1	ZINC000872293063	EG	On-Demand	Mild	GPR119	26	41
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCNCCC1(C)C	ZINC000872293068	EE	On-Demand	Anodyne	CCR1	60	44
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCNCCC1(C)C	ZINC000872293068	EE	On-Demand	Anodyne	UTS2	40	32
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCNCCC1(C)C	ZINC000872293069	EE	On-Demand	Anodyne	CCR1	60	44
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCNCCC1(C)C	ZINC000872293069	EE	On-Demand	Anodyne	UTS2	40	32
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293106	FD	On-Demand	Anodyne	DRD4	26	46
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293106	FD	On-Demand	Anodyne	TPP2	48	32
CCOc1ccccc1OCCCC(=O)N1CCNCCC1(C)C	ZINC000872293115	EF	On-Demand	Anodyne	HCN1	52	43
CCOc1ccccc1OCCCC(=O)N1CCNCCC1(C)C	ZINC000872293115	EF	On-Demand	Anodyne	HCN4	42	33
CC(C)(C)OC(=O)N1CCN(Cc2cn(C[C@@H]3CCOC3)nn2)C(C)(C)CC1	ZINC000872293117	GF	On-Demand	Anodyne	KDM1A	18	40
CC(C)(C)OC(=O)N1CCN(Cc2cn(C[C@H]3CCOC3)nn2)C(C)(C)CC1	ZINC000872293118	GF	On-Demand	Anodyne	KDM1A	18	40
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC000872293138	FE	On-Demand	Anodyne	CCR2	44	38
N#Cc1ccc(C(=O)N2CCCCc3cccnc32)o1	ZINC000872293145	CF	On-Demand	Mild	CSF1R	16	41
CCOc1ccc(OCCCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293150	EF	On-Demand	Anodyne	PLA2G4B	71	34
O=C(c1cc(F)ccc1Cl)N1CCCCc2cccnc21	ZINC000872293152	DH	On-Demand	Anodyne	AVPR2	48	44
C[C@H](c1ccc(C(=O)N2CCCCc3cccnc32)cc1)C(F)(F)F	ZINC000872293153	EJ	On-Demand	Anodyne	AVPR2	35	41
C[C@@H](c1ccc(C(=O)N2CCCCc3cccnc32)cc1)C(F)(F)F	ZINC000872293154	EJ	On-Demand	Anodyne	AVPR2	35	41
CC1(C)CCNCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000872293162	CD	On-Demand	Bother	SLC27A4	47	30
CC1(C)CCNCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000872293162	CD	On-Demand	Bother	KCNJ1	29	41
CC(=O)Nc1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872293216	CD	On-Demand	Anodyne	KCNK3	43	33
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000872293219	GF	On-Demand	Anodyne	L3MBTL3	49	38
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000872293220	GF	On-Demand	Anodyne	L3MBTL3	49	38
CC1(C)CCNCCN1C(=O)c1ccc(-n2cnnn2)cc1	ZINC000872293236	DC	On-Demand	Anodyne	KCNJ1	42	40
Cn1ncc(C(=O)N2CCCCc3cccnc32)c1Cl	ZINC000872293242	CE	On-Demand	Anodyne	AVPR2	27	42
COc1ccc(OCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293258	CD	On-Demand	Anodyne	MMP10	41	37
CC(=O)c1cccc(OCC(=O)N2CCNCCC2(C)C)c1	ZINC000872293261	DD	On-Demand	Anodyne	CPT1A	53	36
CC(=O)Nc1ccccc1C(F)(F)C(=O)N1CCCCc2cccnc21	ZINC000872293269	FH	On-Demand	Anodyne	TRPV1	21	41
CC(C)(C)OC(=O)N1CCN(C[C@@H]2CCc3ncnn32)C(C)(C)CC1	ZINC000872293300	EE	On-Demand	Anodyne	GPR119	40	37
CC(C)(C)OC(=O)N1CCN(C[C@H]2CCc3ncnn32)C(C)(C)CC1	ZINC000872293301	EE	On-Demand	Anodyne	GPR119	40	37
CCOc1ccc(S(=O)(=O)NCCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293303	GD	On-Demand	Anodyne	MMP10	71	33
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872293304	DD	On-Demand	Anodyne	CCR1	22	45
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872293305	DD	On-Demand	Anodyne	CCR1	22	45
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1Cl	ZINC000872293307	DH	On-Demand	Anodyne	AVPR2	58	40
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1Cl	ZINC000872293307	DH	On-Demand	Anodyne	AVPR1A	18	40
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000872293315	GD	On-Demand	Anodyne	CACNA1B	49	38
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000872293315	GD	On-Demand	Anodyne	CCR2	46	35
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000872293315	GD	On-Demand	Anodyne	SFRP1	45	36
CC1(C)CCNCCN1C(=O)COc1ccc2ccc(=O)oc2c1	ZINC000872293319	ED	On-Demand	Anodyne	MAOA	40	39
CC1(C)CCNCCN1C(=O)COc1ccc2ccc(=O)oc2c1	ZINC000872293319	ED	On-Demand	Anodyne	MAOB	17	42
COc1ccc(OCCCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293323	DE	On-Demand	Anodyne	PLA2G4B	44	31
CC(=O)c1ccccc1OCCN1CCNC(=O)CC12CCOCC2	ZINC000872293325	ED	On-Demand	Anodyne	HCN1	44	37
O=C1CC2(CCOCC2)N(CC(=O)N2CCC(Cc3ccccc3)CC2)CCN1	ZINC000872293348	GD	On-Demand	Anodyne	GRIN2B	75	42
C[C@@H]1Cc2cccc(C(=O)N3CCCCc4cccnc43)c2O1	ZINC000872293357	DG	On-Demand	Anodyne	G2YM83_BOTF4	41	35
C[C@H]1Cc2cccc(C(=O)N3CCCCc4cccnc43)c2O1	ZINC000872293358	DG	On-Demand	Anodyne	G2YM83_BOTF4	41	35
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1O	ZINC000872293371	CF	On-Demand	Anodyne	KCNMA1	26	47
O=C(c1ccc(S(=O)(=O)C2CC2)cc1)N1CCCCc2cccnc21	ZINC000872293384	FG	On-Demand	Anodyne	AVPR2	29	44
CCOc1ccc(OCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293398	DE	On-Demand	Anodyne	PLA2G4B	55	33
COc1cccc(OCCC(=O)N2CCCCc3cccnc32)c1	ZINC000872293400	EG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2CCCCc3cccnc32)c1	ZINC000872293400	EG	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc(OCCC(=O)N2CCCCc3cccnc32)c1	ZINC000872293400	EG	On-Demand	Anodyne	MTNR1B	27	40
CC(C)(C)OC(=O)N1CCN(CCc2cnccn2)C(C)(C)CC1	ZINC000872293404	EF	On-Demand	Anodyne	GPR119	29	46
CCCOc1ccc(C(=O)CCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293419	EG	On-Demand	Anodyne	PLA2G4B	63	36
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872293423	FG	On-Demand	Anodyne	AVPR2	59	40
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872293423	FG	On-Demand	Anodyne	AVPR1A	15	40
CC1(C)CCNCCN1C(=O)c1ccc(COc2ccccc2)cc1	ZINC000872293424	EG	On-Demand	Anodyne	MMP10	19	42
CC1(C)CCNCCN1C(=O)c1ccc(COc2ccccc2)cc1	ZINC000872293424	EG	On-Demand	Anodyne	SLC12A5	51	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293433	GC	On-Demand	Anodyne	CAPN1	44	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293433	GC	On-Demand	Anodyne	PSMB8	52	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293434	GC	On-Demand	Anodyne	CAPN1	44	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCNC(=O)CC12CCOCC2	ZINC000872293434	GC	On-Demand	Anodyne	PSMB8	52	41
O=C1CCCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872293436	DH	On-Demand	Anodyne	CNR1	50	31
O=C1CCCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872293436	DH	On-Demand	Anodyne	AVPR2	40	44
C#CCCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872293439	DG	On-Demand	Mild	AVPR2	24	41
CC1(C)CCNCCN1C(=O)CCCOc1ccccc1	ZINC000872293450	CE	On-Demand	Anodyne	PLA2G4B	72	33
CN(CC(=O)N1CCNCCC1(C)C)S(=O)(=O)c1ccc(Cl)cc1	ZINC000872293456	FD	On-Demand	Anodyne	FFAR2	42	33
Cc1oc(-c2ccccc2)nc1CN1CCNC(=O)CC12CCOCC2	ZINC000872293481	FF	On-Demand	Anodyne	PPARG	60	42
Cc1oc(-c2ccccc2)nc1CN1CCNC(=O)CC12CCOCC2	ZINC000872293481	FF	On-Demand	Anodyne	PPARA	63	38
Cc1oc(-c2ccccc2)nc1CN1CCNC(=O)CC12CCOCC2	ZINC000872293481	FF	On-Demand	Anodyne	PDE8B	65	43
O=C1CC2(CCOCC2)N(C[C@H](O)COc2ccccc2)CCN1	ZINC000872293484	EC	On-Demand	Anodyne	ABCB1	44	40
O=C1CC2(CCOCC2)N(C[C@@H](O)COc2ccccc2)CCN1	ZINC000872293485	EC	On-Demand	Anodyne	ABCB1	44	40
O=C([C@@H]1C[C@H]1c1cccnc1)N1CCCCc2cccnc21	ZINC000872293488	CF	On-Demand	Anodyne	NAMPT	29	46
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1S(C)(=O)=O	ZINC000872293497	FE	On-Demand	Anodyne	AVPR2	40	37
Cn1cnc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872293508	DF	On-Demand	Anodyne	HPGD	55	43
O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872293518	FH	On-Demand	Bother	AVPR2	21	40
O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872293518	FH	On-Demand	Bother	TRPV1	15	49
O=C(C[C@H]1COc2ccccc2O1)N1CCCCc2cccnc21	ZINC000872293521	DF	On-Demand	Anodyne	ADRA2B	20	46
O=C(C[C@H]1COc2ccccc2O1)N1CCCCc2cccnc21	ZINC000872293521	DF	On-Demand	Anodyne	ADRA2C	15	43
O=C(C[C@@H]1COc2ccccc2O1)N1CCCCc2cccnc21	ZINC000872293522	DF	On-Demand	Anodyne	ADRA2B	20	46
O=C(C[C@@H]1COc2ccccc2O1)N1CCCCc2cccnc21	ZINC000872293522	DF	On-Demand	Anodyne	ADRA2C	15	43
CC1(C)CCNCCN1C(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872293524	GE	On-Demand	Anodyne	NAMPT	36	41
CC(=O)c1ccc(OCCCC(=O)N2CCNCCC2(C)C)cc1	ZINC000872293532	EF	On-Demand	Anodyne	PLA2G4B	55	34
CCCOc1ccc(C(=O)N2CCCCc3cccnc32)c(OC)c1	ZINC000872293550	EH	On-Demand	Anodyne	AVPR2	23	42
CC1(C)CCNCCN1C(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000872293551	GD	On-Demand	Anodyne	EPHX2	22	49
CCOc1ccccc1OCC(=O)N1CCNCCC1(C)C	ZINC000872293553	DE	On-Demand	Anodyne	HCN1	54	45
CCOc1ccccc1OCC(=O)N1CCNCCC1(C)C	ZINC000872293553	DE	On-Demand	Anodyne	HCN4	44	34
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1	ZINC000872293556	FE	On-Demand	Anodyne	SLC6A2	16	42
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1	ZINC000872293556	FE	On-Demand	Anodyne	SLC6A4	15	42
CC1(C)CCNCCN1C(=O)CNC(=O)COc1ccccc1	ZINC000872293566	DC	On-Demand	Anodyne	CPT1A	77	35
CC1(C)CCNCCN1C(=O)CCCNC(=O)c1ccc(Cl)cc1	ZINC000872293573	FE	On-Demand	Anodyne	DRD3	20	40
O=C(c1cccc(OC(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872293580	EH	On-Demand	Anodyne	AVPR2	27	41
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000872293584	DD	On-Demand	Anodyne	EPHX2	19	42
CC1(C)CCNCCN1C(=O)Cc1ccc(-n2cccn2)cc1	ZINC000872293592	DE	On-Demand	Anodyne	AMP1_PLAFQ	53	38
O=C(c1ccnc(Br)c1)N1CCCCc2cccnc21	ZINC000872293599	EG	On-Demand	Anodyne	AVPR2	32	40
O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872293604	FH	On-Demand	Bother	AVPR2	15	42
CC1(C)CCNCCN1C(=O)COCCOc1ccccc1	ZINC000872293605	DD	On-Demand	Anodyne	CPT1A	40	32
CC1(C)CCNCCN1C(=O)COCCOc1ccccc1	ZINC000872293605	DD	On-Demand	Anodyne	PLA2G4B	54	32
CC1(C)CCNCCN1C(=O)CCCc1ccc(Cl)cc1	ZINC000872293624	DG	On-Demand	Anodyne	FFAR2	76	41
CN(C)C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872293627	FH	On-Demand	Anodyne	AVPR2	81	53
CN(C)C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872293627	FH	On-Demand	Anodyne	AVPR1A	19	41
CN(C)C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872293627	FH	On-Demand	Anodyne	GRM4	49	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000872293629	EE	On-Demand	Anodyne	CACNA1I	46	33
Cc1ccccc1[C@H](CC(=O)N1CCNCCC1(C)C)NC(N)=O	ZINC000872293637	ED	On-Demand	Anodyne	CTSA	61	37
Cc1ccccc1[C@@H](CC(=O)N1CCNCCC1(C)C)NC(N)=O	ZINC000872293638	ED	On-Demand	Anodyne	CTSA	61	37
O=C(c1cccc(C(F)(F)F)c1F)N1CCCCc2cccnc21	ZINC000872293654	EI	On-Demand	Anodyne	TRPV1	27	40
O=C(c1cccc(C(F)(F)F)c1F)N1CCCCc2cccnc21	ZINC000872293654	EI	On-Demand	Anodyne	P2RX7	28	46
C[C@H]1CC[C@H](CC(=O)N2CCCCc3cccnc32)C1	ZINC000872293667	CH	On-Demand	Anodyne	PREP	15	41
C[C@H]1CC[C@@H](CC(=O)N2CCCCc3cccnc32)C1	ZINC000872293669	CH	On-Demand	Anodyne	PREP	15	41
COc1cc(C)c(C(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872293679	EG	On-Demand	Anodyne	AVPR2	50	38
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293694	EH	On-Demand	Anodyne	AVPR2	69	48
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293694	EH	On-Demand	Anodyne	AVPR1A	18	43
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293694	EH	On-Demand	Anodyne	TRPV1	16	48
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293694	EH	On-Demand	Anodyne	GRM4	55	38
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293694	EH	On-Demand	Anodyne	GPBAR1	22	46
CC(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293712	CG	On-Demand	Anodyne	AVPR2	40	40
CC1(C)CCNCCN1C(=O)c1cn(-c2ccccc2)nn1	ZINC000872293719	CD	On-Demand	Anodyne	ESRRA	23	42
CC1(C)CCNCCN1C(=O)Cc1ccc(F)c(Br)c1	ZINC000872293725	EF	On-Demand	Anodyne	FFAR2	55	35
COCCOc1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872293729	DD	On-Demand	Anodyne	DRD4	41	31
COc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1C	ZINC000872293744	EG	On-Demand	Anodyne	PPARD	41	38
O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872293760	GH	On-Demand	Bother	AVPR2	18	41
CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872293765	EF	On-Demand	Anodyne	AMY2	44	31
CC1(C)CCNCCN1C(=O)CCOCc1ccccc1	ZINC000872293766	CE	On-Demand	Anodyne	SLC12A5	68	36
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)NC2CC2)c1	ZINC000872293770	EE	On-Demand	Anodyne	EPHX2	46	45
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)NC2CC2)c1	ZINC000872293770	EE	On-Demand	Anodyne	CXCR3	15	47
O=C(CCc1ccc(F)cc1F)N1CCCCc2cccnc21	ZINC000872293775	DH	On-Demand	Anodyne	HTR2A	20	41
O=C(c1ccc(F)c(Cl)c1)N1CCCCc2cccnc21	ZINC000872293805	DH	On-Demand	Anodyne	CNR1	49	31
O=C(c1ccc(F)c(Cl)c1)N1CCCCc2cccnc21	ZINC000872293805	DH	On-Demand	Anodyne	AVPR2	57	44
O=C(c1ccc(F)c(Cl)c1)N1CCCCc2cccnc21	ZINC000872293805	DH	On-Demand	Anodyne	AVPR1A	15	42
CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2ccccn2)C(C)(C)CC1	ZINC000872293809	GE	On-Demand	Anodyne	GPR119	28	43
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1cccnc1	ZINC000872293822	EE	On-Demand	Anodyne	DRD4	40	31
CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2cccnc2)C(C)(C)CC1	ZINC000872293836	GE	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2cccnc2)C(C)(C)CC1	ZINC000872293836	GE	On-Demand	Anodyne	NAMPT	51	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCN(C3CC3)c3ccccc32)C1	ZINC000872293837	CE	On-Demand	Anodyne	GPBAR1	43	42
CC(C)(C)OC(=O)N1CCN(Cc2cccnc2)C(C)(C)CC1	ZINC000872293851	DG	On-Demand	Anodyne	GPR119	34	44
O=C(c1cccc(Cl)c1F)N1CCCCc2cccnc21	ZINC000872293870	DH	On-Demand	Anodyne	AVPR2	34	43
O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872293873	EH	On-Demand	Bother	AVPR2	21	40
COc1ccc(C(=O)N2CCCCc3cccnc32)c(C)c1	ZINC000872293887	CG	On-Demand	Anodyne	AVPR2	46	42
O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872293933	FH	On-Demand	Bother	TRPV1	16	43
COCCCOc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293935	EG	On-Demand	Anodyne	DRD4	41	32
COCCCOc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872293935	EG	On-Demand	Anodyne	AVPR2	37	43
CC1(C)CCNCCN1C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872293941	GE	On-Demand	Anodyne	MMP13	29	41
CC1(C)CCNCCN1C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872293941	GE	On-Demand	Anodyne	MMP2	16	41
CC1(C)CCNCCN1C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872293941	GE	On-Demand	Anodyne	PLA2G4B	44	31
CC1(C)CCNCCN1C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872293941	GE	On-Demand	Anodyne	MMP9	17	41
CC1(C)CCNCCN1C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872293941	GE	On-Demand	Anodyne	MMP10	59	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1N1CCOCC1	ZINC000872293958	FF	On-Demand	Anodyne	F2	22	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1N1CCOCC1	ZINC000872293958	FF	On-Demand	Anodyne	P2RX7	31	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1N1CCOCC1	ZINC000872293958	FF	On-Demand	Anodyne	SCN10A	15	42
Cc1cc(F)ccc1CN(C)C(=O)[C@@H]1CCCCC[C@@H]1N	ZINC000872293964	CG	On-Demand	Anodyne	TACR1	22	40
O=C(Cc1ccc(F)c(F)c1)N1CCCCc2cccnc21	ZINC000872293980	DG	On-Demand	Anodyne	ABCC1	60	37
CC(C)(C)OC(=O)N1CCN(Cc2ccncc2)C(C)(C)CC1	ZINC000872293990	DG	On-Demand	Anodyne	GPR119	41	52
O=C(c1ccc2nnnn2c1)N1CCCCc2cccnc21	ZINC000872293994	CD	On-Demand	Anodyne	AVPR2	20	40
COC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1F	ZINC000872294005	EF	On-Demand	Anodyne	AVPR2	63	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCCc2cccnc21	ZINC000872294006	GG	On-Demand	Anodyne	GRPR	55	32
CC1(C)CCNCCN1C(=O)COc1cccc(NC(=O)C2CC2)c1	ZINC000872294012	EE	On-Demand	Anodyne	CPT1A	88	40
CC1(C)CCNCCN1C(=O)COc1cccc(NC(=O)C2CC2)c1	ZINC000872294012	EE	On-Demand	Anodyne	EPHX2	24	44
CC1(C)CCNCCN1C(=O)COc1cccc(NC(=O)C2CC2)c1	ZINC000872294012	EE	On-Demand	Anodyne	LIMK2	25	40
O=C(c1cc(F)cc(Cl)c1)N1CCCCc2cccnc21	ZINC000872294015	DH	On-Demand	Anodyne	AVPR2	36	41
Cc1cc(F)ccc1C(=O)N1CCCCc2cccnc21	ZINC000872294029	CH	On-Demand	Anodyne	AVPR2	62	44
CC1(C)CCNCCN1C(=O)COc1cccc(NC(=O)c2ccco2)c1	ZINC000872294030	FF	On-Demand	Anodyne	KISS1R	54	36
O=C(Cc1ccc(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872294032	DH	On-Demand	Anodyne	P2RX7	58	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000872294052	DD	On-Demand	Anodyne	L3MBTL3	42	35
CC(C)(C)OC(=O)N1CCN(CC#N)C(C)(C)CC1	ZINC000872294054	CE	On-Demand	Mild	GPR119	22	40
O=C(c1ccc(F)c(F)c1F)N1CCCCc2cccnc21	ZINC000872294063	DG	On-Demand	Anodyne	AVPR2	31	40
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCCCc2cccnc21	ZINC000872294067	GG	On-Demand	Anodyne	AVPR2	29	41
CC1(C)CCNCCN1C(=O)COCCc1ccccc1	ZINC000872294078	CD	On-Demand	Anodyne	SLC12A5	48	34
O=C(CCC(F)(F)F)N1CCCCc2cccnc21	ZINC000872294088	CG	On-Demand	Anodyne	ETHR	43	33
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA2	64	41
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA1	59	40
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA7	43	38
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA5B	45	38
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA4	40	38
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA5A	47	38
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA12	41	40
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	MMP10	42	32
CC1(C)CCNCCN1C(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000872294116	EC	On-Demand	Anodyne	CA9	45	41
Cc1cc(-n2cncn2)ccc1C(=O)N1CCCCc2cccnc21	ZINC000872294120	EF	On-Demand	Anodyne	AVPR2	36	44
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1N1CCNC1=O	ZINC000872294130	FF	On-Demand	Anodyne	AVPR2	43	38
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000872294135	EG	On-Demand	Anodyne	AMY2	44	30
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000872294136	EG	On-Demand	Anodyne	AMY2	44	30
C#CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294139	DG	On-Demand	Mild	AVPR2	31	42
CC(=O)c1cccc(OCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872294146	EE	On-Demand	Anodyne	HTR1B	17	42
CC1(C)CCNCCN1C(=O)CCc1ccc(OC(F)(F)F)cc1	ZINC000872294147	EG	On-Demand	Anodyne	MMP13	20	41
CC1(C)CCNCCN1C(=O)CCc1ccc(OC(F)(F)F)cc1	ZINC000872294147	EG	On-Demand	Anodyne	MMP2	23	41
CC1(C)CCNCCN1C(=O)CCc1ccc(OC(F)(F)F)cc1	ZINC000872294147	EG	On-Demand	Anodyne	EPHX2	31	41
CC(C)(C)OC(=O)N1CCN(Cc2ccccn2)C(C)(C)CC1	ZINC000872294179	DG	On-Demand	Anodyne	GPR119	40	47
CC1(C)CCNCCN1C(=O)COc1ccc(C(N)=O)cc1	ZINC000872294183	DC	On-Demand	Anodyne	PLA2G4B	40	33
CCc1ccccc1C(=O)N1CCCCc2cccnc21	ZINC000872294194	CH	On-Demand	Anodyne	AVPR2	42	42
COc1ccc2c(c1)C[C@H](C(=O)N1CCNCCC1(C)C)CO2	ZINC000872294197	DD	On-Demand	Anodyne	ROCK2	30	47
COc1ccc2c(c1)C[C@@H](C(=O)N1CCNCCC1(C)C)CO2	ZINC000872294198	DD	On-Demand	Anodyne	ROCK2	30	47
Cc1ccc2cc(C(=O)N3CCCCc4cccnc43)ccc2n1	ZINC000872294232	DH	On-Demand	Anodyne	AVPR2	43	39
O=C(Cc1cccnc1)N1CCCCc2cccnc21	ZINC000872294234	CE	On-Demand	Anodyne	CHRNA7	42	36
O=C(Cc1cccnc1)N1CCCCc2cccnc21	ZINC000872294234	CE	On-Demand	Anodyne	PARP2	24	44
O=C(Cc1cccnc1)N1CCCCc2cccnc21	ZINC000872294234	CE	On-Demand	Anodyne	PARP3	21	44
COCCCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294254	EG	On-Demand	Anodyne	AVPR2	46	41
COCCCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294254	EG	On-Demand	Anodyne	AVPR1A	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000872294256	DG	On-Demand	Anodyne	NPBWR1	89	33
O=C(N1CCCCc2cccnc21)C1(Cc2ccccc2)CC1	ZINC000872294261	DH	On-Demand	Anodyne	SLC12A5	45	32
CCC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294267	DH	On-Demand	Anodyne	AVPR2	49	45
O=C(c1cc(F)c(F)cc1F)N1CCCCc2cccnc21	ZINC000872294269	DG	On-Demand	Anodyne	AVPR2	38	40
O=C(c1ccc(-c2nc(C3CC3)no2)cc1)N1CCCCc2cccnc21	ZINC000872294271	FH	On-Demand	Anodyne	CPT1A	26	40
O=C(c1ccc(F)c(Br)c1)N1CCCCc2cccnc21	ZINC000872294297	EH	On-Demand	Anodyne	AVPR2	46	43
O=C(Cc1cc(F)ccc1F)N1CCCCc2cccnc21	ZINC000872294298	DG	On-Demand	Anodyne	EIF2AK3	35	42
CC1(C)CCNCCN1C(=O)CCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294301	FD	On-Demand	Anodyne	MMP10	71	34
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872294307	DG	On-Demand	Anodyne	PTAFR	35	52
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872294307	DG	On-Demand	Anodyne	DPP8	19	40
O=C1NCCN1c1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872294314	FG	On-Demand	Anodyne	AVPR2	20	46
O=C(c1ccncc1Cl)N1CCCCc2cccnc21	ZINC000872294327	CG	On-Demand	Anodyne	AVPR2	39	48
O=C(c1ccncc1Cl)N1CCCCc2cccnc21	ZINC000872294327	CG	On-Demand	Anodyne	GPBAR1	37	45
Cc1ccc(NC(=O)N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)cc1	ZINC000872294387	FF	On-Demand	Anodyne	EPHX2	26	40
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1F	ZINC000872294390	CH	On-Demand	Anodyne	AVPR2	50	42
O=C1NCCN1c1cc(C(=O)N2CCCCc3cccnc32)ccc1Cl	ZINC000872294391	FG	On-Demand	Anodyne	AVPR2	46	40
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccco2)c1	ZINC000872294392	EF	On-Demand	Anodyne	KISS1R	46	34
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccco2)c1	ZINC000872294392	EF	On-Demand	Anodyne	KCNK3	53	50
COCCCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872294404	EF	On-Demand	Anodyne	HRH2	38	43
COCCCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872294404	EF	On-Demand	Anodyne	ROCK2	24	40
COCCCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872294404	EF	On-Demand	Anodyne	FAAH	18	40
COCCCOc1cccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872294404	EF	On-Demand	Anodyne	PDS	40	36
CC1(C)CCNCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000872294418	ED	On-Demand	Bother	CACNA1D	41	33
O=C(c1cc(C(F)(F)F)ccc1F)N1CCCCc2cccnc21	ZINC000872294420	EI	On-Demand	Anodyne	TRPV1	33	41
O=C(c1ccc(Br)nc1)N1CCCCc2cccnc21	ZINC000872294443	EG	On-Demand	Anodyne	AVPR2	30	43
O=C(c1ccc(OC2CCC2)cc1)N1CCCCc2cccnc21	ZINC000872294459	DH	On-Demand	Anodyne	AVPR2	40	45
O=C(c1ccc(OC2CCC2)cc1)N1CCCCc2cccnc21	ZINC000872294459	DH	On-Demand	Anodyne	AVPR1A	15	40
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872294485	ED	On-Demand	Anodyne	CCR1	19	40
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872294486	ED	On-Demand	Anodyne	CCR1	19	40
CC1(C)CCNCCN1C(=O)CCCNC(=O)c1ccc(F)cc1	ZINC000872294508	ED	On-Demand	Anodyne	DRD3	19	41
CC1(C)CCNCCN1C(=O)CCCNC(=O)c1ccc(F)cc1	ZINC000872294508	ED	On-Demand	Anodyne	PLD2	45	42
CCOc1ccc(OCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872294526	EE	On-Demand	Anodyne	CPT1A	20	43
CCOc1ccc(OCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872294526	EE	On-Demand	Anodyne	CPT2	38	43
O=C(c1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872294528	FG	On-Demand	Anodyne	AVPR2	31	44
O=C(c1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872294528	FG	On-Demand	Anodyne	AVPR1A	17	44
O=C(c1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872294528	FG	On-Demand	Anodyne	L3MBTL3	85	38
O=C(c1ccc(OC2CCOCC2)cc1)N1CCCCc2cccnc21	ZINC000872294543	FH	On-Demand	Anodyne	AVPR2	23	42
CC1(C)CCNCCN1C(=O)CCNC(=O)c1ccc(F)cc1	ZINC000872294558	DD	On-Demand	Anodyne	PLD2	49	43
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000872294617	EE	On-Demand	Anodyne	PREP	39	43
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000872294617	EE	On-Demand	Anodyne	L3MBTL3	52	38
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000872294618	EE	On-Demand	Anodyne	PREP	39	43
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000872294618	EE	On-Demand	Anodyne	L3MBTL3	52	38
CC1(C)CCNCCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294621	FD	On-Demand	Anodyne	MMP13	31	43
CC1(C)CCNCCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294621	FD	On-Demand	Anodyne	ADAM17	27	40
CC1(C)CCNCCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294621	FD	On-Demand	Anodyne	MMP2	17	43
CC1(C)CCNCCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294621	FD	On-Demand	Anodyne	MMP9	18	43
CC1(C)CCNCCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1	ZINC000872294621	FD	On-Demand	Anodyne	MMP10	71	33
CN1CCN(C(=O)c2ccc(Cl)cc2O)Cc2cccnc21	ZINC000872294642	DF	On-Demand	Anodyne	P2RX7	38	51
CC(C)(C)C(=O)NCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294644	FH	On-Demand	Anodyne	AVPR2	45	46
CC1(C)CCNCCN1C(=O)c1csc(-c2c(F)cccc2F)n1	ZINC000872294666	FG	On-Demand	Anodyne	PIM1	15	42
CC1(C)CCNCCN1C(=O)c1csc(-c2c(F)cccc2F)n1	ZINC000872294666	FG	On-Demand	Anodyne	PIM3	15	42
Cc1c(CC(=O)N2CCNCCC2(C)C)nnn1-c1ccccc1	ZINC000872294673	ED	On-Demand	Anodyne	FFAR2	48	32
CCCNC(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872294678	EG	On-Demand	Anodyne	DRD4	44	34
CCCNC(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872294678	EG	On-Demand	Anodyne	AVPR2	46	41
CC1(C)CCNCCN1C(=O)c1cccc(-n2cccn2)c1	ZINC000872294726	CE	On-Demand	Anodyne	AMP1_PLAFQ	45	33
O=C(c1cccc(F)c1Cl)N1CCCCc2cccnc21	ZINC000872294742	DH	On-Demand	Anodyne	AVPR2	26	41
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)OCC(F)(F)F	ZINC000872294754	GI	On-Demand	Anodyne	AVPR2	71	51
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)OCC(F)(F)F	ZINC000872294754	GI	On-Demand	Anodyne	AVPR1A	28	45
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)OCC(F)(F)F	ZINC000872294754	GI	On-Demand	Anodyne	TRPV1	25	40
CN1CCN(C(=O)c2ccc(S(C)(=O)=O)cc2)Cc2cccnc21	ZINC000872294780	ED	On-Demand	Anodyne	LOX1.1	41	32
CN1CCN(C(=O)c2ccc(S(C)(=O)=O)cc2)Cc2cccnc21	ZINC000872294780	ED	On-Demand	Anodyne	O49150_SOLTU	49	32
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)Cc2cccnc21	ZINC000872294788	EF	On-Demand	Bother	P2RX7	27	47
CC(=O)N[C@@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872294798	DD	On-Demand	Anodyne	CCR1	57	43
CN1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])Cc2cccnc21	ZINC000872294805	EF	On-Demand	Bother	P2RX7	22	47
CC(=O)N(CCC(=O)N1CCNCCC1(C)C)Cc1ccccc1	ZINC000872294807	EE	On-Demand	Anodyne	FFAR2	106	40
COc1ccccc1/C(C)=C/C(=O)N1CCNCCC1(C)C	ZINC000872294826	DF	On-Demand	Anodyne	KCNA3	40	39
COc1ccccc1/C(C)=C\C(=O)N1CCNCCC1(C)C	ZINC000872294827	DF	On-Demand	Anodyne	KCNA3	40	39
CN1CCN(C(=O)c2cccc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872294833	FF	On-Demand	Anodyne	NPY2R	16	40
CN1CCN(C(=O)c2cccc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872294833	FF	On-Demand	Anodyne	CFTR	43	36
CN1CCN(C(=O)c2cccc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872294833	FF	On-Demand	Anodyne	EPHX2	15	43
CN1CCN(C(=O)c2cccc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872294833	FF	On-Demand	Anodyne	TYK2	40	36
CN1CCN(C(=O)c2cccc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872294833	FF	On-Demand	Anodyne	LIMK2	19	40
O=C(c1ncccn1)N1CCCCc2cccnc21	ZINC000872294838	CD	On-Demand	Anodyne	AVPR2	25	41
O=C(c1ccc(F)nc1)N1CCCCc2cccnc21	ZINC000872294855	CF	On-Demand	Anodyne	AVPR2	35	43
CCOc1ncc(C(=O)N2CCCCc3cccnc32)cc1Cl	ZINC000872294877	EH	On-Demand	Anodyne	GPBAR1	25	42
CN1CCN(C(=O)c2ccc(F)cc2)Cc2cccnc21	ZINC000872294901	CE	On-Demand	Anodyne	SMO	29	41
COc1ccc(OCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872294914	ED	On-Demand	Anodyne	HTR1B	16	42
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CCCCC[C@@H]3N)ccc21	ZINC000872294918	EE	On-Demand	Anodyne	NOS1	15	46
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CCCCC[C@@H]3N)ccc21	ZINC000872294918	EE	On-Demand	Anodyne	EIF2AK3	48	35
COCCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294927	EG	On-Demand	Anodyne	AVPR2	57	42
COCCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872294927	EG	On-Demand	Anodyne	AVPR1A	20	41
CN1CCN(C(=O)c2ccccc2Br)Cc2cccnc21	ZINC000872294937	EF	On-Demand	Anodyne	P2RX7	25	43
CN1CCN(C(=O)c2cccc(OC(F)F)c2)Cc2cccnc21	ZINC000872294949	EF	On-Demand	Anodyne	DRD4	40	30
CCOc1cn(-c2ccccc2)nc1C(=O)N1CCNCCC1(C)C	ZINC000872294974	EE	On-Demand	Anodyne	HCN1	49	40
CCOc1cn(-c2ccccc2)nc1C(=O)N1CCNCCC1(C)C	ZINC000872294974	EE	On-Demand	Anodyne	HCN4	40	31
CN1CCN(C(=O)c2cccc(Cl)c2)Cc2cccnc21	ZINC000872294984	DF	On-Demand	Anodyne	P2RX7	20	41
CN1CCN(C(=O)c2cccc(Cl)c2)Cc2cccnc21	ZINC000872294984	DF	On-Demand	Anodyne	GRM5	18	42
CCCN(CC)C(=O)c1ccc(C(=O)N2CCNCCC2(C)C)cc1	ZINC000872295004	EF	On-Demand	Anodyne	OPRD1	28	45
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1	ZINC000872295008	GF	On-Demand	Anodyne	AKR1C3	46	34
Cc1ccc(OCc2ccccc2)c(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872295020	EH	On-Demand	Anodyne	PTGER1	53	36
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872295023	GE	On-Demand	Anodyne	P2RY12	169	37
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872295023	GE	On-Demand	Anodyne	CCKBR	21	41
CSCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872295024	GE	On-Demand	Anodyne	P2RY12	169	37
CSCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872295024	GE	On-Demand	Anodyne	CCKBR	21	41
CN1CCN(C(=O)c2ccccc2)Cc2cccnc21	ZINC000872295025	CE	On-Demand	Anodyne	SMO	47	45
O=C(CCCn1ccnc1)N1CCCCc2cccnc21	ZINC000872295032	CE	On-Demand	Anodyne	TBXAS1	54	42
CN1CCN(C(=O)c2cccc(S(=O)(=O)N(C)C)c2)Cc2cccnc21	ZINC000872295040	FD	On-Demand	Anodyne	AKR1C3	54	38
CN1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)Cc2cccnc21	ZINC000872295052	GF	On-Demand	Bother	TAAR1	16	46
CN1CCN(C(=O)c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872295067	DF	On-Demand	Anodyne	P2RX7	15	41
CN1CCN(C(=O)c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872295067	DF	On-Demand	Anodyne	SMO	34	41
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872295098	CE	On-Demand	Anodyne	SMO	23	45
CC1(C)CCNCCN1C(=O)CNC(=O)NCc1ccc(Cl)cc1	ZINC000872295107	FD	On-Demand	Anodyne	FFAR2	59	37
CN1CCN(C(=O)c2ccc(F)cc2F)Cc2cccnc21	ZINC000872295137	DE	On-Demand	Anodyne	P2RX7	30	49
CC1(C)CCNCCN1C(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1	ZINC000872295163	FF	On-Demand	Anodyne	MMP10	56	39
CCOc1ccccc1[C@H](CC(=O)N1CCNCCC1(C)C)NC(C)=O	ZINC000872295168	FE	On-Demand	Anodyne	HCN1	50	41
CCOc1ccccc1[C@H](CC(=O)N1CCNCCC1(C)C)NC(C)=O	ZINC000872295168	FE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1[C@@H](CC(=O)N1CCNCCC1(C)C)NC(C)=O	ZINC000872295169	FE	On-Demand	Anodyne	HCN1	50	41
CCOc1ccccc1[C@@H](CC(=O)N1CCNCCC1(C)C)NC(C)=O	ZINC000872295169	FE	On-Demand	Anodyne	HCN4	41	32
CN1CCN(C(=O)c2ccccc2O)Cc2cccnc21	ZINC000872295175	CD	On-Demand	Anodyne	P2RX7	28	42
CCC(=O)N1CSC[C@@H]1C(=O)N1CCCCc2cccnc21	ZINC000872295188	DE	On-Demand	Anodyne	PREP	30	47
CCC(=O)N1CSC[C@H]1C(=O)N1CCCCc2cccnc21	ZINC000872295194	DE	On-Demand	Anodyne	PREP	30	47
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	HTR1A	15	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	HRH2	44	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	HTR1D	17	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	SIGMAR1	21	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	CCR3	46	42
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	FAAH	21	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295198	FE	On-Demand	Anodyne	MCHR1	21	41
CN(C)C(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872295205	DF	On-Demand	Anodyne	AVPR2	41	40
CC1(C)CCNCCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000872295210	DE	On-Demand	Bother	CACNA1C	58	37
CC1(C)CCNCCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000872295210	DE	On-Demand	Bother	CACNA1D	91	37
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872295216	EG	On-Demand	Anodyne	GPR119	52	47
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872295216	EG	On-Demand	Anodyne	SFRP1	15	40
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872295220	EH	On-Demand	Bother	AVPR2	25	41
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCCCc2cccnc21	ZINC000872295221	FG	On-Demand	Anodyne	AVPR2	36	43
O=C(c1ccncc1F)N1CCCCc2cccnc21	ZINC000872295226	CF	On-Demand	Anodyne	GPBAR1	23	40
O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CCCCc2cccnc21	ZINC000872295227	FF	On-Demand	Anodyne	DRD4	20	40
O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CCCCc2cccnc21	ZINC000872295227	FF	On-Demand	Anodyne	SIGMAR1	24	45
O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CCCCc2cccnc21	ZINC000872295230	FF	On-Demand	Anodyne	DRD4	20	40
O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CCCCc2cccnc21	ZINC000872295230	FF	On-Demand	Anodyne	SIGMAR1	24	45
O=C(COc1cccnc1)N1CCCCc2cccnc21	ZINC000872295252	CE	On-Demand	Anodyne	CPT1A	73	41
O=C(COc1cccnc1)N1CCCCc2cccnc21	ZINC000872295252	CE	On-Demand	Anodyne	CPT2	43	38
O=C(C[C@H](c1ccccc1)N1CCOC1=O)N1CCCCc2cccnc21	ZINC000872295258	FG	On-Demand	Anodyne	PTAFR	15	51
O=C(C[C@@H](c1ccccc1)N1CCOC1=O)N1CCCCc2cccnc21	ZINC000872295259	FG	On-Demand	Anodyne	PTAFR	15	51
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(OC)c1	ZINC000872295269	EE	On-Demand	Anodyne	OXTR	23	45
CN1CCN(C(=O)c2cccc(F)c2)Cc2cccnc21	ZINC000872295276	CE	On-Demand	Anodyne	P2RX7	17	40
CC1(C)CCNCCN1C(=O)c1csc(-c2ccccc2)n1	ZINC000872295286	DG	On-Demand	Anodyne	PTGER1	21	40
CC1(C)CCNCCN1C(=O)c1csc(-c2ccccc2)n1	ZINC000872295286	DG	On-Demand	Anodyne	CHEK1	15	52
CC1(C)CCNCCN1C(=O)c1csc(-c2ccccc2)n1	ZINC000872295286	DG	On-Demand	Anodyne	FFAR2	53	31
CC1(C)CCNCCN1C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872295299	FH	On-Demand	Anodyne	METAP1	49	42
CC1(C)CCNCCN1C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000872295299	FH	On-Demand	Anodyne	MT-CO2	46	36
CN1CCN(C(=O)Cc2nn(C)c(=O)c3ccccc23)Cc2cccnc21	ZINC000872295304	FD	On-Demand	Anodyne	IMDH_CRYPV	29	43
NC(=O)c1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872295305	ED	On-Demand	Anodyne	CPT1A	70	43
O=C(c1ccc(C(F)F)cc1)N1CCCCc2cccnc21	ZINC000872295312	DI	On-Demand	Anodyne	AVPR2	36	47
O=C(c1cc(Br)cnc1Cl)N1CCCCc2cccnc21	ZINC000872295313	FH	On-Demand	Anodyne	AVPR2	22	40
O=C1CCC(=O)N(c2ccc(C(=O)N3CCCCc4cccnc43)cc2)N1	ZINC000872295317	FE	On-Demand	Anodyne	AVPR2	23	44
O=C(c1cccc2c1OCCO2)N1CCCCc2cccnc21	ZINC000872295328	DF	On-Demand	Anodyne	G2YM83_BOTF4	40	35
O=C(c1csc(C2CC2)n1)N1CCCCc2cccnc21	ZINC000872295361	CG	On-Demand	Anodyne	TRPC6	43	33
O=C(c1csc(C2CC2)n1)N1CCCCc2cccnc21	ZINC000872295361	CG	On-Demand	Anodyne	TRPC3	41	33
COCCCOc1ccc(C(=O)N2CCNCCC2(C)C)cc1	ZINC000872295363	DE	On-Demand	Anodyne	PLA2G4B	42	35
CC1(C)CCNCCN1C(=O)C[C@@H]1CCCc2ccccc21	ZINC000872295380	DG	On-Demand	Anodyne	EBP	24	43
CC1(C)CCNCCN1C(=O)C[C@H]1CCCc2ccccc21	ZINC000872295381	DG	On-Demand	Anodyne	EBP	24	43
C[C@@H](C(=O)N1CCNCCC1(C)C)c1ccc(S(C)(=O)=O)cc1	ZINC000872295389	ED	On-Demand	Anodyne	MMP10	51	32
CN(C)c1cc(C(=O)N2CCCCc3cccnc32)cc(Cl)n1	ZINC000872295426	EG	On-Demand	Anodyne	AVPR2	37	41
CN1CCN(C(=O)c2cc(S(C)(=O)=O)ccc2Cl)Cc2cccnc21	ZINC000872295451	GE	On-Demand	Anodyne	P2RX7	24	40
CN1CCN(C(=O)c2cc(S(C)(=O)=O)ccc2Cl)Cc2cccnc21	ZINC000872295451	GE	On-Demand	Anodyne	SLC6A9	42	42
CN1CCN(C(=O)c2ccccc2F)Cc2cccnc21	ZINC000872295452	CE	On-Demand	Anodyne	P2RX7	41	46
CN1CCN(C(=O)c2ccc(F)cc2Cl)Cc2cccnc21	ZINC000872295463	DF	On-Demand	Anodyne	P2RX7	61	65
CC1(C)CCNCCN1C(=O)c1csc(-c2ccccc2Cl)n1	ZINC000872295473	EH	On-Demand	Anodyne	CHEK1	15	40
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccccc1C(F)(F)F	ZINC000872295502	FE	On-Demand	Anodyne	RBP4	41	32
O=C(NC1CCC(C(=O)N2CCCCc3cccnc32)CC1)C1CCCC1	ZINC000872295506	FH	On-Demand	Anodyne	EPHX2	24	41
O=C(c1ccc(N2CCCCCC2)nc1)N1CCCCc2cccnc21	ZINC000872295566	FH	On-Demand	Anodyne	AVPR2	26	45
CC1(C)CCNCCN1C(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000872295600	ED	On-Demand	Anodyne	DRD4	42	46
CC1(C)CCNCCN1C(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000872295600	ED	On-Demand	Anodyne	CHRM3	19	41
CC1(C)CCNCCN1C(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000872295600	ED	On-Demand	Anodyne	SIGMAR1	65	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCOC2=O)cc1	ZINC000872295613	EE	On-Demand	Anodyne	F2	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCOC2=O)cc1	ZINC000872295613	EE	On-Demand	Anodyne	TMPRSS11D	40	33
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	CHRM2	19	40
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	DRD2	22	45
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	DRD4	56	42
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	ACHE	51	47
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	LTA4H	47	44
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	HRH3	32	53
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	SIGMAR1	71	67
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	FAAH	29	42
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	CXCR3	30	41
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	CACNA1G	22	40
O=C(C1CCN(Cc2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872295618	EH	On-Demand	Anodyne	NOD2	42	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000872295621	FF	On-Demand	Anodyne	SFRP1	61	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000872295621	FF	On-Demand	Anodyne	WNT3	53	33
Cn1nnc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872295628	DE	On-Demand	Anodyne	HPGD	46	36
COc1cc(NCCNC(=O)[C@@H]2CCCCC[C@@H]2N)cc(OC)c1	ZINC000872295655	EE	On-Demand	Anodyne	CTSK	19	40
CC(=O)Nc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872295661	DE	On-Demand	Anodyne	CSNK2A1	21	42
CC(=O)Nc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872295661	DE	On-Demand	Anodyne	KCNK3	42	36
NC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)nc1	ZINC000872295672	CD	On-Demand	Anodyne	AVPR2	28	44
CN1CCN(C(=O)c2ccc(CNC(N)=O)cc2)Cc2cccnc21	ZINC000872295695	ED	On-Demand	Anodyne	NAMPT	29	42
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872295705	FH	On-Demand	Anodyne	FPR2	28	50
CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872295719	EG	On-Demand	Anodyne	TRPV1	36	47
CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872295719	EG	On-Demand	Anodyne	SMO	23	42
CC1(C)CCNCCN1C(=O)C[C@H]1CCc2ccccc2C1	ZINC000872295721	DF	On-Demand	Anodyne	PREP	30	49
CC1(C)CCNCCN1C(=O)C[C@@H]1CCc2ccccc2C1	ZINC000872295723	DF	On-Demand	Anodyne	PREP	30	49
CC(=O)N1CCN(c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295743	FE	On-Demand	Anodyne	NPY2R	20	41
CC(=O)N1CCN(c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)CC1	ZINC000872295743	FE	On-Demand	Anodyne	MAPK1	16	40
COc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872295744	DH	On-Demand	Anodyne	AVPR2	52	49
COc1ccc(C(=O)N2CCCCc3cccnc32)c(Cl)c1	ZINC000872295744	DH	On-Demand	Anodyne	GPBAR1	17	46
CCn1cc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872295754	CE	On-Demand	Anodyne	AVPR2	32	40
O=C(c1cccc(C(F)F)c1)N1CCCCc2cccnc21	ZINC000872295765	DI	On-Demand	Anodyne	AVPR2	31	40
CC1(C)CCNCCN1C(=O)CCCCCNC(=O)NC1CCCCC1	ZINC000872295768	FF	On-Demand	Anodyne	EPHX2	19	52
COc1ccc(CC(=O)N2CCN(C)c3ncccc3C2)cc1OC	ZINC000872295774	EE	On-Demand	Anodyne	ABCB1	21	47
CC(=O)N1CCN(Cc2ccccc2NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)CC1	ZINC000872295785	FD	On-Demand	Anodyne	CCR3	16	42
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	TRPV1	22	42
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	CACNA1B	47	36
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	CCR2	56	40
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	RBP4	16	44
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	BMX	27	40
CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872295790	EG	On-Demand	Anodyne	HPGD	15	40
O=C(c1cc(Cl)nc(N2CCCC2)c1)N1CCCCc2cccnc21	ZINC000872295792	FH	On-Demand	Anodyne	AVPR2	26	41
Cc1oc(-c2ccccc2)nc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872295795	EG	On-Demand	Anodyne	PDE8B	50	35
CN1CCN(C(=O)c2cc(F)ccc2F)Cc2cccnc21	ZINC000872295810	DE	On-Demand	Anodyne	P2RX7	30	46
O=C(c1nc(C2CC2)n(-c2ccccc2Cl)n1)N1CCCCc2cccnc21	ZINC000872295842	GI	On-Demand	Anodyne	AVPR2	23	41
COCCOc1ccc(C(=O)N2CCNCCC2(C)C)cc1	ZINC000872295852	DD	On-Demand	Anodyne	PLA2G4B	41	34
CC1(C)CCNCCN1C(=O)Cc1csc(-c2ccccc2)n1	ZINC000872295863	EF	On-Demand	Anodyne	FFAR2	52	33
COCCC(=O)N1CCC(NC(=O)[C@@H]2CCCCC[C@@H]2N)CC1	ZINC000872295870	ED	On-Demand	Anodyne	EPHX2	20	44
CN1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])Cc2cccnc21	ZINC000872295895	EF	On-Demand	Bother	P2RX7	20	44
CN1CCN(C(=O)c2cc(Cl)ccc2O)Cc2cccnc21	ZINC000872295896	DF	On-Demand	Anodyne	P2RX7	33	47
O=C(c1ccc(OCC(F)(F)C(F)F)nc1)N1CCCCc2cccnc21	ZINC000872295906	GH	On-Demand	Anodyne	AVPR2	26	41
CC(=O)Nc1ccc(CC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872295908	EE	On-Demand	Anodyne	TRPV1	15	46
NC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)s1	ZINC000872295922	DE	On-Demand	Anodyne	AVPR2	16	40
CN1CCN(C(=O)c2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872295926	EG	On-Demand	Anodyne	TRPV1	28	44
CN1CCN(C(=O)c2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872295926	EG	On-Demand	Anodyne	P2RX7	49	46
CN1CCN(C(=O)c2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872295926	EG	On-Demand	Anodyne	RBP4	62	40
CN1CCN(C(=O)c2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872295926	EG	On-Demand	Anodyne	SCD1	23	46
CN1CCN(C(=O)c2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872295926	EG	On-Demand	Anodyne	SCD	28	46
O=C(c1cc(F)c(Cl)nc1Cl)N1CCCCc2cccnc21	ZINC000872295933	EH	On-Demand	Anodyne	AVPR2	26	40
CN1CCN(C(=O)c2ccccc2Cl)Cc2cccnc21	ZINC000872295937	DF	On-Demand	Anodyne	P2RX7	55	49
CN1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)Cc2cccnc21	ZINC000872295941	FF	On-Demand	Anodyne	TRPV1	21	49
CN1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)Cc2cccnc21	ZINC000872295941	FF	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)Cc2cccnc21	ZINC000872295941	FF	On-Demand	Anodyne	L3MBTL3	44	37
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCNCCC1(C)C	ZINC000872295943	EG	On-Demand	Anodyne	TACR1	27	40
O=C(c1cccc(F)c1F)N1CCCCc2cccnc21	ZINC000872295965	CG	On-Demand	Anodyne	AVPR2	37	42
O=C(c1csc(-c2ccc3c(c2)OCO3)n1)N1CCCCc2cccnc21	ZINC000872296045	GH	On-Demand	Anodyne	TRPC6	35	44
O=C(c1csc(-c2ccc3c(c2)OCO3)n1)N1CCCCc2cccnc21	ZINC000872296045	GH	On-Demand	Anodyne	TRPC3	34	44
COc1cccc(C(=O)NCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872296063	FD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872296063	FD	On-Demand	Anodyne	DRD3	17	50
O=C(c1ccc(N2CCOCC2)cc1)N1CCCCc2cccnc21	ZINC000872296102	EF	On-Demand	Anodyne	AVPR2	31	57
O=C(c1ccc2c(c1)COC2)N1CCCCc2cccnc21	ZINC000872296127	CG	On-Demand	Anodyne	AVPR2	35	44
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(F)c1	ZINC000872296142	DE	On-Demand	Anodyne	P2RX7	16	40
CC1(C)CCNCCN1C(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000872296149	EH	On-Demand	Anodyne	FFAR2	48	36
O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872296173	EI	On-Demand	Anodyne	AVPR2	40	39
CN1CCN(C(=O)c2ccc3c(c2)NC(=O)CO3)Cc2cccnc21	ZINC000872296186	ED	On-Demand	Anodyne	HTR1B	15	43
C[C@H](O)[C@](C)(CNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872296196	EF	On-Demand	Anodyne	AMY2	50	34
C[C@H](O)[C@](C)(CNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872296196	EF	On-Demand	Anodyne	REN	52	37
CCOc1ccc(C(=O)NCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872296204	FD	On-Demand	Anodyne	NOD2	32	41
O=C(CN1CCc2ccccc21)N1CCCCc2cccnc21	ZINC000872296207	DF	On-Demand	Anodyne	AVPR2	33	42
CCOC(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872296209	FF	On-Demand	Anodyne	TRPV1	17	41
CCOC(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872296209	FF	On-Demand	Anodyne	NOD2	40	38
CN1CCN(C(=O)c2cn(C)c3ccccc23)Cc2cccnc21	ZINC000872296261	DF	On-Demand	Anodyne	TPSAB1	16	42
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)N2CCNCCC2(C)C)c1	ZINC000872296308	EG	On-Demand	Anodyne	NPY2R	21	43
CCOc1ccccc1C(=O)NCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872296336	FD	On-Demand	Anodyne	HCN1	91	48
CCOc1ccccc1C(=O)NCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872296336	FD	On-Demand	Anodyne	HCN4	62	42
O=C(CCCOCc1ccccc1)N1CCCCc2cccnc21	ZINC000872296337	DH	On-Demand	Anodyne	PREP	45	37
O=C(c1ccnc(F)c1)N1CCCCc2cccnc21	ZINC000872296365	CF	On-Demand	Anodyne	AVPR2	34	40
CC1(C)CCNCCN1C(=O)CCCc1ccc(F)c(F)c1	ZINC000872296370	DF	On-Demand	Anodyne	FFAR2	48	36
Cc1nc2ccc(C(=O)N3CCN(C)c4ncccc4C3)cc2nc1C	ZINC000872296385	EF	On-Demand	Anodyne	HPGD	44	34
CC1(C)CCNCCN1C(=O)CCCc1csc2ccccc12	ZINC000872296392	EH	On-Demand	Anodyne	FFAR2	85	45
CN1CCN(C(=O)c2ccc(CN3C(=O)CCC3=O)cc2)Cc2cccnc21	ZINC000872296394	GD	On-Demand	Anodyne	FABI	46	35
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1F	ZINC000872296396	DE	On-Demand	Anodyne	RBP4	16	40
O=C(c1ccc(Br)c(F)c1)N1CCCCc2cccnc21	ZINC000872296404	EH	On-Demand	Anodyne	AVPR2	38	40
O=C(c1ccc(S(=O)(=O)C2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872296405	GH	On-Demand	Anodyne	AVPR2	27	41
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872296425	DG	On-Demand	Bother	AVPR2	20	41
CCOc1ccccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296428	DF	On-Demand	Anodyne	HCN1	65	42
CCOc1ccccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296428	DF	On-Demand	Anodyne	HCN4	45	35
O=C(Cc1cccc(Cl)c1)N1CCCCc2cccnc21	ZINC000872296453	DH	On-Demand	Anodyne	EIF2AK3	24	41
CNC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872296474	DD	On-Demand	Anodyne	AVPR2	70	43
CNC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872296474	DD	On-Demand	Anodyne	AVPR1A	18	43
CC(C)(C)OC(=O)N1C[C@@H]2OC(=O)N([C@@H]3CCN(Cc4ncccn4)C3)[C@@H]2C1	ZINC000872296483	GD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1C[C@@H]2OC(=O)N([C@H]3CCN(Cc4ncccn4)C3)[C@@H]2C1	ZINC000872296484	GD	On-Demand	Anodyne	GPR119	22	40
CN1CCN(C(=O)Cn2ccccc2=O)Cc2cccnc21	ZINC000872296489	CC	On-Demand	Anodyne	CHRM2	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000872296505	FE	On-Demand	Anodyne	EPHX2	16	58
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296537	FD	On-Demand	Anodyne	CPT1A	132	42
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296537	FD	On-Demand	Anodyne	CPT2	50	38
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296537	FD	On-Demand	Anodyne	PREP	40	36
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296538	FD	On-Demand	Anodyne	CPT1A	132	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296538	FD	On-Demand	Anodyne	CPT2	50	38
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000872296538	FD	On-Demand	Anodyne	PREP	40	36
CCCN(CC)C(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872296552	FH	On-Demand	Anodyne	AVPR2	40	40
CCCN(CC)C(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872296552	FH	On-Demand	Anodyne	OPRD1	26	40
O=C(NCCC(=O)N1CCCCc2cccnc21)C1CCCCC1	ZINC000872296572	EF	On-Demand	Anodyne	TBK1	60	33
O=C(NCCC(=O)N1CCCCc2cccnc21)C1CCCCC1	ZINC000872296572	EF	On-Demand	Anodyne	GPBAR1	15	41
CN1CCN(C(=O)c2cc(F)c(F)cc2Cl)Cc2cccnc21	ZINC000872296573	EG	On-Demand	Anodyne	P2RX7	53	43
O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N1CCCCc2cccnc21	ZINC000872296579	GH	On-Demand	Anodyne	TRPC6	32	40
O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N1CCCCc2cccnc21	ZINC000872296579	GH	On-Demand	Anodyne	TRPC3	30	40
COCCCOc1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872296593	DE	On-Demand	Anodyne	DRD4	40	30
CCOc1ccccc1[C@H](CC(=O)N1CCCCc2cccnc21)NC(C)=O	ZINC000872296622	GG	On-Demand	Anodyne	PTAFR	15	40
CCOc1ccccc1[C@@H](CC(=O)N1CCCCc2cccnc21)NC(C)=O	ZINC000872296623	GG	On-Demand	Anodyne	PTAFR	15	40
CN1CCN(C(=O)c2cccc(S(=O)(=O)NC3CC3)c2)Cc2cccnc21	ZINC000872296628	GD	On-Demand	Anodyne	AKR1C3	46	36
CN1CCN(C(=O)c2cccc(S(=O)(=O)NC3CC3)c2)Cc2cccnc21	ZINC000872296628	GD	On-Demand	Anodyne	SFRP1	96	39
CN1CCN(C(=O)c2cccc(S(=O)(=O)NC3CC3)c2)Cc2cccnc21	ZINC000872296628	GD	On-Demand	Anodyne	WNT3	48	33
CCCNC(=O)c1cccc(C(=O)N2CCNCCC2(C)C)c1	ZINC000872296639	DE	On-Demand	Anodyne	DRD4	43	33
CC1(C)CCNCCN1C(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	ZINC000872296640	FF	On-Demand	Anodyne	ESRRA	16	41
O=C(Cc1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872296644	EI	On-Demand	Anodyne	TRPV1	32	42
O=C(Cc1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872296644	EI	On-Demand	Anodyne	RBP4	18	44
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872296651	FE	On-Demand	Anodyne	SIGMAR1	17	44
CN1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])Cc2cccnc21	ZINC000872296667	EE	On-Demand	Bother	COLA	92	35
O=C(NCc1ccc(C(=O)N2CCCCc3cccnc32)cc1)C1CCCC1	ZINC000872296668	GH	On-Demand	Anodyne	AVPR2	42	46
O=C(C[C@@H](c1ccccc1)C(F)(F)F)N1CCCCc2cccnc21	ZINC000872296675	EI	On-Demand	Anodyne	PTAFR	15	46
O=C(C[C@H](c1ccccc1)C(F)(F)F)N1CCCCc2cccnc21	ZINC000872296676	EI	On-Demand	Anodyne	PTAFR	15	46
O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296682	FG	On-Demand	Anodyne	AVPR2	23	40
O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296682	FG	On-Demand	Anodyne	PREP	43	42
O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296682	FG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296682	FG	On-Demand	Anodyne	MAP3K12	32	41
O=C(c1ccccc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296683	FG	On-Demand	Anodyne	AVPR2	23	40
O=C(c1ccccc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296683	FG	On-Demand	Anodyne	PREP	43	42
O=C(c1ccccc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296683	FG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(c1ccccc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872296683	FG	On-Demand	Anodyne	MAP3K12	32	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	ACE	19	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	SSTR2	22	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	GHRHR	29	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MME	25	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	EDNRB	50	33
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	EDNRA	37	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	TACR1	27	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	UGCG	21	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MC4R	73	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	CCKAR	64	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	BRS3	26	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	NMBR	45	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MC3R	66	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MC5R	73	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MMP2	24	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	GRPR	90	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	ECE1	55	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MMP11	65	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	CCKBR	49	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	GHSR	65	50
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MMP9	23	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	MC1R	93	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	KISS1R	57	34
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	ERAP2	40	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872296718	GE	On-Demand	Anodyne	HPN	21	41
Cc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(C)c1	ZINC000872296728	CF	On-Demand	Anodyne	P2RX7	18	48
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)Cc2cccnc21	ZINC000872296762	EF	On-Demand	Bother	P2RX7	24	40
O=C(c1cc(F)c(F)c(F)c1)N1CCCCc2cccnc21	ZINC000872296764	DG	On-Demand	Anodyne	AVPR2	36	41
CN1CCN(C(=O)c2cccnc2Cl)Cc2cccnc21	ZINC000872296768	DE	On-Demand	Anodyne	P2RX7	48	43
CN1CCN(C(=O)c2cccnc2Cl)Cc2cccnc21	ZINC000872296768	DE	On-Demand	Anodyne	G2YM83_BOTF4	75	41
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	P2RY12	56	34
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	MME	47	36
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	UGCG	41	41
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	MC4R	81	40
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	TRY2_BOVIN	101	38
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	CYSP_TRYCR	43	35
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	NPFFR2	51	30
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	MC5R	41	34
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	CAPN1	41	39
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	ACE2	57	34
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	ST14	47	35
CN1CCN(C(=O)[C@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296776	FD	On-Demand	Anodyne	NPFFR1	43	30
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	P2RY12	56	34
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	MME	47	36
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	UGCG	41	41
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	MC4R	81	40
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	TRY2_BOVIN	101	38
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	CYSP_TRYCR	43	35
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	NPFFR2	51	30
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	MC5R	41	34
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	CAPN1	41	39
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	ACE2	57	34
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	ST14	47	35
CN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(N)=O)Cc2cccnc21	ZINC000872296777	FD	On-Demand	Anodyne	NPFFR1	43	30
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccn2)CC1	ZINC000872296786	ED	On-Demand	Anodyne	HTR1A	26	54
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccn2)CC1	ZINC000872296786	ED	On-Demand	Anodyne	DRD2	19	50
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccn2)CC1	ZINC000872296786	ED	On-Demand	Anodyne	DRD4	40	47
CC1(C)CCNCCN1C(=O)c1cc(-c2cccnc2)on1	ZINC000872296788	DD	On-Demand	Anodyne	SOAT2	48	31
CC1(C)CCNCCN1C(=O)CSCc1cccnc1	ZINC000872296798	CD	On-Demand	Anodyne	CHRNA7	47	37
CC1(C)CCNCCN1C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000872296803	DE	On-Demand	Anodyne	CYP11B1	38	43
CC1(C)CCNCCN1C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000872296803	DE	On-Demand	Anodyne	TBXAS1	40	48
CC1(C)CCNCCN1C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000872296803	DE	On-Demand	Anodyne	CYP11B2	17	43
CC1(C)CCNCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872296805	ED	On-Demand	Anodyne	DRD4	24	41
CC1(C)CCNCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872296806	ED	On-Demand	Anodyne	DRD4	24	41
CC1(C)CCNCCN1C(=O)Cc1csc(Cc2ccccc2)n1	ZINC000872296815	EF	On-Demand	Anodyne	FFAR2	50	34
N#Cc1cccc(OCC(=O)N2CCCCc3cccnc32)c1	ZINC000872296837	DF	On-Demand	Mild	CPT1A	86	43
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	CA2	21	43
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	CA1	15	43
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	MMP2	16	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	MMP9	21	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	CA12	16	43
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296840	JH	On-Demand	Anodyne	CA9	22	43
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	CA2	21	43
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	CA1	15	43
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	MMP2	16	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	MMP9	21	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	CA12	16	43
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)c2c[nH]c3ccccc23)cc1	ZINC000872296841	JH	On-Demand	Anodyne	CA9	22	43
C[C@H]1CN(Cc2ccc(C(=O)N3CCNCCC3(C)C)cc2)C[C@@H](C)O1	ZINC000872296853	FF	On-Demand	Anodyne	MLNR	46	34
C[C@@H]1CN(Cc2ccc(C(=O)N3CCNCCC3(C)C)cc2)C[C@@H](C)O1	ZINC000872296854	FF	On-Demand	Anodyne	MLNR	46	34
C[C@H]1CN(Cc2ccc(C(=O)N3CCNCCC3(C)C)cc2)C[C@H](C)O1	ZINC000872296855	FF	On-Demand	Anodyne	MLNR	46	34
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1OC(F)F	ZINC000872296924	EH	On-Demand	Anodyne	AVPR2	40	37
O=C1CCCc2cc(C(=O)N3CCCCc4cccnc43)ccc2N1	ZINC000872296956	EG	On-Demand	Anodyne	AVPR2	29	41
CC1(C)CCNCCN1C(=O)c1ccc(N2CCCC2)nn1	ZINC000872296968	DD	On-Demand	Anodyne	SCD1	46	34
CC1(C)CCNCCN1C(=O)c1csc(Cc2ccccc2)n1	ZINC000872296984	EF	On-Demand	Anodyne	FFAR2	53	32
CCOc1ccccc1N(C)C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872296986	CE	On-Demand	Anodyne	HCN1	44	34
CCOc1ccccc1N(C)C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872296986	CE	On-Demand	Anodyne	HCN4	40	32
CC1(C)CCNCCN1C(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000872297029	GD	On-Demand	Anodyne	CHRM3	17	45
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000872297031	DE	On-Demand	Anodyne	SIGMAR1	16	47
C=CCOc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1OC	ZINC000872297057	FF	On-Demand	Mild	PDGFRB	23	41
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297060	FG	On-Demand	Anodyne	DRD2	15	43
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297060	FG	On-Demand	Anodyne	DRD3	25	40
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297060	FG	On-Demand	Anodyne	BCHE	21	41
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297060	FG	On-Demand	Anodyne	PLD2	43	37
CC1(C)CCNCCN1C(=O)CN1CCN(c2ccccn2)CC1	ZINC000872297097	EC	On-Demand	Anodyne	DRD4	32	44
CC1(C)CCNCCN1C(=O)CN1CCN(c2ccccn2)CC1	ZINC000872297097	EC	On-Demand	Anodyne	SLC27A1	24	41
CC1(C)CCNCCN1C(=O)c1ccc(N2CCC(O)CC2)cc1	ZINC000872297106	ED	On-Demand	Anodyne	L3MBTL3	15	40
Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCCCc4cccnc43)C2)cc1	ZINC000872297111	GH	On-Demand	Anodyne	L3MBTL3	47	35
O=C(COc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297113	GG	On-Demand	Anodyne	CPT1A	129	48
O=C(COc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297113	GG	On-Demand	Anodyne	CPT2	54	44
CC1(C)CCNCCN1C(=O)c1ccc(N2CCOCC2)c(F)c1	ZINC000872297119	ED	On-Demand	Anodyne	SLC6A9	19	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	ACE	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CELA1	19	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	ELANE	28	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	PTAFR	18	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	UGCG	31	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	KLK3	71	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CTSB	59	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	PAPA1_CARPA	67	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CYSP_TRYCR	54	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CTSK	38	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CTSL	46	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CAPNS1	62	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CTSS	15	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CAPN1	76	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	CAPN2	120	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	TGM2	32	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	NPR	58	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	DPP8	21	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297121	FE	On-Demand	Anodyne	Q6PRC7_IXORI	52	44
CC1(C)CCNCCN1C(=O)COc1cccnc1	ZINC000872297126	CD	On-Demand	Anodyne	CHRNA7	22	44
CC1(C)CCNCCN1C(=O)COc1cccnc1	ZINC000872297126	CD	On-Demand	Anodyne	CPT1A	54	37
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297132	EH	On-Demand	Anodyne	CFTR	40	35
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297132	EH	On-Demand	Anodyne	TYK2	23	42
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297134	EH	On-Demand	Anodyne	CFTR	40	35
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297134	EH	On-Demand	Anodyne	TYK2	23	42
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297138	EH	On-Demand	Anodyne	CFTR	40	35
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297138	EH	On-Demand	Anodyne	TYK2	23	42
CC1(C)CCNCCN1C(=O)c1csc(Nc2ccccn2)n1	ZINC000872297144	EE	On-Demand	Anodyne	KCNN1	25	41
CC1(C)CCNCCN1C(=O)c1csc(Nc2ccccn2)n1	ZINC000872297144	EE	On-Demand	Anodyne	TRPC6	58	36
CC1(C)CCNCCN1C(=O)c1csc(Nc2ccccn2)n1	ZINC000872297144	EE	On-Demand	Anodyne	TRPC3	51	36
O=C(Cc1ccc(-n2cnnn2)cc1)N1CCCCc2cccnc21	ZINC000872297150	ED	On-Demand	Anodyne	KCNJ1	69	47
CC1(C)CCNCCN1C(=O)c1cccc(CN2CCOCC2)c1	ZINC000872297151	ED	On-Demand	Anodyne	CHRM3	19	44
CC1(C)CCNCCN1C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000872297158	GD	On-Demand	Anodyne	NAMPT	47	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CS(=O)(=O)N1CCCC1	ZINC000872297168	GE	On-Demand	Anodyne	TMPRSS11D	40	33
O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872297177	EF	On-Demand	Bother	CPT1A	40	43
CC1(C)CCNCCN1C(=O)c1ccc(NC2CC2)nc1	ZINC000872297190	CD	On-Demand	Anodyne	PRKD1	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000872297192	FC	On-Demand	Anodyne	L3MBTL3	72	39
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	HTR1A	83	49
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	DRD2	53	49
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	DRD4	37	41
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	ADRA1D	20	44
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	HTR2A	49	49
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	ADRA1A	29	44
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	ADRA1B	24	44
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	DRD3	57	42
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	DRD5	19	42
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	HTR7	111	47
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	SIGMAR1	18	44
CC1(C)CCNCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000872297220	FE	On-Demand	Anodyne	CYP2J2	43	30
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	HTR1A	53	50
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	DRD2	30	45
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	DRD4	30	41
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	HTR2A	30	45
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	DRD3	32	40
CC1(C)CCNCCN1C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872297224	ED	On-Demand	Anodyne	HTR7	66	44
COc1ccc2c(c1)C[C@H](C(=O)N1CCCCc3cccnc31)CO2	ZINC000872297228	EG	On-Demand	Anodyne	ROCK2	37	48
COc1ccc2c(c1)C[C@@H](C(=O)N1CCCCc3cccnc31)CO2	ZINC000872297229	EG	On-Demand	Anodyne	ROCK2	37	48
CC1(C)CCNCCN1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872297230	FF	On-Demand	Anodyne	TGFBR1	15	43
CC1(C)CCNCCN1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872297230	FF	On-Demand	Anodyne	TRPC6	28	40
CC1(C)CCNCCN1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872297230	FF	On-Demand	Anodyne	TRPC3	31	40
CC1(C)CCNCCN1C(=O)c1cc(OCc2ccccc2)ccn1	ZINC000872297241	EF	On-Demand	Anodyne	SLC12A5	58	33
CC1(C)CCNCCN1C(=O)c1cccc(CN2CCCC2)c1	ZINC000872297247	DE	On-Demand	Anodyne	CHRM3	21	46
CC1(C)CCNCCN1C(=O)c1cccc(CN2CCCC2)c1	ZINC000872297247	DE	On-Demand	Anodyne	PARP1	16	42
CC1(C)CCNCCN1C(=O)c1ccc(-n2cnc3ccccc32)cc1	ZINC000872297248	EG	On-Demand	Anodyne	HPGD	48	42
O=C(COCCOc1ccccc1)N1CCCCc2cccnc21	ZINC000872297251	EF	On-Demand	Anodyne	CPT1A	75	37
O=C(CCc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297253	GH	On-Demand	Anodyne	GRIN2B	16	51
O=C(CCc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297253	GH	On-Demand	Anodyne	C3AR1	44	44
O=C(CCc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297253	GH	On-Demand	Anodyne	PREP	70	39
O=C(CCc1ccccc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872297253	GH	On-Demand	Anodyne	FAAH	25	46
CC1(C)CCNCCN1C(=O)C1CCN(c2cnccn2)CC1	ZINC000872297262	DD	On-Demand	Anodyne	KARS	55	39
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872297265	EE	On-Demand	Anodyne	SLC6A1	150	39
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872297265	EE	On-Demand	Anodyne	SIGMAR1	55	44
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872297266	EE	On-Demand	Anodyne	SLC6A1	150	39
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872297266	EE	On-Demand	Anodyne	SIGMAR1	55	44
CN1CCN(C(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872297288	FF	On-Demand	Anodyne	GPR119	39	41
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872297290	FF	On-Demand	Anodyne	GPR119	39	41
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297303	EF	On-Demand	Anodyne	SLC6A1	109	41
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297303	EF	On-Demand	Anodyne	CHRM3	17	41
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297303	EF	On-Demand	Anodyne	MLNR	56	44
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297303	EF	On-Demand	Anodyne	CACNA1G	24	41
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297304	EF	On-Demand	Anodyne	SLC6A1	109	41
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297304	EF	On-Demand	Anodyne	CHRM3	17	41
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297304	EF	On-Demand	Anodyne	MLNR	56	44
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000872297304	EF	On-Demand	Anodyne	CACNA1G	24	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)NC1CCCCC1	ZINC000872297333	DD	On-Demand	Anodyne	EPHX2	19	50
CC1(C)CCNCCN1C(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21	ZINC000872297337	GD	On-Demand	Anodyne	PDE6D	44	32
CN1CCN(C(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)Cc2cccnc21	ZINC000872297343	GD	On-Demand	Anodyne	SFRP1	84	39
CC1(C)CCNCCN1C(=O)Cc1csc(NC(=O)Cc2cccs2)n1	ZINC000872297347	GF	On-Demand	Anodyne	CA5B	28	40
CC1(C)CCNCCN1C(=O)Cc1csc(NC(=O)Cc2cccs2)n1	ZINC000872297347	GF	On-Demand	Anodyne	CA5A	28	40
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000872297349	ED	On-Demand	Anodyne	SLC6A1	64	32
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000872297350	ED	On-Demand	Anodyne	SLC6A1	64	32
CC(=O)N1CCc2cc(C(=O)N3CCN(C)c4ncccc4C3)ccc21	ZINC000872297364	FE	On-Demand	Anodyne	HSD17B3	50	33
CC(=O)N1CCc2cc(C(=O)N3CCN(C)c4ncccc4C3)ccc21	ZINC000872297364	FE	On-Demand	Anodyne	EIF2AK3	42	33
O=C(Cc1ccc(-n2cccn2)cc1)N1CCCCc2cccnc21	ZINC000872297383	EG	On-Demand	Anodyne	AMP1_PLAFQ	51	35
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297387	EH	On-Demand	Anodyne	AVPR2	91	47
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297387	EH	On-Demand	Anodyne	AVPR1A	36	47
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297387	EH	On-Demand	Anodyne	TRPV1	17	42
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297388	EH	On-Demand	Anodyne	AVPR2	91	47
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297388	EH	On-Demand	Anodyne	AVPR1A	36	47
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297388	EH	On-Demand	Anodyne	TRPV1	17	42
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297390	EH	On-Demand	Anodyne	AVPR2	91	47
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297390	EH	On-Demand	Anodyne	AVPR1A	36	47
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297390	EH	On-Demand	Anodyne	TRPV1	17	42
O=C(Nc1cccc(OCC(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872297396	FG	On-Demand	Anodyne	CPT1A	100	39
O=C(Nc1cccc(OCC(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872297396	FG	On-Demand	Anodyne	CPT2	43	35
O=C(Nc1cccc(OCC(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872297396	FG	On-Demand	Anodyne	EPHX2	19	48
O=C(Nc1cccc(OCC(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872297396	FG	On-Demand	Anodyne	TYK2	44	35
O=C(Nc1cccc(OCC(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872297396	FG	On-Demand	Anodyne	LIMK2	23	42
O=C1CCCCN1Cc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297400	FH	On-Demand	Anodyne	AVPR2	38	43
O=C(CCCc1nc(-c2cccs2)no1)N1CCCCc2cccnc21	ZINC000872297401	FH	On-Demand	Anodyne	ETHR	42	41
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297405	FE	On-Demand	Anodyne	MC4R	48	37
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297405	FE	On-Demand	Anodyne	CCR1	59	42
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297406	FE	On-Demand	Anodyne	MC4R	48	37
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872297406	FE	On-Demand	Anodyne	CCR1	59	42
COc1ccc(-c2cncc(C(=O)N3CCNCCC3(C)C)c2)cc1	ZINC000872297426	EF	On-Demand	Anodyne	CYP11B2	25	45
COc1ccc(-c2cncc(C(=O)N3CCNCCC3(C)C)c2)cc1	ZINC000872297426	EF	On-Demand	Anodyne	ACVR1	33	46
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CCCCc2cccnc21	ZINC000872297434	GE	On-Demand	Anodyne	LPL	45	35
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(CNC(=O)c2ccccn2)CC1	ZINC000872297439	FD	On-Demand	Anodyne	HTR4	41	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(CNC(=O)c2ccccn2)CC1	ZINC000872297439	FD	On-Demand	Anodyne	GRIN2B	33	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(CNC(=O)c2ccccn2)CC1	ZINC000872297439	FD	On-Demand	Anodyne	CACNA1I	53	34
CCOc1ccc(CCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872297468	DH	On-Demand	Anodyne	NOD2	24	40
COc1ccc(Nc2nc(C(=O)N3CCNCCC3(C)C)cs2)cc1	ZINC000872297489	FG	On-Demand	Anodyne	TRPC6	72	57
COc1ccc(Nc2nc(C(=O)N3CCNCCC3(C)C)cs2)cc1	ZINC000872297489	FG	On-Demand	Anodyne	TRPC3	63	57
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000872297500	FF	On-Demand	Anodyne	RPS6KA3	30	42
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000872297500	FF	On-Demand	Anodyne	CSF1R	16	41
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000872297500	FF	On-Demand	Anodyne	KARS	31	44
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000872297500	FF	On-Demand	Anodyne	KCNK3	81	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCNc1cccc(F)c1	ZINC000872297505	DF	On-Demand	Anodyne	TBK1	42	49
CCC(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297512	DG	On-Demand	Anodyne	AVPR2	43	40
Cc1nn(CC(=O)N2CCCCc3cccnc32)c(C)c1Cl	ZINC000872297514	DF	On-Demand	Anodyne	CCR1	16	41
CNC(=O)COc1ccc(C(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872297540	FE	On-Demand	Anodyne	AVPR2	48	39
O=C(c1ccc(OCC2CC2)cc1)N1CCCCc2cccnc21	ZINC000872297543	DH	On-Demand	Anodyne	AVPR2	33	41
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCNCCC1(C)C	ZINC000872297561	EF	On-Demand	Anodyne	PPARG	85	43
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCNCCC1(C)C	ZINC000872297561	EF	On-Demand	Anodyne	PPARA	90	43
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCNCCC1(C)C	ZINC000872297561	EF	On-Demand	Anodyne	PDE8B	62	35
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	CHRM2	19	40
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	DRD2	19	43
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	DRD4	52	43
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	ACHE	49	44
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	CHRM3	28	41
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	LTA4H	19	41
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	HRH3	15	49
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	SIGMAR1	87	48
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	CACNA1G	34	44
CC1(C)CCNCCN1C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000872297566	EE	On-Demand	Anodyne	CCR8	19	42
CCSCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297568	EI	On-Demand	Anodyne	AVPR2	56	45
CCSCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297568	EI	On-Demand	Anodyne	AVPR1A	16	42
COc1cccc(OCC(=O)N2CCCCc3cccnc32)c1	ZINC000872297571	DF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCC(=O)N2CCCCc3cccnc32)c1	ZINC000872297571	DF	On-Demand	Anodyne	CPT1A	83	38
COCCOc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297572	EG	On-Demand	Anodyne	DRD4	43	33
COCCOc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297572	EG	On-Demand	Anodyne	AVPR2	43	44
O=C(CCCOCCc1ccccc1)N1CCCCc2cccnc21	ZINC000872297573	EH	On-Demand	Anodyne	PREP	46	40
O=C([C@H]1CC(=O)N(C2CCCCC2)C1)N1CCCCc2cccnc21	ZINC000872297591	EF	On-Demand	Anodyne	INHA	22	44
O=C([C@@H]1CC(=O)N(C2CCCCC2)C1)N1CCCCc2cccnc21	ZINC000872297592	EF	On-Demand	Anodyne	INHA	22	44
CC1(C)CCNCCN1C(=O)COCC(=O)NCc1cccnc1	ZINC000872297622	EC	On-Demand	Anodyne	NAMPT	52	45
O=C1CCc2cc(OCCCC(=O)N3CCCCc4cccnc43)ccc2N1	ZINC000872297628	GG	On-Demand	Anodyne	DRD2	18	43
CC1(C)CCNCCN1C(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872297640	FF	On-Demand	Anodyne	TGFBR1	15	43
CCOc1ccccc1C(=O)NCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872297675	GE	On-Demand	Anodyne	HCN1	82	46
CCOc1ccccc1C(=O)NCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872297675	GE	On-Demand	Anodyne	HCN4	58	39
O=C(Cc1ccc2c(c1)OCO2)N1CCCCc2cccnc21	ZINC000872297690	DF	On-Demand	Anodyne	NOS2	89	36
CC1(C)CCNCCN1C(=O)COc1ccc(Oc2ccccn2)cc1	ZINC000872297703	FF	On-Demand	Anodyne	CPT1A	82	37
O=C(NCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297713	EF	On-Demand	Anodyne	BCHE	20	40
O=C(NCCC(=O)N1CCCCc2cccnc21)c1ccc(F)cc1	ZINC000872297713	EF	On-Demand	Anodyne	PLD2	45	38
C=CC(=O)NCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297721	EF	On-Demand	Anodyne	AVPR2	38	46
C=CC(=O)NCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297721	EF	On-Demand	Anodyne	NAMPT	24	40
O=C(c1cccc2c1OCO2)N1CCCCc2cccnc21	ZINC000872297735	CF	On-Demand	Anodyne	G2YM83_BOTF4	40	35
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	CA2	27	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	CA1	21	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	CCR3	15	45
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	MMP2	18	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	MMP9	26	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	CA12	15	44
COc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297739	JI	On-Demand	Anodyne	CA9	25	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	CA2	27	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	CA1	21	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	CCR3	15	45
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	MMP2	18	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	MMP9	26	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	CA12	15	44
COc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c2c[nH]c3ccccc23)cc1	ZINC000872297740	JI	On-Demand	Anodyne	CA9	25	44
CC1(C)CCNCCN1C(=O)c1cnc2ccccc2n1	ZINC000872297751	CD	On-Demand	Anodyne	HTR3A	16	53
Cc1oc(-c2cccs2)nc1CC(=O)N1CCNCCC1(C)C	ZINC000872297754	EF	On-Demand	Anodyne	PPARA	36	40
CN1CCN(C(=O)c2cc(Cl)ccc2F)Cc2cccnc21	ZINC000872297759	DF	On-Demand	Anodyne	P2RX7	52	42
CN1CCN(C(=O)c2cc(Cl)ccc2F)Cc2cccnc21	ZINC000872297759	DF	On-Demand	Anodyne	PARP1	50	40
O=C(c1ccc(Cl)nc1Cl)N1CCCCc2cccnc21	ZINC000872297764	DH	On-Demand	Anodyne	AVPR2	24	43
CCCOc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297776	DH	On-Demand	Anodyne	AVPR2	37	40
CC1(C)CCNCCN1C(=O)c1csc(-c2cnccn2)n1	ZINC000872297785	DD	On-Demand	Anodyne	KARS	49	31
O=C(CCc1nc(-c2ccccn2)no1)N1CCCCc2cccnc21	ZINC000872297786	EF	On-Demand	Anodyne	HCAR2	33	40
CC1(C)CCNCCN1C(=O)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000872297787	EH	On-Demand	Anodyne	SCN2A	19	40
CC1(C)CCNCCN1C(=O)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000872297787	EH	On-Demand	Anodyne	SCN10A	46	42
CN1CCN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)Cc2cccnc21	ZINC000872297789	GD	On-Demand	Anodyne	CA6	21	50
CN1CCN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)Cc2cccnc21	ZINC000872297789	GD	On-Demand	Anodyne	CA7	23	50
CN1CCN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)Cc2cccnc21	ZINC000872297789	GD	On-Demand	Anodyne	CA13	44	50
CC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872297795	CG	On-Demand	Anodyne	AVPR2	60	48
COC(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872297796	DF	On-Demand	Anodyne	AVPR2	46	40
O=C(CSCc1cccnc1)N1CCCCc2cccnc21	ZINC000872297808	DG	On-Demand	Anodyne	CHRNA7	44	38
COc1ccc(-c2noc(CCCC(=O)N3CCCCc4cccnc43)n2)cc1	ZINC000872297810	GH	On-Demand	Anodyne	CPT1A	25	41
CC1(C)CCNCCN1C(=O)c1ccc2c(c1)CCNCC2	ZINC000872297816	DD	On-Demand	Anodyne	RARA	40	30
CC1(C)CCNCCN1C(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000872297821	ED	On-Demand	Anodyne	L3MBTL3	40	37
CC1(C)CCNCCN1C(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000872297823	ED	On-Demand	Anodyne	L3MBTL3	40	37
CCOC(=O)N1CC[C@@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872297825	CD	On-Demand	Anodyne	CCR8	20	42
CCOC(=O)N1CC[C@H](NC(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872297827	CD	On-Demand	Anodyne	CCR8	20	42
O=C(CCCc1ccccc1)N1CCCCc2cccnc21	ZINC000872297865	CH	On-Demand	Anodyne	PREP	59	46
O=C(CCCc1ccccc1)N1CCCCc2cccnc21	ZINC000872297865	CH	On-Demand	Anodyne	FAAH	52	39
O=C(CCCc1ccccc1)N1CCCCc2cccnc21	ZINC000872297865	CH	On-Demand	Anodyne	CES1	58	37
C[C@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@@H](C)O1	ZINC000872297867	GH	On-Demand	Anodyne	AVPR2	40	39
C[C@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@@H](C)O1	ZINC000872297867	GH	On-Demand	Anodyne	NOD2	42	36
C[C@@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@@H](C)O1	ZINC000872297869	GH	On-Demand	Anodyne	AVPR2	40	39
C[C@@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@@H](C)O1	ZINC000872297869	GH	On-Demand	Anodyne	NOD2	42	36
C[C@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@H](C)O1	ZINC000872297871	GH	On-Demand	Anodyne	AVPR2	40	39
C[C@H]1CN(Cc2ccc(C(=O)N3CCCCc4cccnc43)cc2)C[C@H](C)O1	ZINC000872297871	GH	On-Demand	Anodyne	NOD2	42	36
CC(=O)Nc1nc(C(=O)N2CCCCc3cccnc32)cs1	ZINC000872297882	DE	On-Demand	Anodyne	TRPC6	61	41
CC(=O)Nc1nc(C(=O)N2CCCCc3cccnc32)cs1	ZINC000872297882	DE	On-Demand	Anodyne	TRPC3	55	40
CC1(C)CCNCCN1C(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000872297895	ED	On-Demand	Anodyne	L3MBTL3	45	37
COc1cccc(SCC(=O)N2CCCCc3cccnc32)c1	ZINC000872297905	EH	On-Demand	Anodyne	DRD4	42	32
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1cccnc1	ZINC000872297923	EC	On-Demand	Anodyne	TBXAS1	42	37
CC1(C)CCNCCN1C(=O)CCCOc1cccnc1	ZINC000872297927	CD	On-Demand	Anodyne	CHRNA7	19	42
CCO[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1	ZINC000872297946	DF	On-Demand	Anodyne	AMY2	53	38
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	ZINC000872297950	GG	On-Demand	Anodyne	TAAR1	45	37
CC1(C)CCNCCN1C(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	ZINC000872297950	GG	On-Demand	Anodyne	KCNK3	73	34
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000872297952	EE	On-Demand	Anodyne	F2	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000872297953	EE	On-Demand	Anodyne	F2	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000872297962	FF	On-Demand	Anodyne	SPHK1	38	45
O=C(Cc1ccccc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872297969	GG	On-Demand	Anodyne	PREP	64	37
O=C(Cc1ccccc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872297970	GG	On-Demand	Anodyne	PREP	64	37
C[C@@H](CCCc1ccccc1)C(=O)N1CCNCCC1(C)C	ZINC000872298089	DG	On-Demand	Anodyne	GHRHR	47	39
CC1(C)CCNCCN1C(=O)CNC(=O)c1sc2ccccc2c1Cl	ZINC000872298105	GF	On-Demand	Anodyne	FFAR2	41	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCCS(=O)(=O)CCc1ccccc1	ZINC000872298114	FD	On-Demand	Anodyne	FKBP1A	20	43
CC1(C)CCNCCN1C(=O)Cc1cccc(OCC(F)(F)F)c1	ZINC000872298121	EF	On-Demand	Anodyne	BRS3	32	47
COC(=O)[C@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccc(F)cc1	ZINC000872298125	EE	On-Demand	Anodyne	SLC6A3	24	45
COC(=O)[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccc(F)cc1	ZINC000872298128	EE	On-Demand	Anodyne	SLC6A3	24	45
O=C(c1ccc(SC(F)F)cc1)N1CCCCc2cccnc21	ZINC000872298134	EI	On-Demand	Anodyne	AVPR2	27	43
CC1(C)CCNCCN1C(=O)c1ccc(N)cn1	ZINC000872298143	BC	On-Demand	Anodyne	CCR8	16	41
CC1(C)CCNCCN1C(=O)Cc1ccc2c(c1)NC(=O)C2	ZINC000872298183	DD	On-Demand	Anodyne	FFAR2	44	32
CC1(C)CCNCCN1C(=O)c1cc(S(C)(=O)=O)ccc1F	ZINC000872298192	ED	On-Demand	Anodyne	SLC6A9	36	40
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccc(F)c(F)c1	ZINC000872298209	ED	On-Demand	Anodyne	PLD1	23	42
O=C(c1ccc(Cn2cccn2)cc1)N1CCCCc2cccnc21	ZINC000872298240	EG	On-Demand	Anodyne	AVPR2	36	45
O=C(c1ccnc(Cl)c1)N1CCCCc2cccnc21	ZINC000872298263	CG	On-Demand	Anodyne	AVPR2	38	40
CN1CCN(C(=O)c2cccnc2O)Cc2cccnc21	ZINC000872298280	CD	On-Demand	Anodyne	P2RX7	23	42
O=C(c1ccoc1)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872298293	FF	On-Demand	Anodyne	L3MBTL3	62	35
CC1(C)CCNCCN1C(=O)CNC(=O)c1cccc(Cl)c1	ZINC000872298317	DD	On-Demand	Anodyne	DRD4	42	34
CC1(C)CCNCCN1C(=O)CNC(=O)c1cccc(Cl)c1	ZINC000872298317	DD	On-Demand	Anodyne	CACNA1I	56	43
CS(=O)(=O)NCCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298330	FE	On-Demand	Anodyne	AVPR2	38	40
O=C1CCc2cc(OCC(=O)N3CCCCc4cccnc43)ccc2N1	ZINC000872298337	FF	On-Demand	Anodyne	DRD2	15	41
Cn1cnc2cc(C(=O)N3CCNCCC3(C)C)ccc21	ZINC000872298344	CD	On-Demand	Anodyne	HPGD	50	42
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCCc2cccnc21	ZINC000872298355	EH	On-Demand	Anodyne	PPARG	87	45
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCCc2cccnc21	ZINC000872298355	EH	On-Demand	Anodyne	PPARA	92	42
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCCc2cccnc21	ZINC000872298355	EH	On-Demand	Anodyne	PDE8B	64	39
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccccc1OC(F)F	ZINC000872298360	FD	On-Demand	Anodyne	HCN1	79	43
CC1(C)CCNCCN1C(=O)CNC(=O)c1ccccc1OC(F)F	ZINC000872298360	FD	On-Demand	Anodyne	HCN4	54	36
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298376	GG	On-Demand	Anodyne	AVPR2	36	42
CC(=O)N[C@@H](CC(=O)N1CCCCc2cccnc21)c1ccc(Cl)cc1	ZINC000872298387	FH	On-Demand	Anodyne	AKT3	49	37
CN1CCN(C(=O)c2ccc(N3CCOCC3)nc2)Cc2cccnc21	ZINC000872298401	FD	On-Demand	Anodyne	HPGDS	20	42
COc1ccc(-n2nc(C(=O)N3CCNCCC3(C)C)cc2C)cc1	ZINC000872298406	EE	On-Demand	Anodyne	RPA1	17	41
O=C(CCc1ccc2c(c1)OCCO2)N1CCCCc2cccnc21	ZINC000872298436	EG	On-Demand	Anodyne	NOS2	56	32
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298459	GI	On-Demand	Anodyne	AVPR2	40	45
CCOc1ccccc1C(=O)NCC(=O)N1CCNCCC1(C)C	ZINC000872298467	ED	On-Demand	Anodyne	KCNA3	40	45
CCOc1ccccc1C(=O)NCC(=O)N1CCNCCC1(C)C	ZINC000872298467	ED	On-Demand	Anodyne	HCN1	99	59
CCOc1ccccc1C(=O)NCC(=O)N1CCNCCC1(C)C	ZINC000872298467	ED	On-Demand	Anodyne	HCN4	70	47
O=C(c1cnn2cccnc12)N1CCCCc2cccnc21	ZINC000872298470	CE	On-Demand	Anodyne	AVPR2	15	41
CC(C)(C)C(=O)NCCC(=O)N1CCCCc2cccnc21	ZINC000872298478	DE	On-Demand	Anodyne	SIRT2	20	41
COC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298481	EG	On-Demand	Anodyne	AVPR2	100	53
COC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298481	EG	On-Demand	Anodyne	AVPR1A	38	50
COC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298481	EG	On-Demand	Anodyne	TRPV1	20	40
COC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298481	EG	On-Demand	Anodyne	NOD2	41	36
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA2	37	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA1	23	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA7	29	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA4	16	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA14	16	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA12	19	43
CC1(C)CCNCCN1C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000872298494	DC	On-Demand	Anodyne	CA9	21	43
O=C(c1ccoc1)N1CCCCc2cccnc21	ZINC000872298506	BF	On-Demand	Anodyne	AVPR2	26	42
CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872298508	FD	On-Demand	Clean	CTSK	17	48
CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872298508	FD	On-Demand	Clean	TMPRSS11D	50	33
CC1(C)CCNCCN1C(=O)Cc1cccc(OCc2cccnc2)c1	ZINC000872298517	FF	On-Demand	Anodyne	CHRNA7	23	41
O=C(c1ccc(Cl)cc1F)N1CCCCc2cccnc21	ZINC000872298539	DH	On-Demand	Anodyne	CNR1	50	31
O=C(c1ccc(Cl)cc1F)N1CCCCc2cccnc21	ZINC000872298539	DH	On-Demand	Anodyne	AVPR2	40	45
O=C(c1ccc(Cl)cc1F)N1CCCCc2cccnc21	ZINC000872298539	DH	On-Demand	Anodyne	GPBAR1	23	48
COc1cc2c(cc1OC)CN(CC(=O)N1CCNCCC1(C)C)CC2	ZINC000872298540	FD	On-Demand	Anodyne	ABCB1B	60	37
COc1cc2c(cc1OC)CN(CC(=O)N1CCNCCC1(C)C)CC2	ZINC000872298540	FD	On-Demand	Anodyne	ABCB1	22	41
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872298568	FE	On-Demand	Anodyne	PTAFR	37	56
CC1(C)CCNCCN1C(=O)Cc1ccc(F)cc1Cl	ZINC000872298575	CF	On-Demand	Anodyne	P2RX7	60	40
O=C([C@@H]1COc2ccccc2C1)N1CCCCc2cccnc21	ZINC000872298580	DG	On-Demand	Anodyne	ROCK2	22	42
O=C([C@H]1COc2ccccc2C1)N1CCCCc2cccnc21	ZINC000872298582	DG	On-Demand	Anodyne	ROCK2	22	42
O=C(c1ccc(C(F)(F)F)nc1)N1CCCCc2cccnc21	ZINC000872298596	DG	On-Demand	Anodyne	AVPR2	27	40
O=C(c1ccc(C(F)(F)F)nc1)N1CCCCc2cccnc21	ZINC000872298596	DG	On-Demand	Anodyne	TRPV1	15	43
Cn1c(C(=O)N2CCCCc3cccnc32)cc(Cl)c1Cl	ZINC000872298606	DH	On-Demand	Anodyne	AVPR2	23	40
Cc1sc2ncn(CCC(=O)N3CCN(C)c4ncccc4C3)c(=O)c2c1C	ZINC000872298607	GE	On-Demand	Anodyne	HTR1B	17	40
COc1ccc(-c2nc(C(=O)N3CCCCc4cccnc43)cs2)cc1	ZINC000872298610	FI	On-Demand	Anodyne	TRPC6	30	42
O=C(Cc1ccc(C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872298645	EI	On-Demand	Anodyne	TRPV1	35	45
CC1(C)CCNCCN1C(=O)CCC(=O)N1CCN(c2ccccc2)CC1	ZINC000872298663	FD	On-Demand	Anodyne	SSTR1	44	44
CC1(C)CCNCCN1C(=O)c1ccc(=O)n(-c2ccccc2F)n1	ZINC000872298670	ED	On-Demand	Anodyne	CTSA	48	32
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1cccs1	ZINC000872298674	FE	On-Demand	Anodyne	PTAFR	25	45
Cc1c(C(=O)N2CCCCc3cccnc32)cnn1-c1ccccc1F	ZINC000872298700	FH	On-Demand	Anodyne	AVPR2	44	39
Cc1c(C(=O)N2CCCCc3cccnc32)cnn1-c1ccccc1F	ZINC000872298700	FH	On-Demand	Anodyne	GPBAR1	15	41
O=C(CCc1ncc(-c2ccccc2)o1)N1CCCCc2cccnc21	ZINC000872298706	EI	On-Demand	Anodyne	FAAH	41	38
C[C@@H]1Oc2ccccc2N(CCC(=O)N2CCCCc3cccnc32)C1=O	ZINC000872298709	FF	On-Demand	Anodyne	GHRL	62	33
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872298719	GG	On-Demand	Anodyne	AVPR2	28	43
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccc(C)cc1	ZINC000872298721	FE	On-Demand	Anodyne	PTAFR	23	50
O=C(Cc1csc(-c2ccccc2)n1)N1CCCCc2cccnc21	ZINC000872298728	EI	On-Demand	Anodyne	CPT1A	19	41
O=C(c1cccc(S(=O)(=O)NC2CCCC2)c1)N1CCCCc2cccnc21	ZINC000872298745	GG	On-Demand	Anodyne	AKR1C3	54	35
O=C(c1cccc(S(=O)(=O)NC2CCCC2)c1)N1CCCCc2cccnc21	ZINC000872298745	GG	On-Demand	Anodyne	SFRP1	108	38
O=C(c1cccc(S(=O)(=O)NC2CCCC2)c1)N1CCCCc2cccnc21	ZINC000872298745	GG	On-Demand	Anodyne	WNT3	74	36
C=CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298758	DH	On-Demand	Mild	AVPR2	32	43
CCOC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298773	EH	On-Demand	Anodyne	AVPR2	96	50
CCOC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298773	EH	On-Demand	Anodyne	AVPR1A	38	47
CCOC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298773	EH	On-Demand	Anodyne	TRPV1	18	42
CCOC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298773	EH	On-Demand	Anodyne	NOD1	15	41
CCOC(=O)Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872298773	EH	On-Demand	Anodyne	NOD2	43	41
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ncc(C2CCNCC2)s1	ZINC000872298778	DE	On-Demand	Anodyne	CDK5	53	45
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCNCCC1(C)C	ZINC000872298784	DG	On-Demand	Anodyne	MC4R	21	41
CN1CCN(C(=O)c2ccc(Cl)cc2F)Cc2cccnc21	ZINC000872298785	DF	On-Demand	Anodyne	P2RX7	50	46
CC1(C)CCNCCN1C(=O)c1ccc(-n2cnc3ccccc32)nc1	ZINC000872298795	EF	On-Demand	Anodyne	HPGD	40	34
O=C(Cc1ccccc1)NCCC(=O)N1CCCCc2cccnc21	ZINC000872298813	EE	On-Demand	Anodyne	AVPR2	25	42
C=C1c2ccccc2C(=O)N1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872298814	ED	On-Demand	Anodyne	CHRM2	15	42
O=C1CCCN1c1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872298820	FF	On-Demand	Anodyne	CPT1A	33	41
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1OC1CCCC1	ZINC000872298823	EG	On-Demand	Anodyne	PDE4A	44	47
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1OC1CCCC1	ZINC000872298823	EG	On-Demand	Anodyne	PDE4B	26	47
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1OC1CCCC1	ZINC000872298823	EG	On-Demand	Anodyne	PDE4D	34	47
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1OC1CCCC1	ZINC000872298823	EG	On-Demand	Anodyne	PDE4C	18	47
O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N1CCCCc2cccnc21	ZINC000872298849	GI	On-Demand	Anodyne	CPT1A	17	40
O=C(c1ccc(F)cc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872298858	GG	On-Demand	Anodyne	SLC18A3	19	40
O=C(c1ccc(F)cc1)N1CCC[C@@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872298858	GG	On-Demand	Anodyne	L3MBTL3	43	35
O=C(c1ccc(F)cc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872298859	GG	On-Demand	Anodyne	SLC18A3	19	40
O=C(c1ccc(F)cc1)N1CCC[C@H](C(=O)N2CCCCc3cccnc32)C1	ZINC000872298859	GG	On-Demand	Anodyne	L3MBTL3	43	35
O=C(c1ccc(N2CCCS2(=O)=O)cc1)N1CCCCc2cccnc21	ZINC000872298860	FF	On-Demand	Anodyne	AVPR2	23	46
CN1CCN(C(=O)Cn2c(=O)nc(O)c3ccccc32)Cc2cccnc21	ZINC000872298867	FC	On-Demand	Anodyne	FABI	41	31
CCNS(=O)(=O)c1ccc(CC(=O)N2CCNCCC2(C)C)cc1	ZINC000872298874	FD	On-Demand	Anodyne	MMP10	46	32
CN1CCN(C(=O)c2cccnc2S)Cc2cccnc21	ZINC000872298876	DD	On-Demand	Anodyne	P2RX7	22	42
COc1ccc(-c2noc(CCC(=O)N3CCCCc4cccnc43)n2)cc1	ZINC000872298884	GG	On-Demand	Anodyne	CPT1A	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	ACE	31	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	AVPR2	20	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CELA1	25	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	ELANE	32	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	MME	18	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTRA_BOVIN	50	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	KLK3	73	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTSB	59	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	PAPA1_CARPA	68	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CYSP_TRYCR	54	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTSG	40	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTSK	43	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTSL	48	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	PREP	20	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CAPNS1	67	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CELA2A	48	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CTSS	18	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CAPN1	75	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	CAPN2	119	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	TGM2	31	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	TPSAB1	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	NPR	65	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	Q6PRC7_IXORI	35	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCCc2cccnc21	ZINC000872298903	FG	On-Demand	Anodyne	SLC12A5	52	33
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872298908	GD	On-Demand	Anodyne	P2RX7	21	41
C[C@H](Cc1ccccc1Cl)C(=O)N1CCNCCC1(C)C	ZINC000872298921	DG	On-Demand	Anodyne	SLC6A2	15	44
C[C@@H](Cc1ccccc1Cl)C(=O)N1CCNCCC1(C)C	ZINC000872298922	DG	On-Demand	Anodyne	SLC6A2	15	44
Cc1oc(-c2cccs2)nc1CC(=O)N1CCCCc2cccnc21	ZINC000872298947	FI	On-Demand	Anodyne	PPARA	36	41
COc1cccc(C(=O)NCC(=O)N2CCNCCC2(C)C)c1	ZINC000872298957	DD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCC(=O)N2CCNCCC2(C)C)c1	ZINC000872298957	DD	On-Demand	Anodyne	TAAR1	29	40
CN1CCN(C(=O)c2ccc(Cn3cncn3)cc2)Cc2cccnc21	ZINC000872298959	ED	On-Demand	Anodyne	FABI	44	34
COc1ccc2c(C)c(CCC(=O)N3CCCCc4cccnc43)c(=O)oc2c1	ZINC000872298965	GH	On-Demand	Anodyne	MAOB	33	41
COc1ccc2c(C)c(CCC(=O)N3CCCCc4cccnc43)c(=O)oc2c1	ZINC000872298965	GH	On-Demand	Anodyne	NQO1	32	42
O=C(C1CCN(c2nc3ccccc3o2)CC1)N1CCCCc2cccnc21	ZINC000872298975	GH	On-Demand	Anodyne	SORD	18	43
O=C1CCCN1c1cc(C(=O)N2CCCCc3cccnc32)ccc1Cl	ZINC000872298996	FH	On-Demand	Anodyne	AVPR2	46	41
CC(=O)N1CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872298997	EF	On-Demand	Anodyne	AVPR2	50	46
CC(=O)N1CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872298997	EF	On-Demand	Anodyne	HSD17B3	41	32
CC1(C)CCNCCN1C(=O)c1cc(Cc2ccccc2)[nH]n1	ZINC000872299004	DE	On-Demand	Anodyne	HAO2	74	32
CNC(=O)COc1cccc(CC(=O)N2CCNCCC2(C)C)c1	ZINC000872299017	EC	On-Demand	Anodyne	UPP1	55	32
CC(=O)c1ccc(OCCCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872299036	FF	On-Demand	Anodyne	HRH3	21	44
CC1(C)CCNCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000872299044	CF	On-Demand	Anodyne	FFAR2	59	37
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccc(Cl)cc1	ZINC000872299047	GF	On-Demand	Anodyne	PTAFR	19	47
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccc(Cl)cc1	ZINC000872299047	GF	On-Demand	Anodyne	AKT3	59	35
COc1ccc([C@H](CC(=O)N2CCN(C)c3ncccc3C2)NC(C)=O)cc1	ZINC000872299058	GE	On-Demand	Anodyne	PTAFR	18	46
COc1ccc([C@@H](CC(=O)N2CCN(C)c3ncccc3C2)NC(C)=O)cc1	ZINC000872299059	GE	On-Demand	Anodyne	PTAFR	18	46
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872299077	FG	On-Demand	Anodyne	PPARG	80	42
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872299077	FG	On-Demand	Anodyne	PPARA	84	42
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872299077	FG	On-Demand	Anodyne	PDE8B	61	38
CCCOc1cccc(CC(=O)N2CCNCCC2(C)C)c1	ZINC000872299101	DF	On-Demand	Anodyne	BRS3	24	43
CCCOc1cccc(CC(=O)N2CCNCCC2(C)C)c1	ZINC000872299101	DF	On-Demand	Anodyne	UPP1	51	39
CCCOc1cccc(CC(=O)N2CCNCCC2(C)C)c1	ZINC000872299101	DF	On-Demand	Anodyne	PLA2G4B	30	42
COc1cc(N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)ccc1F	ZINC000872299104	EE	On-Demand	Anodyne	SSTR1	41	42
COc1cc(N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)ccc1F	ZINC000872299104	EE	On-Demand	Anodyne	SSTR3	22	42
COc1cc(N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)ccc1F	ZINC000872299104	EE	On-Demand	Anodyne	PDE7A	30	40
COc1cc(N2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)ccc1F	ZINC000872299104	EE	On-Demand	Anodyne	TTK	34	41
COc1ccc(C(=O)N2CCNCCC2(C)C)cc1-c1ccccn1	ZINC000872299106	EF	On-Demand	Anodyne	ACACA	15	40
O=C(CCc1nc(-c2cccs2)no1)N1CCCCc2cccnc21	ZINC000872299107	FG	On-Demand	Anodyne	ETHR	48	42
CC1(C)CCNCCN1C(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872299108	FG	On-Demand	Anodyne	RARA	17	40
CC1(C)CCNCCN1C(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872299108	FG	On-Demand	Anodyne	AVPR2	65	42
CC1(C)CCNCCN1C(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872299108	FG	On-Demand	Anodyne	AVPR1A	39	41
CC1(C)CCNCCN1C(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872299108	FG	On-Demand	Anodyne	PRNP	61	40
CC1(C)CCNCCN1C(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000872299108	FG	On-Demand	Anodyne	KCNK3	58	39
O=C(c1ccc(Cn2cncn2)cc1)N1CCCCc2cccnc21	ZINC000872299114	EF	On-Demand	Anodyne	AVPR2	27	40
COc1ccc(C(=O)N2CCCCc3cccnc32)cn1	ZINC000872299138	CE	On-Demand	Anodyne	AVPR2	36	40
CC1(C)CCNCCN1C(=O)Cc1ccc(Cl)cn1	ZINC000872299148	CD	On-Demand	Anodyne	FFAR2	43	35
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(=O)c1ccccc1	ZINC000872299156	FE	On-Demand	Anodyne	PTAFR	26	43
O=C(c1cc(Cl)ccc1F)N1CCCCc2cccnc21	ZINC000872299183	DH	On-Demand	Anodyne	CNR1	51	31
O=C(c1cc(Cl)ccc1F)N1CCCCc2cccnc21	ZINC000872299183	DH	On-Demand	Anodyne	AVPR2	38	43
O=C(c1cc(Cl)ccc1F)N1CCCCc2cccnc21	ZINC000872299183	DH	On-Demand	Anodyne	GPBAR1	24	49
CN1CCN(C(=O)c2ccc(Cn3cccn3)cc2)Cc2cccnc21	ZINC000872299203	EE	On-Demand	Anodyne	FABI	52	37
CCn1cc(C(=O)N2CCN(C)c3ncccc3C2)c2ccccc21	ZINC000872299205	EG	On-Demand	Anodyne	CNR1	22	48
CCn1cc(C(=O)N2CCN(C)c3ncccc3C2)c2ccccc21	ZINC000872299205	EG	On-Demand	Anodyne	TPSAB1	20	45
O=C(c1ccc(Br)cc1F)N1CCCCc2cccnc21	ZINC000872299206	EH	On-Demand	Anodyne	AVPR2	23	42
CC1(C)CCNCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000872299220	DG	On-Demand	Anodyne	NMBR	67	33
CC1(C)CCNCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000872299220	DG	On-Demand	Anodyne	GHSR	31	41
O=C(c1cccc(S(=O)(=O)NC2CC2)c1)N1CCCCc2cccnc21	ZINC000872299221	FF	On-Demand	Anodyne	AKR1C3	42	33
O=C(c1cccc(S(=O)(=O)NC2CC2)c1)N1CCCCc2cccnc21	ZINC000872299221	FF	On-Demand	Anodyne	SFRP1	114	38
O=C(c1cccc(S(=O)(=O)NC2CC2)c1)N1CCCCc2cccnc21	ZINC000872299221	FF	On-Demand	Anodyne	WNT3	74	36
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872299226	EF	On-Demand	Anodyne	DRD2	17	41
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872299226	EF	On-Demand	Anodyne	AVPR2	26	42
O=C(NCCCC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872299226	EF	On-Demand	Anodyne	DRD3	31	43
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299240	FE	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299240	FE	On-Demand	Anodyne	PREP	93	54
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299240	FE	On-Demand	Anodyne	GPR119	27	40
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299240	FE	On-Demand	Anodyne	SFRP1	43	42
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299240	FE	On-Demand	Anodyne	WNT3	54	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299241	FE	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299241	FE	On-Demand	Anodyne	PREP	93	54
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299241	FE	On-Demand	Anodyne	GPR119	27	40
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299241	FE	On-Demand	Anodyne	SFRP1	43	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872299241	FE	On-Demand	Anodyne	WNT3	54	42
CC1(C)CCNCCN1C(=O)CCc1cccc(C(F)(F)F)c1	ZINC000872299254	EG	On-Demand	Anodyne	TACR1	15	41
COCCn1cc(C(=O)N2CCNCCC2(C)C)c2ccccc21	ZINC000872299256	EF	On-Demand	Anodyne	CNR1	20	56
COCCn1cc(C(=O)N2CCNCCC2(C)C)c2ccccc21	ZINC000872299256	EF	On-Demand	Anodyne	CNR2	29	56
CN1CCN(C(=O)c2c(F)cccc2Cl)Cc2cccnc21	ZINC000872299265	DF	On-Demand	Anodyne	P2RX7	37	43
Cc1ccnn1-c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872299273	EH	On-Demand	Anodyne	AVPR2	44	46
CSc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872299280	CH	On-Demand	Anodyne	AVPR2	43	45
O=C(c1ccsc1)N1CCCCc2cccnc21	ZINC000872299281	CG	On-Demand	Anodyne	AVPR2	28	41
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000872299293	DE	On-Demand	Anodyne	HTR1A	20	40
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000872299293	DE	On-Demand	Anodyne	SLC6A4	28	47
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000872299293	DE	On-Demand	Anodyne	MPO	99	47
O=C(CCc1cccnc1)N1CCCCc2cccnc21	ZINC000872299297	CF	On-Demand	Anodyne	TBXAS1	22	40
O=C(CCc1cccnc1)N1CCCCc2cccnc21	ZINC000872299297	CF	On-Demand	Anodyne	CHRNA7	41	37
O=C(CCc1cccnc1)N1CCCCc2cccnc21	ZINC000872299297	CF	On-Demand	Anodyne	C3AR1	41	44
CC(=O)N1CCC[C@H]1C(=O)N1CCCCc2cccnc21	ZINC000872299302	CD	On-Demand	Anodyne	PREP	86	39
CN1CCN(C(=O)c2cc(Cl)ccn2)Cc2cccnc21	ZINC000872299307	DE	On-Demand	Anodyne	P2RX7	16	41
CC(=O)Nc1ccc(CC(=O)N2CCCCc3cccnc32)cc1	ZINC000872299311	DF	On-Demand	Anodyne	AVPR2	28	41
CC(=O)Nc1ccc(CC(=O)N2CCCCc3cccnc32)cc1	ZINC000872299311	DF	On-Demand	Anodyne	TRPV1	17	45
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCCCc2cccnc21	ZINC000872299324	EF	On-Demand	Anodyne	INHA	21	43
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCCCc2cccnc21	ZINC000872299325	EF	On-Demand	Anodyne	INHA	21	43
O=C(Nc1cccc(C(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872299332	EG	On-Demand	Anodyne	AVPR2	39	40
O=C(Nc1cccc(C(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872299332	EG	On-Demand	Anodyne	CFTR	40	36
O=C(Nc1cccc(C(=O)N2CCCCc3cccnc32)c1)C1CC1	ZINC000872299332	EG	On-Demand	Anodyne	TYK2	51	38
O=C(c1ccc(C2SCCCS2)cc1)N1CCCCc2cccnc21	ZINC000872299333	FJ	On-Demand	Anodyne	AVPR2	33	42
CC1(C)CCNCCN1C(=O)c1cc2c(F)cccc2[nH]1	ZINC000872299336	CF	On-Demand	Anodyne	HRH4	21	58
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	ZINC000872299344	GD	On-Demand	Anodyne	SFRP1	62	38
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	ZINC000872299344	GD	On-Demand	Anodyne	WNT3	44	38
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872299345	GD	On-Demand	Anodyne	F2	20	42
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccc2ccccc2c1	ZINC000872299345	GD	On-Demand	Anodyne	TRY2_BOVIN	67	42
O=C1CCCN1Cc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872299354	EG	On-Demand	Anodyne	AVPR2	37	42
CC1(C)CCNCCN1C(=O)c1cc2c(Br)cncc2s1	ZINC000872299358	FG	On-Demand	Anodyne	SELE	78	33
CC1(C)CCNCCN1C(=O)c1cc2c(Br)cncc2s1	ZINC000872299358	FG	On-Demand	Anodyne	ICAM1	73	33
CC1(C)CCNCCN1C(=O)c1cc2c(Br)cncc2s1	ZINC000872299358	FG	On-Demand	Anodyne	VCAM1	44	32
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	CHRM2	15	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	DRD4	29	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	CHRM3	17	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	SIGMAR1	63	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	NPFFR2	41	42
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	CACNA1G	26	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1(N)CCN(Cc2ccccc2)CC1	ZINC000872299366	FE	On-Demand	Anodyne	NPFFR1	52	42
CC1(C)CCNCCN1C(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000872299395	DG	On-Demand	Anodyne	HRH4	32	67
CC1(C)CCNCCN1C(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000872299395	DG	On-Demand	Anodyne	PYGL	75	41
O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCCc2cccnc21	ZINC000872299402	GH	On-Demand	Bother	AVPR2	19	42
Nc1cccc(C2CCN(C(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872299407	DF	On-Demand	Anodyne	ADAM10	20	41
Cc1n[nH]c(C)c1CCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872299431	DD	On-Demand	Anodyne	HAO2	49	31
Cn1c(C(=O)N2CCNCCC2(C)C)cc2ccccc21	ZINC000872299450	CE	On-Demand	Anodyne	GLRA1	16	41
CS(=O)(=O)N1CCCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872299458	GF	On-Demand	Anodyne	AVPR2	40	42
CS(=O)(=O)N1CCCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872299458	GF	On-Demand	Anodyne	CYP11B2	28	41
Cc1nc2ccc(C(=O)N3CCCCc4cccnc43)cc2nc1C	ZINC000872299465	EH	On-Demand	Anodyne	AVPR2	41	41
Cc1nc2ccc(C(=O)N3CCCCc4cccnc43)cc2nc1C	ZINC000872299465	EH	On-Demand	Anodyne	HPGD	41	34
CCOC(=O)N1CCC(C(=O)N2CCCCc3cccnc32)CC1	ZINC000872299468	EF	On-Demand	Anodyne	GRIN2B	21	42
O=C1CCC(=O)N1Cc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872299472	FF	On-Demand	Anodyne	AVPR2	37	43
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1F	ZINC000872299493	DG	On-Demand	Anodyne	AVPR2	51	41
CCn1cc(C(=O)N2CCNCCC2(C)C)c2ccccc21	ZINC000872299496	CF	On-Demand	Anodyne	CNR1	20	43
CCn1cc(C(=O)N2CCNCCC2(C)C)c2ccccc21	ZINC000872299496	CF	On-Demand	Anodyne	CNR2	26	43
CCn1cc(C(=O)N2CCNCCC2(C)C)c2ccccc21	ZINC000872299496	CF	On-Demand	Anodyne	TPSAB1	16	45
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(COc3cccc(F)c3)cc2)C1	ZINC000872299521	FG	On-Demand	Anodyne	PDS	33	40
COc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872299545	DF	On-Demand	Anodyne	CPT1A	100	40
COc1ccc2[nH]cc(CC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000872299562	FF	On-Demand	Anodyne	HTR1A	19	47
COc1ccc2[nH]cc(CC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000872299562	FF	On-Demand	Anodyne	HTR1D	55	47
COc1ccc2[nH]cc(CC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000872299562	FF	On-Demand	Anodyne	HTR1B	47	44
COc1ccc2[nH]cc(CC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000872299562	FF	On-Demand	Anodyne	MTNR1A	27	43
COc1ccc2[nH]cc(CC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000872299562	FF	On-Demand	Anodyne	MTNR1B	27	43
CC1(C)CCNCCN1C(=O)c1ccnc(OCc2ccccc2)c1	ZINC000872299563	EF	On-Demand	Anodyne	SLC12A5	54	32
CC1(C)CCNCCN1C(=O)[C@@H]1CC(c2cccc(F)c2)=NO1	ZINC000872299565	DD	On-Demand	Anodyne	LUCI_PHOPY	21	40
CC1(C)CCNCCN1C(=O)[C@H]1CC(c2cccc(F)c2)=NO1	ZINC000872299566	DD	On-Demand	Anodyne	LUCI_PHOPY	21	40
O=C(c1ccc2c(c1)CCC2)N1CCCCc2cccnc21	ZINC000872299571	CH	On-Demand	Anodyne	AVPR2	43	47
COc1ccc(CC(=O)N2CCCCc3cccnc32)cc1F	ZINC000872299573	DG	On-Demand	Anodyne	MET	47	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCOCC2CCC2)C1	ZINC000872299593	CD	On-Demand	Anodyne	SPHK1	16	44
CC1(C)CCNCCN1C(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000872299601	CE	On-Demand	Anodyne	NPBWR1	92	35
Cn1nc(CC(=O)N2CCCCc3cccnc32)c2ccccc2c1=O	ZINC000872299621	EE	On-Demand	Anodyne	IMDH_CRYPV	29	44
CC1(C)CCNCCN1C(=O)Cc1coc2cc(Cl)ccc12	ZINC000872299622	DG	On-Demand	Anodyne	FFAR2	59	35
CC1(C)CCNCCN1C(=O)CCNS(=O)(=O)c1ccccc1Cl	ZINC000872299627	FD	On-Demand	Anodyne	CCR1	16	46
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2cc(Cl)ccc12	ZINC000872299635	DF	On-Demand	Anodyne	FFAR2	47	34
O=C(c1cccc(N2C(=O)CCC2=O)c1)N1CCCCc2cccnc21	ZINC000872299648	EF	On-Demand	Anodyne	AVPR2	31	40
O=C(c1cc(Cl)sc1Cl)N1CCCCc2cccnc21	ZINC000872299655	EI	On-Demand	Anodyne	AVPR2	26	42
N[C@H]1CCCCC[C@H]1C(=O)N1C[C@@H](N)[C@H](c2cccc(F)c2)C1	ZINC000872299663	DD	On-Demand	Anodyne	CCR5	81	37
O=C(c1ccc(F)c(F)c1)N1CCCCc2cccnc21	ZINC000872299672	CG	On-Demand	Anodyne	AVPR2	47	43
CCOC(=O)N[C@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872299673	ED	On-Demand	Anodyne	CCR1	51	36
CCOC(=O)N[C@@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872299676	ED	On-Demand	Anodyne	CCR1	51	36
CC1(C)CCNCCN1C(=O)CCc1c[nH]c2ccccc12	ZINC000872299680	CF	On-Demand	Anodyne	NMBR	80	35
CC1(C)CCNCCN1C(=O)CCc1c[nH]c2ccccc12	ZINC000872299680	CF	On-Demand	Anodyne	MC5R	28	43
CC1(C)CCNCCN1C(=O)CCc1c[nH]c2ccccc12	ZINC000872299680	CF	On-Demand	Anodyne	GRPR	43	35
CC1(C)CCNCCN1C(=O)CCc1c[nH]c2ccccc12	ZINC000872299680	CF	On-Demand	Anodyne	GHSR	35	42
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)C1CC1	ZINC000872299715	EG	On-Demand	Anodyne	AVPR2	94	50
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)C1CC1	ZINC000872299715	EG	On-Demand	Anodyne	AVPR1A	42	50
O=C(Nc1ccc(C(=O)N2CCCCc3cccnc32)cc1)C1CC1	ZINC000872299715	EG	On-Demand	Anodyne	TRPV1	20	49
Cc1nn(CC(=O)N2CCN(C)c3ncccc3C2)c(C)c1Cl	ZINC000872299737	EE	On-Demand	Anodyne	CCR1	22	47
O=C(COc1ccc(Cl)cc1)N1CCCCc2cccnc21	ZINC000872299741	DG	On-Demand	Anodyne	CPT1A	76	42
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872299768	GG	On-Demand	Anodyne	P2RX7	21	41
C/C(=C/c1ccccn1)C(=O)N1CCNCCC1(C)C	ZINC000872299770	CE	On-Demand	Anodyne	Q59401_ENTCL	53	32
O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872299792	EH	On-Demand	Bother	GPBAR1	22	45
O=C(c1ccc(C2SCCS2)cc1)N1CCCCc2cccnc21	ZINC000872299799	FJ	On-Demand	Anodyne	AVPR2	35	43
CC1(C)CCNCCN1C(=O)c1ccc(Oc2ccc(F)cc2)nc1	ZINC000872299813	EG	On-Demand	Anodyne	MLNR	23	43
COc1ccc2c(c1)C[C@H](C(=O)N1CCN(C)c3ncccc3C1)CO2	ZINC000872299821	FE	On-Demand	Anodyne	ROCK2	32	44
COc1ccc2c(c1)C[C@H](C(=O)N1CCN(C)c3ncccc3C1)CO2	ZINC000872299821	FE	On-Demand	Anodyne	SSTR1	43	38
COc1ccc2c(c1)C[C@@H](C(=O)N1CCN(C)c3ncccc3C1)CO2	ZINC000872299822	FE	On-Demand	Anodyne	ROCK2	32	44
COc1ccc2c(c1)C[C@@H](C(=O)N1CCN(C)c3ncccc3C1)CO2	ZINC000872299822	FE	On-Demand	Anodyne	SSTR1	43	38
O=C(COc1ccccc1)N1CCCCc2cccnc21	ZINC000872299825	CF	On-Demand	Anodyne	CPT1A	132	45
O=C(COc1ccccc1)N1CCCCc2cccnc21	ZINC000872299825	CF	On-Demand	Anodyne	CPT2	50	41
COc1ccccc1Cn1cnc2cc(C(=O)N3CCNCCC3(C)C)ccc21	ZINC000872299826	GG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1Cn1cnc2cc(C(=O)N3CCNCCC3(C)C)ccc21	ZINC000872299826	GG	On-Demand	Anodyne	HPGD	45	43
O=C(c1cccnc1Cl)N1CCCCc2cccnc21	ZINC000872299838	CG	On-Demand	Anodyne	AVPR2	32	43
O=C(c1cccnc1Cl)N1CCCCc2cccnc21	ZINC000872299838	CG	On-Demand	Anodyne	G2YM83_BOTF4	68	41
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1C	ZINC000872299857	CH	On-Demand	Anodyne	AVPR2	48	43
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCCc2cccnc21	ZINC000872299865	EH	On-Demand	Bother	AVPR2	36	47
CN1CCN(C(=O)[C@@H]2CC(c3ccccc3)=NO2)Cc2cccnc21	ZINC000872299885	EE	On-Demand	Anodyne	LUCI_PHOPY	40	31
COc1ccc(CC(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872299907	EG	On-Demand	Anodyne	FKBP1A	40	35
COc1ccc(CC(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872299907	EG	On-Demand	Anodyne	OPRK1	15	42
COc1ccc(CC(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872299907	EG	On-Demand	Anodyne	HCRTR1	24	40
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	DRD2	15	40
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	DRD4	42	40
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	ACHE	36	40
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	SLC6A1	42	32
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	SIGMAR1	68	44
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	SLC18A3	24	42
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	MLNR	45	37
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	S1PR5	16	42
CC1(C)CCNCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872299938	DE	On-Demand	Anodyne	CACNA1G	30	41
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	DRD2	15	40
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	DRD4	42	40
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	ACHE	36	40
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	SLC6A1	42	32
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	SIGMAR1	68	44
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	SLC18A3	24	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	MLNR	45	37
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	S1PR5	16	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872299939	DE	On-Demand	Anodyne	CACNA1G	30	41
CN1CCN(C(=O)[C@H]2CC(c3ccccc3)=NO2)Cc2cccnc21	ZINC000872299940	EE	On-Demand	Anodyne	LUCI_PHOPY	40	31
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)Cc2cccnc21	ZINC000872299955	GF	On-Demand	Bother	SLC6A9	18	52
O=C(OCc1ccccc1)[C@@H]1C[C@@H](NC(=O)[C@]23CCC[C@H]2OCC3)C1	ZINC000872299963	EF	On-Demand	Anodyne	SLC12A5	74	39
CS(=O)(=O)N1CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872299982	FE	On-Demand	Anodyne	AVPR2	42	42
CS(=O)(=O)N1CCc2cc(C(=O)N3CCCCc4cccnc43)ccc21	ZINC000872299982	FE	On-Demand	Anodyne	CYP11B2	31	46
NCc1ccc(CNC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1	ZINC000872300002	CC	On-Demand	Anodyne	TPSAB1	19	48
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC000872300027	CE	On-Demand	Anodyne	NMBR	80	35
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC000872300027	CE	On-Demand	Anodyne	GRPR	43	35
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC000872300027	CE	On-Demand	Anodyne	GHSR	27	44
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC000872300027	CE	On-Demand	Anodyne	FFAR2	54	33
NCc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872300053	CD	On-Demand	Anodyne	F2	20	40
NCc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872300053	CD	On-Demand	Anodyne	TPSAB1	21	48
NCc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872300053	CD	On-Demand	Anodyne	PROC	40	37
Cc1ccc2cc(C(=O)N3CCN(C)c4ncccc4C3)[nH]c2c1	ZINC000872300083	DF	On-Demand	Anodyne	GRIN2B	20	41
Cc1ccc2cc(C(=O)N3CCN(C)c4ncccc4C3)[nH]c2c1	ZINC000872300083	DF	On-Demand	Anodyne	HRH4	37	52
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000872300089	FD	On-Demand	Anodyne	TBXA2R	41	32
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000872300089	FD	On-Demand	Anodyne	CCR1	22	43
CC1(C)CCNCCN1C(=O)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000872300089	FD	On-Demand	Anodyne	FFAR2	44	36
O=C1c2ccccc2C(=O)N1CC(=O)N1CCCCc2cccnc21	ZINC000872300097	EE	On-Demand	Anodyne	CHRM2	15	41
CN1CCN(C(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)Cc2cccnc21	ZINC000872300098	GE	On-Demand	Anodyne	PREP	71	38
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)Cc2cccnc21	ZINC000872300102	GE	On-Demand	Anodyne	PREP	71	38
O=C(c1ccc(OC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300117	EH	On-Demand	Anodyne	AVPR2	29	44
O=C(c1ccc(OC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300117	EH	On-Demand	Anodyne	P2RY1	28	45
O=C(c1ccc(OC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300117	EH	On-Demand	Anodyne	EPHX2	41	39
O=C(c1ccc(OC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300117	EH	On-Demand	Anodyne	SHH	40	36
O=C(c1ccc(OC(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300117	EH	On-Demand	Anodyne	NOD2	24	42
CN1CCN(C(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)Cc2cccnc21	ZINC000872300118	GD	On-Demand	Anodyne	LPL	43	34
COc1ccc(C(=O)N2CCCCc3cccnc32)c(F)c1	ZINC000872300122	DG	On-Demand	Anodyne	AVPR2	30	41
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCCc3cccnc32)c1	ZINC000872300124	GF	On-Demand	Anodyne	AVPR2	22	44
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)Cc2cccnc21	ZINC000872300165	EC	On-Demand	Anodyne	CA2	25	44
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)Cc2cccnc21	ZINC000872300165	EC	On-Demand	Anodyne	CA1	21	44
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)Cc2cccnc21	ZINC000872300165	EC	On-Demand	Anodyne	CA7	21	44
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)Cc2cccnc21	ZINC000872300165	EC	On-Demand	Anodyne	CA13	20	44
O=C(Cc1cccc(F)c1)N1CCCCc2cccnc21	ZINC000872300184	CG	On-Demand	Anodyne	EIF2AK3	35	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2Cc3ccccc3C[C@H]2C(=O)NC2CC2)C1	ZINC000872300203	ED	On-Demand	Anodyne	OPRD1	48	34
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2Cc3ccccc3C[C@H]2C(=O)NC2CC2)C1	ZINC000872300203	ED	On-Demand	Anodyne	CFTR	44	32
Cc1ccc2cc(C(=O)N3CCNCCC3(C)C)[nH]c2c1	ZINC000872300210	CF	On-Demand	Anodyne	HRH4	22	46
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCc2cccnc21	ZINC000872300251	EF	On-Demand	Bother	CPT1A	34	42
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)Cc2cccnc21	ZINC000872300262	GD	On-Demand	Bother	SLC6A9	19	57
CC1(C)CCNCCN1C(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000872300274	EG	On-Demand	Anodyne	C3AR1	46	43
CC1(C)CCNCCN1C(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872300275	EG	On-Demand	Anodyne	C3AR1	46	43
O=C(c1csc(NC2CC2)n1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300318	FC	On-Demand	Anodyne	TRPC6	49	36
O=C(c1csc(NC2CC2)n1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300318	FC	On-Demand	Anodyne	TRPC3	43	36
O=C(c1csc(NC2CC2)n1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300319	FC	On-Demand	Anodyne	TRPC6	49	36
O=C(c1csc(NC2CC2)n1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300319	FC	On-Demand	Anodyne	TRPC3	43	36
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300320	GD	On-Demand	Anodyne	C3AR1	40	39
O=C([C@H](Cc1cccnc1)C1CCCC1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300321	GD	On-Demand	Anodyne	C3AR1	40	39
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300322	GD	On-Demand	Anodyne	C3AR1	40	39
O=C([C@H](Cc1cccnc1)C1CCCC1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300323	GD	On-Demand	Anodyne	C3AR1	40	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300329	GE	On-Demand	Anodyne	CPT1A	15	42
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300329	GE	On-Demand	Anodyne	CPT2	46	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300329	GE	On-Demand	Anodyne	PREP	106	53
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300330	GE	On-Demand	Anodyne	CPT1A	15	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300330	GE	On-Demand	Anodyne	CPT2	46	39
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2cccs2)Cc2cccnc21	ZINC000872300330	GE	On-Demand	Anodyne	PREP	106	53
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872300350	EH	On-Demand	Anodyne	HTR1D	20	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872300350	EH	On-Demand	Anodyne	HTR1B	17	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872300350	EH	On-Demand	Anodyne	HTR1F	59	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872300350	EH	On-Demand	Anodyne	CCR2	30	46
COc1ccc2[nH]cc(CC(=O)N3CCNCCC3(C)C)c2c1	ZINC000872300398	DE	On-Demand	Anodyne	HTR1A	16	45
COc1ccc2[nH]cc(CC(=O)N3CCNCCC3(C)C)c2c1	ZINC000872300398	DE	On-Demand	Anodyne	HTR1D	35	45
COc1ccc2[nH]cc(CC(=O)N3CCNCCC3(C)C)c2c1	ZINC000872300398	DE	On-Demand	Anodyne	HTR1B	29	45
COc1ccc2[nH]cc(CC(=O)N3CCNCCC3(C)C)c2c1	ZINC000872300398	DE	On-Demand	Anodyne	MTNR1A	27	47
COc1ccc2[nH]cc(CC(=O)N3CCNCCC3(C)C)c2c1	ZINC000872300398	DE	On-Demand	Anodyne	MTNR1B	23	47
CN1CCN(C(=O)[C@@H]2CSCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300400	GE	On-Demand	Anodyne	PREP	40	42
CN1CCN(C(=O)[C@H]2CSCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300401	GE	On-Demand	Anodyne	PREP	40	42
CN1CCN(C(=O)c2cc(F)c(F)c(F)c2F)Cc2cccnc21	ZINC000872300415	EF	On-Demand	Anodyne	P2RX7	35	40
CC1(C)CCNCCN1C(=O)[C@@H]1CC(c2ccccc2)=NO1	ZINC000872300419	DD	On-Demand	Anodyne	LUCI_PHOPY	45	35
CC1(C)CCNCCN1C(=O)[C@H]1CC(c2ccccc2)=NO1	ZINC000872300420	DD	On-Demand	Anodyne	LUCI_PHOPY	45	35
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300421	FE	On-Demand	Anodyne	CPT2	47	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300421	FE	On-Demand	Anodyne	PREP	119	58
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300421	FE	On-Demand	Anodyne	SFRP1	41	39
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300421	FE	On-Demand	Anodyne	WNT3	46	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300422	FE	On-Demand	Anodyne	CPT2	47	42
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300422	FE	On-Demand	Anodyne	PREP	119	58
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300422	FE	On-Demand	Anodyne	SFRP1	41	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872300422	FE	On-Demand	Anodyne	WNT3	46	39
CC(=O)Nc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872300437	ED	On-Demand	Anodyne	TRPC6	63	47
CC(=O)Nc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872300437	ED	On-Demand	Anodyne	TRPC3	54	42
Cc1ccc(CN2CCO[C@H](CNC(=O)[C@]34CCC[C@H]3OCC4)C2)cc1	ZINC000872300458	FE	On-Demand	Anodyne	DRD4	15	41
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872300464	DG	On-Demand	Anodyne	AVPR2	55	41
O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872300475	GF	On-Demand	Anodyne	AVPR2	33	44
O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872300475	GF	On-Demand	Anodyne	TGM2	25	42
O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872300475	GF	On-Demand	Anodyne	F13A1	30	42
O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872300475	GF	On-Demand	Anodyne	AKR1C3	45	35
O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCc2cccnc21	ZINC000872300475	GF	On-Demand	Anodyne	NAMPT	40	43
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1Br	ZINC000872300483	FH	On-Demand	Anodyne	AVPR2	55	41
Cc1cc(C)cc(CC(=O)N2CCNCCC2(C)C)c1	ZINC000872300489	CE	On-Demand	Anodyne	FFAR2	45	44
CCCCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872300497	CF	On-Demand	Anodyne	FAAH	29	42
O=C(c1cc(Cl)ccn1)N1CCCCc2cccnc21	ZINC000872300498	CG	On-Demand	Anodyne	AVPR2	22	41
Cc1oc(-c2ccccc2)nc1C(=O)N1CCCCc2cccnc21	ZINC000872300499	EI	On-Demand	Anodyne	PPARG	46	39
Cc1oc(-c2ccccc2)nc1C(=O)N1CCCCc2cccnc21	ZINC000872300499	EI	On-Demand	Anodyne	PPARA	44	36
Cc1oc(-c2ccccc2)nc1C(=O)N1CCCCc2cccnc21	ZINC000872300499	EI	On-Demand	Anodyne	PDE8B	56	33
O=C(c1ccc2c(c1)OCO2)N1CCCCc2cccnc21	ZINC000872300533	CF	On-Demand	Anodyne	AVPR2	41	43
O=C(c1ccc(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872300540	DH	On-Demand	Anodyne	AVPR2	68	50
O=C(c1ccc(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872300540	DH	On-Demand	Anodyne	AVPR1A	21	42
O=C(c1ccc(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872300540	DH	On-Demand	Anodyne	P2RX7	24	44
COc1ccc(C(=O)N2CCCCc3cccnc32)c(OC)c1	ZINC000872300545	DG	On-Demand	Anodyne	AVPR2	32	43
COc1ccc(C(=O)N2CCCCc3cccnc32)c(OC)c1	ZINC000872300545	DG	On-Demand	Anodyne	OXTR	16	41
O=C(CCCOc1ccccc1)N1CCCCc2cccnc21	ZINC000872300570	DH	On-Demand	Anodyne	HRH3	21	40
O=C(CCCOc1ccccc1)N1CCCCc2cccnc21	ZINC000872300570	DH	On-Demand	Anodyne	CPT1A	59	38
O=C(CCCOc1ccccc1)N1CCCCc2cccnc21	ZINC000872300570	DH	On-Demand	Anodyne	CPT2	40	35
O=C(Cc1ccc2c(c1)OCCO2)N1CCCCc2cccnc21	ZINC000872300581	DF	On-Demand	Anodyne	NOS2	66	32
O=C(c1cnc(Cl)c(Cl)c1)N1CCCCc2cccnc21	ZINC000872300586	DH	On-Demand	Anodyne	AVPR2	38	40
CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1OC	ZINC000872300590	EG	On-Demand	Anodyne	AVPR2	49	39
CC1(C)CCNCCN1C(=O)Cc1c[nH]c2cc(F)ccc12	ZINC000872300626	DE	On-Demand	Anodyne	MPO	72	37
O=C(c1ccc2c(c1)OCCCO2)N1CCCCc2cccnc21	ZINC000872300629	DG	On-Demand	Anodyne	AVPR2	38	42
CN(C)S(=O)(=O)c1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872300658	FE	On-Demand	Anodyne	AKR1C3	53	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](c2cccnc2)C1	ZINC000872300669	CE	On-Demand	Anodyne	CCR5	29	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](c2cccnc2)C1	ZINC000872300669	CE	On-Demand	Anodyne	ADAM10	19	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](c2cccnc2)C1	ZINC000872300671	CE	On-Demand	Anodyne	CCR5	29	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@H](c2cccnc2)C1	ZINC000872300671	CE	On-Demand	Anodyne	ADAM10	19	42
O=C(c1ccc(N2C(=O)CCC2=O)cc1)N1CCCCc2cccnc21	ZINC000872300678	EF	On-Demand	Anodyne	AVPR2	34	49
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872300694	GF	On-Demand	Anodyne	PAPA1_CARPA	29	40
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872300694	GF	On-Demand	Anodyne	FPR1	23	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872300700	GF	On-Demand	Anodyne	PAPA1_CARPA	29	40
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872300700	GF	On-Demand	Anodyne	FPR1	23	41
C[C@@H](CC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872300703	CH	On-Demand	Anodyne	PTAFR	22	45
Cc1cc(C)cc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872300710	CH	On-Demand	Anodyne	AVPR2	45	44
O=C(c1cnn(Cc2ccccc2)c1)N1CCCCc2cccnc21	ZINC000872300712	EG	On-Demand	Anodyne	AVPR2	34	40
O=C(N1CCC(c2nc(C3CCC3)no2)CC1)[C@]12CCC[C@H]1OCC2	ZINC000872300724	EG	On-Demand	Anodyne	ETHR	56	50
CC1(C)CCNCCN1C(=O)c1cc2cc(F)ccc2[nH]1	ZINC000872300726	CF	On-Demand	Anodyne	HRH4	26	56
CC1(C)CCNCCN1C(=O)c1cc2cc(F)ccc2[nH]1	ZINC000872300726	CF	On-Demand	Anodyne	PLD1	15	41
CC1(C)CCNCCN1C(=O)c1cc2cc(F)ccc2[nH]1	ZINC000872300726	CF	On-Demand	Anodyne	PLD2	29	41
O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872300740	FH	On-Demand	Bother	AVPR2	35	43
O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872300740	FH	On-Demand	Bother	TAAR1	15	46
COc1ccc([C@H](CNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300752	JJ	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc([C@H](CNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300752	JJ	On-Demand	Anodyne	MTNR1B	15	45
CC1(C)CCNCCN1C(=O)c1cccc(Oc2ccccn2)c1	ZINC000872300769	EG	On-Demand	Anodyne	CFTR	20	42
COc1ccc([C@H](CNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300774	JJ	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc([C@H](CNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300774	JJ	On-Demand	Anodyne	MTNR1B	15	45
COc1ccc([C@@H](CNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300775	JJ	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc([C@@H](CNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300775	JJ	On-Demand	Anodyne	MTNR1B	15	45
COc1ccc([C@@H](CNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300776	JJ	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc([C@@H](CNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)cc1	ZINC000872300776	JJ	On-Demand	Anodyne	MTNR1B	15	45
O=C(CCc1c[nH]c2ccccc12)N1CCCCc2cccnc21	ZINC000872300786	DH	On-Demand	Anodyne	NMBR	50	35
O=C(CCc1c[nH]c2ccccc12)N1CCCCc2cccnc21	ZINC000872300786	DH	On-Demand	Anodyne	MC5R	32	42
C[C@@H](OCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872300804	EE	On-Demand	Anodyne	UGCG	33	40
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872300811	EG	On-Demand	Anodyne	PTAFR	17	43
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872300811	EG	On-Demand	Anodyne	DPP8	23	44
O=C(c1ccc(C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300821	DI	On-Demand	Anodyne	AVPR2	37	45
O=C(c1ccc(C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300821	DI	On-Demand	Anodyne	TRPV1	39	47
O=C(c1ccc(C(F)(F)F)cc1)N1CCCCc2cccnc21	ZINC000872300821	DI	On-Demand	Anodyne	TRPM8	44	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000872300822	DD	On-Demand	Anodyne	DGAT1	21	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000872300822	DD	On-Demand	Anodyne	SLC27A1	44	42
O=C(c1ccccc1F)N1CCCCc2cccnc21	ZINC000872300839	CG	On-Demand	Anodyne	AVPR2	38	43
O=C(/C=C/c1ccccc1C(F)(F)F)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300844	GE	On-Demand	Anodyne	ITGAL	41	34
O=C(/C=C\c1ccccc1C(F)(F)F)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300845	GE	On-Demand	Anodyne	ITGAL	41	34
O=C(/C=C\c1ccccc1C(F)(F)F)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300846	GE	On-Demand	Anodyne	ITGAL	41	34
O=C(/C=C/c1ccccc1C(F)(F)F)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872300847	GE	On-Demand	Anodyne	ITGAL	41	34
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000872300857	DF	On-Demand	Anodyne	DRD5	21	43
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000872300857	DF	On-Demand	Anodyne	SSTR4	47	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000872300857	DF	On-Demand	Anodyne	SSTR1	17	43
O=C(c1cccc(C(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872300861	DI	On-Demand	Anodyne	TRPV1	30	41
O=C(c1ccc(F)cc1)N1CCCCc2cccnc21	ZINC000872300865	CG	On-Demand	Anodyne	AVPR2	55	48
O=C(c1ccc(F)cc1)N1CCCCc2cccnc21	ZINC000872300865	CG	On-Demand	Anodyne	AVPR1A	15	44
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300871	CG	On-Demand	Anodyne	AVPR2	50	45
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300871	CG	On-Demand	Anodyne	AVPR1A	15	42
COc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300871	CG	On-Demand	Anodyne	NOD2	24	40
CC1(C)CCNCCN1C(=O)Cc1ccc2cccnc2c1	ZINC000872300895	CE	On-Demand	Anodyne	FFAR2	43	33
CC1(C)CCNCCN1C(=O)Cc1ccc(OCc2ccncc2)cc1	ZINC000872300904	FF	On-Demand	Anodyne	ADAM17	15	45
CCN(CC)S(=O)(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300908	GG	On-Demand	Anodyne	AVPR2	38	40
COc1cccc(OCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872300910	ED	On-Demand	Anodyne	DRD4	43	32
COc1cccc(OCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872300910	ED	On-Demand	Anodyne	HTR1B	17	42
COc1cccc(OCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872300910	ED	On-Demand	Anodyne	CPT2	41	38
CN1CCN(C(=O)Cc2csc3ccccc23)Cc2cccnc21	ZINC000872300911	EG	On-Demand	Anodyne	FFAR2	55	36
O=C(CCc1ccccc1)N1CCCCc2cccnc21	ZINC000872300917	CG	On-Demand	Anodyne	PREP	40	38
CCCCCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872300927	CG	On-Demand	Mild	FAAH	29	42
COC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300938	DF	On-Demand	Anodyne	AVPR2	71	45
COC(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872300938	DF	On-Demand	Anodyne	AVPR1A	20	45
O=C(NC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1)OCc1ccccc1	ZINC000872300960	FF	On-Demand	Anodyne	CTSK	17	48
O=C(NC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1)OCc1ccccc1	ZINC000872300960	FF	On-Demand	Anodyne	CTSL	24	48
O=C(NC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1)OCc1ccccc1	ZINC000872300960	FF	On-Demand	Anodyne	TGM2	30	46
O=C(NC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1)OCc1ccccc1	ZINC000872300960	FF	On-Demand	Anodyne	F13A1	27	46
O=C(NC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1)OCc1ccccc1	ZINC000872300960	FF	On-Demand	Anodyne	SLC12A5	76	42
O=C(c1ccccc1Br)N1CCCCc2cccnc21	ZINC000872300977	EH	On-Demand	Anodyne	AVPR2	34	40
CN1CCN(C(=O)c2ccc(Cn3ccnc3)cc2)Cc2cccnc21	ZINC000872300986	EE	On-Demand	Anodyne	CYP19A1	15	48
CN1CCN(C(=O)c2ccc(Cn3ccnc3)cc2)Cc2cccnc21	ZINC000872300986	EE	On-Demand	Anodyne	CYP11B1	42	41
CN1CCN(C(=O)c2ccc(Cn3ccnc3)cc2)Cc2cccnc21	ZINC000872300986	EE	On-Demand	Anodyne	TBXAS1	47	46
CN1CCN(C(=O)c2ccc(Cn3ccnc3)cc2)Cc2cccnc21	ZINC000872300986	EE	On-Demand	Anodyne	CYP11B2	19	41
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872301003	GF	On-Demand	Anodyne	EPHX2	21	49
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872301003	GF	On-Demand	Anodyne	TGM2	45	40
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872301003	GF	On-Demand	Anodyne	F13A1	49	40
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872301003	GF	On-Demand	Anodyne	AKR1C3	56	36
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCCCc2cccnc21	ZINC000872301003	GF	On-Demand	Anodyne	NAMPT	62	41
CN1CCN(C(=O)c2ccc(CN3CCCC3=O)cc2)Cc2cccnc21	ZINC000872301011	FE	On-Demand	Anodyne	FABI	44	34
CC1(C)CCNCCN1C(=O)Cc1csc(COc2ccccc2)n1	ZINC000872301023	FF	On-Demand	Anodyne	CPT1A	41	34
CC1(C)CCNCCN1C(=O)c1cc(OCc2ccccc2)cs1	ZINC000872301025	EH	On-Demand	Anodyne	SLC12A5	58	33
COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872301047	EF	On-Demand	Clean	CTSK	18	42
CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872301056	CG	On-Demand	Anodyne	AVPR2	46	44
CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872301056	CG	On-Demand	Anodyne	AVPR1A	17	43
CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872301056	CG	On-Demand	Anodyne	NOD2	33	44
CC1(C)CCNCCN1C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872301065	ED	On-Demand	Anodyne	SLC18A3	18	42
CC1(C)CCNCCN1C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872301065	ED	On-Demand	Anodyne	L3MBTL3	64	39
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872301067	ED	On-Demand	Anodyne	SLC18A3	18	42
CC1(C)CCNCCN1C(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872301067	ED	On-Demand	Anodyne	L3MBTL3	64	39
O=C(c1cccc(Br)c1)N1CCCCc2cccnc21	ZINC000872301068	EH	On-Demand	Anodyne	AVPR2	34	40
CC1(C)CCNCCN1C(=O)c1ccc(OCc2ccccc2)cn1	ZINC000872301109	EF	On-Demand	Anodyne	SLC12A5	56	34
CN1CCN(C(=O)c2cccc(OCC(N)=O)c2)Cc2cccnc21	ZINC000872301111	ED	On-Demand	Anodyne	DRD4	41	31
CN1CCN(C(=O)c2cnn(C)c2C(F)(F)F)Cc2cccnc21	ZINC000872301123	ED	On-Demand	Anodyne	P2RX7	28	40
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872301144	CG	On-Demand	Anodyne	AVPR2	45	49
Cc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872301144	CG	On-Demand	Anodyne	KCNK3	43	36
O=C1c2ccccc2C(=O)N1CCCC(=O)N1CCCCc2cccnc21	ZINC000872301148	FF	On-Demand	Anodyne	CHRM2	19	45
CN1CCN(C(=O)c2cccc3c2OCO3)Cc2cccnc21	ZINC000872301157	DD	On-Demand	Anodyne	G2YM83_BOTF4	41	35
Cc1c(C(=O)N2CCCCc3cccnc32)cccc1[N+](=O)[O-]	ZINC000872301160	DG	On-Demand	Bother	AVPR2	24	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(COc3ccc(F)cc3)cc2)C1	ZINC000872301162	FG	On-Demand	Anodyne	ADAM17	16	41
O=C(c1cc(F)cc(F)c1)N1CCCCc2cccnc21	ZINC000872301168	CG	On-Demand	Anodyne	AVPR2	36	42
CC(=O)Nc1cccc(C(=O)N2CCCCc3cccnc32)c1	ZINC000872301183	DG	On-Demand	Anodyne	AVPR2	50	42
COc1ccc(-n2nnc(C(=O)N3CCN(C)c4ncccc4C3)c2C)cc1	ZINC000872301184	GE	On-Demand	Anodyne	CACNA2D2	40	31
CSc1ccc(C(=O)N2CCCCc3cccnc32)cc1[N+](=O)[O-]	ZINC000872301195	EH	On-Demand	Bother	AVPR2	30	41
N[C@@H]1CCCCC[C@@H]1C(=O)NCCOCC1CCC1	ZINC000872301196	CD	On-Demand	Anodyne	SPHK1	17	43
CC(=O)c1cccc(OCC(=O)N2CCCCc3cccnc32)c1	ZINC000872301197	DG	On-Demand	Anodyne	CPT1A	84	38
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(OCc2ccc(F)cc2)CC1	ZINC000872301216	EG	On-Demand	Anodyne	GRIN2B	21	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(OCc2ccc(F)cc2)CC1	ZINC000872301216	EG	On-Demand	Anodyne	LIPG	15	42
COCCOc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872301273	EE	On-Demand	Anodyne	DRD4	46	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)C1	ZINC000872301275	DG	On-Demand	Anodyne	HTR1D	25	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)C1	ZINC000872301275	DG	On-Demand	Anodyne	HTR1B	22	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)C1	ZINC000872301275	DG	On-Demand	Anodyne	HTR1F	77	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)C1	ZINC000872301275	DG	On-Demand	Anodyne	CCR2	31	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872301277	EG	On-Demand	Anodyne	HTR1D	17	48
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872301277	EG	On-Demand	Anodyne	SLC6A4	16	48
CN1CCN(C(=O)Cn2cc(C(N)=O)c3ccccc32)Cc2cccnc21	ZINC000872301280	FD	On-Demand	Anodyne	CNR1	15	41
COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@]45C[C@@H](N)C[C@@H]4C5)CC3)c2c1	ZINC000872301283	FF	On-Demand	Anodyne	HTR1A	15	46
COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@]45C[C@@H](N)C[C@@H]4C5)CC3)c2c1	ZINC000872301283	FF	On-Demand	Anodyne	HTR1D	22	49
COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@]45C[C@@H](N)C[C@@H]4C5)CC3)c2c1	ZINC000872301283	FF	On-Demand	Anodyne	HTR1B	18	46
COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@]45C[C@@H](N)C[C@@H]4C5)CC3)c2c1	ZINC000872301283	FF	On-Demand	Anodyne	SLC6A4	15	58
CN1CCN(C(=O)[C@@H]2CCCCN2S(C)(=O)=O)Cc2cccnc21	ZINC000872301304	FC	On-Demand	Anodyne	CPT2	42	36
CN1CCN(C(=O)[C@H]2CCCCN2S(C)(=O)=O)Cc2cccnc21	ZINC000872301305	FC	On-Demand	Anodyne	CPT2	42	36
CN1CCN(C2CCN(C(=O)[C@]34CCC[C@H]3OCC4)CC2)CC1	ZINC000872301315	DD	On-Demand	Anodyne	L3MBTL3	44	40
O=C(c1cc(F)c(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872301317	DH	On-Demand	Anodyne	AVPR2	51	46
O=C(c1cc(F)c(F)cc1Cl)N1CCCCc2cccnc21	ZINC000872301317	DH	On-Demand	Anodyne	GPBAR1	15	46
CCOc1ccc(C(=O)N2CCCCc3cccnc32)cc1OCC	ZINC000872301325	EH	On-Demand	Anodyne	AVPR2	46	41
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872301330	GH	On-Demand	Bother	AVPR2	29	41
CN1CCN(C(=O)c2cc(Cl)c(Cl)n2C)Cc2cccnc21	ZINC000872301335	EF	On-Demand	Anodyne	P2RX7	17	40
CN1CCN(C(=O)c2ccc(CO)cc2)Cc2cccnc21	ZINC000872301339	CD	On-Demand	Anodyne	SMO	22	41
CN(C)S(=O)(=O)c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872301345	FE	On-Demand	Anodyne	AVPR2	41	42
O=C(c1cccc([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872301347	CF	On-Demand	Bother	AVPR2	27	52
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)CCCc1ccccc1	ZINC000872301361	EE	On-Demand	Anodyne	FKBP1A	29	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)CCCc1ccccc1	ZINC000872301361	EE	On-Demand	Anodyne	PREP	49	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCNC(=O)CCCc1ccccc1	ZINC000872301361	EE	On-Demand	Anodyne	MMP2	52	35
CC1(C)CCNCCN1C(=O)CCc1cccc2ccccc12	ZINC000872301374	DG	On-Demand	Anodyne	FFAR2	44	32
O=C(COc1ccc2ccc(=O)oc2c1)N1CCCCc2cccnc21	ZINC000872301378	FF	On-Demand	Anodyne	BCHE	17	43
CC1(C)CCNCCN1C(=O)c1ccc(-c2cn[nH]c2)cn1	ZINC000872301379	CD	On-Demand	Anodyne	PTK6	46	39
O=C(c1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872301384	GG	On-Demand	Anodyne	AVPR2	28	43
O=C(c1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872301384	GG	On-Demand	Anodyne	TGM2	22	41
O=C(c1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872301384	GG	On-Demand	Anodyne	F13A1	25	41
O=C(c1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCCCc2cccnc21	ZINC000872301384	GG	On-Demand	Anodyne	NAMPT	37	45
O=C(c1ccc(Cl)nc1)N1CCCCc2cccnc21	ZINC000872301392	CG	On-Demand	Anodyne	AVPR2	39	43
O=C(c1ccccc1)N1CCCCc2cccnc21	ZINC000872301397	CG	On-Demand	Anodyne	AVPR2	62	52
O=C(c1ccccc1)N1CCCCc2cccnc21	ZINC000872301397	CG	On-Demand	Anodyne	AVPR1A	17	52
O=C(Cc1ccccc1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872301402	DF	On-Demand	Bother	COLA	49	33
Cc1ccccc1[C@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(N)=O	ZINC000872301416	FD	On-Demand	Anodyne	PTAFR	24	41
Cc1ccccc1[C@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(N)=O	ZINC000872301416	FD	On-Demand	Anodyne	CTSA	55	34
Cc1ccccc1[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(N)=O	ZINC000872301418	FD	On-Demand	Anodyne	PTAFR	24	41
Cc1ccccc1[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(N)=O	ZINC000872301418	FD	On-Demand	Anodyne	CTSA	55	34
O=C(CCOc1ccccc1)N1CCCCc2cccnc21	ZINC000872301428	CG	On-Demand	Anodyne	CPT1A	64	37
O=C1CCCN1c1ccc(C(=O)N2CCCCc3cccnc32)cc1	ZINC000872301434	EG	On-Demand	Anodyne	AVPR2	31	47
CCOc1ccc(CC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301438	DG	On-Demand	Anodyne	NOD2	24	41
Cc1ccc(C(=O)N2CCNCCC2(C)C)cc1-c1cnn(C)c1	ZINC000872301454	EF	On-Demand	Anodyne	ACACA	24	41
CC1(C)CCNCCN1C(=O)CCc1ccc(F)c2ccccc12	ZINC000872301465	EH	On-Demand	Anodyne	FFAR2	54	34
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCCCc2cccnc21	ZINC000872301470	EH	On-Demand	Bother	AVPR2	40	41
N#Cc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301481	DF	On-Demand	Mild	CPT1A	44	44
CC[C@H](NC(=O)[C@]12CCC[C@H]1OCC2)c1ccccc1OC	ZINC000872301483	DG	On-Demand	Anodyne	HCN1	40	31
CC[C@H](NC(=O)[C@]12CCC[C@H]1OCC2)c1ccccc1OC	ZINC000872301483	DG	On-Demand	Anodyne	HCN4	40	31
O=C(c1ccc2c(c1)OCCO2)N1CCCCc2cccnc21	ZINC000872301525	DF	On-Demand	Anodyne	AVPR2	40	43
O=C(Cc1ccc(Cl)cc1)N1CCCCc2cccnc21	ZINC000872301536	DH	On-Demand	Anodyne	SCN2A	17	41
O=C(Cc1ccc(Cl)cc1)N1CCCCc2cccnc21	ZINC000872301536	DH	On-Demand	Anodyne	SCN10A	15	41
CN1CCN(C(=O)c2cccc(Cn3ccnc3)c2)Cc2cccnc21	ZINC000872301542	EE	On-Demand	Anodyne	CYP19A1	16	51
CN1CCN(C(=O)c2cccc(Cn3ccnc3)c2)Cc2cccnc21	ZINC000872301542	EE	On-Demand	Anodyne	CYP11B1	43	43
CN1CCN(C(=O)c2cccc(Cn3ccnc3)c2)Cc2cccnc21	ZINC000872301542	EE	On-Demand	Anodyne	TBXAS1	41	44
CN1CCN(C(=O)c2cccc(Cn3ccnc3)c2)Cc2cccnc21	ZINC000872301542	EE	On-Demand	Anodyne	CYP11B2	21	43
Cc1ccc(NC(=O)CSCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301551	FG	On-Demand	Anodyne	TRPV1	17	44
CC1(C)CCNCCN1C(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1	ZINC000872301554	FE	On-Demand	Anodyne	AKR1C3	49	34
O=C(c1cccc(F)c1)N1CCCCc2cccnc21	ZINC000872301562	CG	On-Demand	Anodyne	AVPR2	38	40
CC1(C)CCNCCN1C(=O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1	ZINC000872301589	GG	On-Demand	Anodyne	SMG1	46	36
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)Cc2cccnc21	ZINC000872301596	GD	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)Cc2cccnc21	ZINC000872301596	GD	On-Demand	Anodyne	PREP	97	43
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2O)Cc2cccnc21	ZINC000872301597	GD	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2O)Cc2cccnc21	ZINC000872301597	GD	On-Demand	Anodyne	PREP	97	43
O=C(c1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872301616	DI	On-Demand	Anodyne	TRPV1	32	42
O=C(c1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872301616	DI	On-Demand	Anodyne	RBP4	41	37
O=C(c1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872301616	DI	On-Demand	Anodyne	SCD1	20	40
O=C(c1ccccc1C(F)(F)F)N1CCCCc2cccnc21	ZINC000872301616	DI	On-Demand	Anodyne	SCD	25	40
O=C(c1ccc(Br)cc1)N1CCCCc2cccnc21	ZINC000872301643	EH	On-Demand	Anodyne	AVPR2	44	48
O=C(c1ccc(C2CCOCC2)cc1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872301644	GD	On-Demand	Anodyne	L3MBTL3	52	39
O=C(c1ccc(C2CCOCC2)cc1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872301645	GD	On-Demand	Anodyne	L3MBTL3	52	39
COc1ccc2c(c1)CC[C@H]2C(=O)N1CCNCCC1(C)C	ZINC000872301684	DE	On-Demand	Anodyne	EBP	18	41
O=C(c1ccccn1)N1CCCCc2cccnc21	ZINC000872301697	CE	On-Demand	Anodyne	AVPR2	28	41
O=C(c1ccccn1)N1CCCCc2cccnc21	ZINC000872301697	CE	On-Demand	Anodyne	GRM4	41	33
CCOc1ccccc1OCC(=O)N1CCCCc2cccnc21	ZINC000872301705	EG	On-Demand	Anodyne	HCN1	45	34
CCOc1ccccc1OCC(=O)N1CCCCc2cccnc21	ZINC000872301705	EG	On-Demand	Anodyne	HCN4	40	31
O=C(c1cccc(Cl)c1)N1CCCCc2cccnc21	ZINC000872301706	CH	On-Demand	Anodyne	AVPR2	44	49
O=C(c1cccc(Cl)c1)N1CCCCc2cccnc21	ZINC000872301706	CH	On-Demand	Anodyne	GRM5	18	40
CC1(C)CCNCCN1C(=O)CCNC(=O)c1cc2ccccc2[nH]1	ZINC000872301710	ED	On-Demand	Anodyne	PYGL	40	37
CC1(C)CCNCCN1C(=O)CCNC(=O)c1cc2ccccc2[nH]1	ZINC000872301710	ED	On-Demand	Anodyne	PLD1	32	44
CC1(C)CCNCCN1C(=O)CCNC(=O)c1cc2ccccc2[nH]1	ZINC000872301710	ED	On-Demand	Anodyne	PLD2	45	43
O=C(CCCc1c[nH]c2ccccc12)N1CCCCc2cccnc21	ZINC000872301719	EI	On-Demand	Anodyne	HTR1D	54	35
O=C(CCCc1c[nH]c2ccccc12)N1CCCCc2cccnc21	ZINC000872301719	EI	On-Demand	Anodyne	HTR1B	42	35
CC[C@H](C(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872301724	CH	On-Demand	Anodyne	KCNQ2	47	43
CC[C@@H](C(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872301725	CH	On-Demand	Anodyne	KCNQ2	47	43
CCOc1ccccc1C(=O)N1CCCCc2cccnc21	ZINC000872301727	CG	On-Demand	Anodyne	AVPR2	40	40
CCOc1ccccc1C(=O)N1CCCCc2cccnc21	ZINC000872301727	CG	On-Demand	Anodyne	HCN1	66	40
CCOc1ccccc1C(=O)N1CCCCc2cccnc21	ZINC000872301727	CG	On-Demand	Anodyne	HCN4	47	37
O=C(Cc1cccc(C(F)(F)F)c1)N1CCCCc2cccnc21	ZINC000872301733	EI	On-Demand	Anodyne	EIF2AK3	28	44
O=C(c1ccccc1[N+](=O)[O-])N1CCCCc2cccnc21	ZINC000872301736	CF	On-Demand	Bother	AVPR2	25	48
O=C(c1ccc(F)cc1F)N1CCCCc2cccnc21	ZINC000872301748	CG	On-Demand	Anodyne	AVPR2	36	43
O=C(c1ccccc1Cl)N1CCCCc2cccnc21	ZINC000872301754	CH	On-Demand	Anodyne	AVPR2	59	51
O=C(c1ccccc1Cl)N1CCCCc2cccnc21	ZINC000872301754	CH	On-Demand	Anodyne	GPBAR1	19	51
O=C(c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCCc2cccnc21	ZINC000872301772	GG	On-Demand	Anodyne	AKR1C3	71	46
O=C(c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCCc2cccnc21	ZINC000872301772	GG	On-Demand	Anodyne	NAMPT	19	41
COC(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872301785	EE	On-Demand	Anodyne	PDGFRB	43	35
COC(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872301785	EE	On-Demand	Anodyne	TRPV1	20	41
N#CCc1ccc(CNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872301819	CE	On-Demand	Mild	CTSK	16	44
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCCCc2cccnc21	ZINC000872301821	GF	On-Demand	Bother	SLC6A9	15	50
COc1ccc(-c2nnc(SCC(=O)N3CCCCc4cccnc43)o2)cc1	ZINC000872301843	GH	On-Demand	Anodyne	GSK3A	21	40
O=C(c1ccc(OC(F)F)cc1)N1CCCCc2cccnc21	ZINC000872301847	DH	On-Demand	Anodyne	AVPR2	27	43
O=C(c1cc(Cl)nc(Cl)c1)N1CCCCc2cccnc21	ZINC000872301858	DH	On-Demand	Anodyne	AVPR2	35	41
CC1(C)CCNCCN1C(=O)CC1(N)CCN(Cc2ccccc2)CC1	ZINC000872301882	FD	On-Demand	Anodyne	SIGMAR1	55	38
CC1(C)CCNCCN1C(=O)CC1(N)CCN(Cc2ccccc2)CC1	ZINC000872301882	FD	On-Demand	Anodyne	NPFFR1	42	39
CC1(C)CCNCCN1C(=O)CC1(N)CCN(Cc2ccccc2)CC1	ZINC000872301882	FD	On-Demand	Anodyne	PA	15	40
Cc1ccc(F)c2[nH]c(C(=O)N3CCNCCC3(C)C)cc12	ZINC000872301888	DF	On-Demand	Anodyne	HRH4	23	53
CN1CCN(C(=O)c2csc(COc3ccc(F)cc3)n2)Cc2cccnc21	ZINC000872301923	GG	On-Demand	Anodyne	TRPC6	20	40
CC(=O)N[C@@H](CC(=O)N1CCCCc2cccnc21)c1ccccc1	ZINC000872301927	EG	On-Demand	Anodyne	PTAFR	26	49
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@H](Oc3ccccc3)C2)C1	ZINC000872301951	CD	On-Demand	Anodyne	EPHX2	17	46
O=C(c1ccc(S(=O)(=O)C(F)F)cc1)N1CCCCc2cccnc21	ZINC000872301968	FG	On-Demand	Anodyne	AVPR2	24	42
CCOc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301993	EG	On-Demand	Anodyne	CPT1A	71	41
CCOc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301993	EG	On-Demand	Anodyne	CPT2	29	41
CCOc1ccc(OCC(=O)N2CCCCc3cccnc32)cc1	ZINC000872301993	EG	On-Demand	Anodyne	PLA2G4B	43	31
CC1(C)CCNCCN1C(=O)c1csc(NC2CC2)n1	ZINC000872302029	CD	On-Demand	Anodyne	TRPC6	52	37
CC1(C)CCNCCN1C(=O)c1csc(NC2CC2)n1	ZINC000872302029	CD	On-Demand	Anodyne	TRPC3	46	37
O=C(COc1ccc(F)cc1)N1CCCCc2cccnc21	ZINC000872302034	DF	On-Demand	Anodyne	CPT1A	75	41
O=C(COc1cccc(Cl)c1)N1CCCCc2cccnc21	ZINC000872302042	DG	On-Demand	Anodyne	CPT1A	86	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302047	ED	On-Demand	Anodyne	CPT2	42	37
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302047	ED	On-Demand	Anodyne	PREP	86	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302047	ED	On-Demand	Anodyne	WNT3	41	39
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302049	ED	On-Demand	Anodyne	CPT2	42	37
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302049	ED	On-Demand	Anodyne	PREP	86	39
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872302049	ED	On-Demand	Anodyne	WNT3	41	39
CC1(C)CCNCCN1C(=O)c1ccc(-n2cnnn2)cn1	ZINC000872302059	DC	On-Demand	Anodyne	KCNJ1	40	38
CC1(C)CCNCCN1C(=O)CCCc1cccnc1	ZINC000872302061	CE	On-Demand	Anodyne	TBXAS1	26	43
CC1(C)CCNCCN1C(=O)CCCc1cccnc1	ZINC000872302061	CE	On-Demand	Anodyne	PTAFR	32	42
CC1(C)CCNCCN1C(=O)CCCc1cccnc1	ZINC000872302061	CE	On-Demand	Anodyne	C3AR1	38	42
CN(C)S(=O)(=O)c1cc(C(=O)N2CCCCc3cccnc32)ccc1Cl	ZINC000872302069	GF	On-Demand	Anodyne	AVPR2	40	39
Cc1ccc(NC(=O)CSCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872302076	GF	On-Demand	Anodyne	TRPV1	16	48
CN1CCN(C(=O)c2cccnc2OCC(F)(F)F)Cc2cccnc21	ZINC000872302082	FF	On-Demand	Anodyne	P2RX7	31	41
O=C(N[C@]12CCC[C@H]1OCC2)c1cnc(Nc2ccccc2)nc1C(F)(F)F	ZINC000872302122	GH	On-Demand	Anodyne	STAT6	47	32
CCOc1ccc(CCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872302245	EF	On-Demand	Anodyne	GPBAR1	16	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c([nH]c4ccccc34)C2)C1	ZINC000872302267	CE	On-Demand	Anodyne	SSTR2	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c([nH]c4ccccc34)C2)C1	ZINC000872302267	CE	On-Demand	Anodyne	DRD5	22	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c([nH]c4ccccc34)C2)C1	ZINC000872302267	CE	On-Demand	Anodyne	SSTR4	54	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c([nH]c4ccccc34)C2)C1	ZINC000872302267	CE	On-Demand	Anodyne	SSTR5	43	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c([nH]c4ccccc34)C2)C1	ZINC000872302267	CE	On-Demand	Anodyne	SSTR1	19	43
O=C([C@H](c1cccnc1)C1CCCCC1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872302273	GE	On-Demand	Anodyne	C3AR1	40	39
O=C([C@@H](c1cccnc1)C1CCCCC1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872302274	GE	On-Demand	Anodyne	C3AR1	40	39
O=C([C@@H](c1cccnc1)C1CCCCC1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872302275	GE	On-Demand	Anodyne	C3AR1	40	39
O=C([C@H](c1cccnc1)C1CCCCC1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872302276	GE	On-Demand	Anodyne	C3AR1	40	39
CN1CCN(C(=O)c2cccnc2N2CCOCC2)Cc2cccnc21	ZINC000872302290	FD	On-Demand	Anodyne	P2RX7	17	41
O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCCc2cccnc21	ZINC000872302305	EH	On-Demand	Bother	AVPR2	21	41
CN1CCN(C(=O)c2cc(Cl)c(Cl)[nH]2)Cc2cccnc21	ZINC000872302326	EF	On-Demand	Anodyne	HRH4	33	46
O=C(c1cccnc1)N1CCCCc2cccnc21	ZINC000872302356	CE	On-Demand	Anodyne	AVPR2	29	42
CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)Cc2cccnc21	ZINC000872302388	FF	On-Demand	Anodyne	HRH3	15	41
CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)Cc2cccnc21	ZINC000872302388	FF	On-Demand	Anodyne	FAAH	21	47
CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)Cc2cccnc21	ZINC000872302388	FF	On-Demand	Anodyne	PARP1	16	42
O=C(c1ccncc1)N1CCCCc2cccnc21	ZINC000872302394	CE	On-Demand	Anodyne	AVPR2	34	47
Cc1ccc(N2CCC(C(=O)N3CCN(C)c4ncccc4C3)CC2)nc1	ZINC000872302398	FE	On-Demand	Anodyne	SSTR1	24	40
CCC(=O)N[C@@H](CCSC)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302413	FD	On-Demand	Anodyne	P2RY12	79	34
CCC(=O)N[C@H](CCSC)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302414	FD	On-Demand	Anodyne	P2RY12	79	34
CN1CCN(C(=O)c2cccc(NC(=O)NC3CC3)c2)Cc2cccnc21	ZINC000872302421	FE	On-Demand	Anodyne	EPHX2	46	46
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302431	GF	On-Demand	Anodyne	CPT1A	15	42
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302431	GF	On-Demand	Anodyne	CPT2	45	39
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302431	GF	On-Demand	Anodyne	PREP	82	39
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302432	GF	On-Demand	Anodyne	CPT1A	15	42
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302432	GF	On-Demand	Anodyne	CPT2	45	39
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)Cc2cccnc21	ZINC000872302432	GF	On-Demand	Anodyne	PREP	82	39
O=C(c1ccc(Cl)cc1)N1CCCCc2cccnc21	ZINC000872302433	CH	On-Demand	Anodyne	AVPR2	58	49
O=C(c1ccc([N+](=O)[O-])cc1)N1CCCCc2cccnc21	ZINC000872302438	CF	On-Demand	Bother	AVPR2	31	45
CCn1ncnc1-c1ccc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872302443	GC	On-Demand	Anodyne	L3MBTL3	42	35
CCn1ncnc1-c1ccc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872302444	GC	On-Demand	Anodyne	L3MBTL3	42	35
CN1CCN(C(=O)c2cc3ccsc3[nH]2)Cc2cccnc21	ZINC000872302449	DF	On-Demand	Anodyne	HRH4	35	66
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2ccccc2-c2nc3ccc(Cl)cc3[nH]2)C1	ZINC000872302552	FH	On-Demand	Anodyne	NR2E3	51	30
COc1ccccc1-c1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872302557	GG	On-Demand	Anodyne	TRPC6	17	44
CN1CCN(C(=O)c2csc(C3CC3)n2)Cc2cccnc21	ZINC000872302577	DF	On-Demand	Anodyne	TRPC6	46	39
COCCn1cc(C(=O)N2CCN(C)c3ncccc3C2)c2ccccc21	ZINC000872302602	FF	On-Demand	Anodyne	CNR1	21	48
COCCn1cc(C(=O)N2CCN(C)c3ncccc3C2)c2ccccc21	ZINC000872302602	FF	On-Demand	Anodyne	CNR2	24	48
COCCn1cc(C(=O)N2CCN(C)c3ncccc3C2)c2ccccc21	ZINC000872302602	FF	On-Demand	Anodyne	TPSAB1	17	49
COc1cccc(OC)c1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302614	EE	On-Demand	Anodyne	SSTR1	48	39
C[C@@H](Cc1cccc(F)c1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302653	EF	On-Demand	Anodyne	TRY2_BOVIN	55	34
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OC1CC1	ZINC000872302666	CF	On-Demand	Anodyne	HCN1	43	33
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OC1CC1	ZINC000872302666	CF	On-Demand	Anodyne	HCN4	41	33
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302684	EF	On-Demand	Anodyne	MC4R	47	39
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872302684	EF	On-Demand	Anodyne	AKT1	19	42
CN1CCN(C(=O)c2cc(F)ccc2NS(C)(=O)=O)Cc2cccnc21	ZINC000872302686	GD	On-Demand	Anodyne	P2RX7	15	41
CN1CCN(C(=O)c2ccc3c(c2)nc(O)n3C)Cc2cccnc21	ZINC000872302704	ED	On-Demand	Anodyne	HPGD	51	39
CN1CCN(C(=O)c2ccc(CN3CCCCC3=O)cc2)Cc2cccnc21	ZINC000872302716	GF	On-Demand	Anodyne	FABI	44	34
CC[C@@H](C(=O)N[C@]12CCC[C@H]1OCC2)c1ccc(F)cc1	ZINC000872302737	CG	On-Demand	Anodyne	KCNQ2	34	44
Cc1ccc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1C(F)(F)F	ZINC000872302869	GE	On-Demand	Anodyne	L3MBTL3	40	34
Cc1ccc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1C(F)(F)F	ZINC000872302870	GE	On-Demand	Anodyne	L3MBTL3	40	34
CN1CCN(C(=O)[C@H]2CCCN(CC(F)(F)F)C2)Cc2cccnc21	ZINC000872302893	FE	On-Demand	Anodyne	SLC6A1	126	33
CN1CCN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)Cc2cccnc21	ZINC000872302894	FE	On-Demand	Anodyne	SLC6A1	126	33
COc1cccc(C[C@@H](N)C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1	ZINC000872302913	FB	On-Demand	Anodyne	DPP7	22	43
COc1cccc(C[C@H](N)C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1	ZINC000872302914	FB	On-Demand	Anodyne	DPP7	22	43
COc1cccc(C[C@@H](N)C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1	ZINC000872302915	FB	On-Demand	Anodyne	DPP7	22	43
COc1cccc(C[C@H](N)C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1	ZINC000872302916	FB	On-Demand	Anodyne	DPP7	22	43
CN1CCN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)Cc2cccnc21	ZINC000872302933	GD	On-Demand	Anodyne	SCARB1	21	41
C[C@@](O)(CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccco1	ZINC000872302937	CD	On-Demand	Anodyne	AMY2	43	29
CN1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)Cc2cccnc21	ZINC000872302987	EE	On-Demand	Bother	KCNJ1	15	40
CN1CCN(C(=O)c2cc(F)cc(Cl)c2O)Cc2cccnc21	ZINC000872303004	EF	On-Demand	Anodyne	P2RX7	44	48
Cc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1O	ZINC000872303023	CE	On-Demand	Anodyne	HPGD	40	33
Cc1ccccc1[C@@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872303024	DG	On-Demand	Anodyne	PTAFR	25	45
Cc1ccccc1[C@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872303026	DG	On-Demand	Anodyne	PTAFR	25	45
O=C([C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303043	GC	On-Demand	Anodyne	SIGMAR1	25	41
O=C([C@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303045	GC	On-Demand	Anodyne	SIGMAR1	25	41
O=C([C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303047	GC	On-Demand	Anodyne	SIGMAR1	25	41
O=C([C@H]1CCN(Cc2ccccc2)C1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303048	GC	On-Demand	Anodyne	SIGMAR1	25	41
COc1ccc(-c2cnc(CCC(=O)N3CCN(C)c4ncccc4C3)o2)cc1	ZINC000872303049	GG	On-Demand	Anodyne	FAAH	15	42
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303084	ED	On-Demand	Anodyne	MC4R	18	40
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303084	ED	On-Demand	Anodyne	CTSK	20	41
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303084	ED	On-Demand	Anodyne	CTSL	20	41
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303084	ED	On-Demand	Anodyne	CAPN2	41	34
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303085	ED	On-Demand	Anodyne	MC4R	18	40
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303085	ED	On-Demand	Anodyne	CTSK	20	41
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303085	ED	On-Demand	Anodyne	CTSL	20	41
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303085	ED	On-Demand	Anodyne	CAPN2	41	34
CN1CCN(C(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)Cc2cccnc21	ZINC000872303092	GF	On-Demand	Anodyne	NAMPT	24	40
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872303109	FE	On-Demand	Anodyne	PSEN2	50	31
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N[C@]12CCC[C@H]1OCC2	ZINC000872303109	FE	On-Demand	Anodyne	PSEN1	40	30
CCCNC(=O)c1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872303123	FE	On-Demand	Anodyne	DRD4	44	34
CCCNC(=O)c1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872303123	FE	On-Demand	Anodyne	DRD3	18	41
C[C@@H](Cc1ccccc1F)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303146	EF	On-Demand	Anodyne	MC4R	26	42
C[C@H](Cc1ccccc1F)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303147	EF	On-Demand	Anodyne	MC4R	26	42
Cn1cc(CCNC(=O)[C@@H]2CCCCC[C@@H]2N)c2ccccc21	ZINC000872303149	DF	On-Demand	Anodyne	MTNR1A	19	40
Cn1cc(CCNC(=O)[C@@H]2CCCCC[C@@H]2N)c2ccccc21	ZINC000872303149	DF	On-Demand	Anodyne	MTNR1B	15	40
CN1CCN(C(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872303227	FD	On-Demand	Anodyne	PREP	24	40
CN1CCN(C(=O)[C@H]2CSCN2C(=O)C(C)(C)C)Cc2cccnc21	ZINC000872303229	FD	On-Demand	Anodyne	PREP	24	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872303233	EG	On-Demand	Anodyne	HTR1D	23	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872303233	EG	On-Demand	Anodyne	HTR1B	19	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872303233	EG	On-Demand	Anodyne	HTR1F	66	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)C1	ZINC000872303233	EG	On-Demand	Anodyne	CCR2	26	49
Cc1cccc(NC(=O)NCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872303286	FD	On-Demand	Anodyne	CCKAR	23	41
Cc1cccc(NC(=O)NCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872303286	FD	On-Demand	Anodyne	CCKBR	37	41
Cc1cccc(NC(=O)NCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872303286	FD	On-Demand	Anodyne	KCNK3	43	35
O=C(CNc1cccc(C(F)(F)F)c1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303289	GD	On-Demand	Anodyne	CCR2	43	39
O=C(CNc1cccc(C(F)(F)F)c1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303291	GD	On-Demand	Anodyne	CCR2	43	39
CN1CCN(C(=O)c2c(O)cccc2Cl)Cc2cccnc21	ZINC000872303300	DF	On-Demand	Anodyne	P2RX7	18	44
CN1CCN(C(=O)c2cccc3c2OCCO3)Cc2cccnc21	ZINC000872303323	ED	On-Demand	Anodyne	G2YM83_BOTF4	41	35
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(=O)OC(C)(C)C	ZINC000872303349	EE	On-Demand	Anodyne	PTAFR	15	44
CN1CCN(C(=O)[C@@H]2CCCN2c2ncccn2)Cc2cccnc21	ZINC000872303357	ED	On-Demand	Anodyne	PREP	42	37
CN1CCN(C(=O)[C@H]2CCCN2c2ncccn2)Cc2cccnc21	ZINC000872303358	ED	On-Demand	Anodyne	PREP	42	37
CN1CCN(C(=O)c2ccc(N3CCOCC3)cc2)Cc2cccnc21	ZINC000872303384	FE	On-Demand	Anodyne	PIK3CA	29	41
CN1CCN(C(=O)c2ccc(N3CCOCC3)cc2)Cc2cccnc21	ZINC000872303384	FE	On-Demand	Anodyne	MTOR	36	41
CN1CCN(C(=O)c2ccc(N3CCOCC3)cc2)Cc2cccnc21	ZINC000872303384	FE	On-Demand	Anodyne	PIK3CG	18	41
CN1CCN(C(=O)c2ccc(N3CCOCC3)cc2)Cc2cccnc21	ZINC000872303384	FE	On-Demand	Anodyne	AKR1C3	15	42
CN1CCN(C(=O)c2ccc(N3CCOCC3)cc2)Cc2cccnc21	ZINC000872303384	FE	On-Demand	Anodyne	SMO	19	43
CNc1ccccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872303413	CE	On-Demand	Anodyne	G2YM83_BOTF4	47	34
O=C([C@@H]1C[C@H]1c1ccsc1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303417	ED	On-Demand	Anodyne	NPBWR1	87	32
O=C([C@@H]1C[C@H]1c1ccsc1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303418	ED	On-Demand	Anodyne	NPBWR1	87	32
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303436	GE	On-Demand	Anodyne	FKBP1A	40	35
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303436	GE	On-Demand	Anodyne	CPT1A	19	48
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303436	GE	On-Demand	Anodyne	CPT2	52	45
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303436	GE	On-Demand	Anodyne	PREP	146	48
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303437	GE	On-Demand	Anodyne	FKBP1A	40	35
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303437	GE	On-Demand	Anodyne	CPT1A	19	48
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303437	GE	On-Demand	Anodyne	CPT2	52	45
CN1CCN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)Cc2cccnc21	ZINC000872303437	GE	On-Demand	Anodyne	PREP	146	48
CN1CCN(C(=O)[C@H]2CCCN2C)Cc2cccnc21	ZINC000872303443	CC	On-Demand	Anodyne	CPT2	41	37
CN1CCN(C(=O)[C@H]2CCCN2C)Cc2cccnc21	ZINC000872303443	CC	On-Demand	Anodyne	PREP	47	36
CN1CCN(C(=O)[C@@H]2CCCN2C)Cc2cccnc21	ZINC000872303444	CC	On-Demand	Anodyne	CPT2	41	37
CN1CCN(C(=O)[C@@H]2CCCN2C)Cc2cccnc21	ZINC000872303444	CC	On-Demand	Anodyne	PREP	47	36
NCc1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)c(F)c1	ZINC000872303448	CD	On-Demand	Anodyne	F2	16	40
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303459	GF	On-Demand	Anodyne	CPT1A	31	48
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303459	GF	On-Demand	Anodyne	CPT2	51	46
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303459	GF	On-Demand	Anodyne	PREP	115	57
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303459	GF	On-Demand	Anodyne	SFRP1	41	38
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303459	GF	On-Demand	Anodyne	WNT3	46	38
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303460	GF	On-Demand	Anodyne	CPT1A	31	48
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303460	GF	On-Demand	Anodyne	CPT2	51	46
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303460	GF	On-Demand	Anodyne	PREP	115	57
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303460	GF	On-Demand	Anodyne	SFRP1	41	38
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)Cc2cccnc21	ZINC000872303460	GF	On-Demand	Anodyne	WNT3	46	38
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)S(=O)(=O)c1ccc(F)cc1	ZINC000872303472	GE	On-Demand	Anodyne	DPP8	21	41
N#Cc1cccc(C2(NC(=O)[C@]34C[C@H](N)C[C@H]3C4)CCOCC2)c1	ZINC000872303582	ED	On-Demand	Mild	MCHR1	18	40
CN1CCN(C(=O)[C@@H]2CSCN2C(=O)C2CCCC2)Cc2cccnc21	ZINC000872303583	FD	On-Demand	Anodyne	PREP	44	45
CN1CCN(C(=O)[C@H]2CSCN2C(=O)C2CCCC2)Cc2cccnc21	ZINC000872303584	FD	On-Demand	Anodyne	PREP	44	45
CN1CCN(C(=O)c2ccc(OC3CCC3)cc2)Cc2cccnc21	ZINC000872303598	EG	On-Demand	Anodyne	L3MBTL3	40	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000872303620	DD	On-Demand	Anodyne	L3MBTL3	63	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000872303624	DD	On-Demand	Anodyne	L3MBTL3	63	42
CCNc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872303646	DE	On-Demand	Anodyne	TRPC6	62	46
CCNc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872303646	DE	On-Demand	Anodyne	TRPC3	54	41
COCC(=O)N[C@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872303661	EC	On-Demand	Anodyne	CCR1	52	37
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1cccc(F)c1	ZINC000872303674	EG	On-Demand	Anodyne	PTAFR	19	41
CCOc1cc(Cl)ccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872303680	DG	On-Demand	Anodyne	HCN1	42	33
CCOc1cc(Cl)ccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872303680	DG	On-Demand	Anodyne	HCN4	42	33
CN1CCN(C(=O)c2csc(NC3CC3)n2)Cc2cccnc21	ZINC000872303697	EE	On-Demand	Anodyne	TRPC6	65	46
CN1CCN(C(=O)c2csc(NC3CC3)n2)Cc2cccnc21	ZINC000872303697	EE	On-Demand	Anodyne	TRPC3	57	41
CN1CCN(C(=O)c2ccccc2CN2CCOCC2)Cc2cccnc21	ZINC000872303699	FE	On-Demand	Anodyne	CCR8	19	40
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)C1	ZINC000872303724	GC	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccccc1)N1CC[C@H](C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)C1	ZINC000872303725	GC	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)C1	ZINC000872303726	GC	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccccc1)N1CC[C@@H](C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)C1	ZINC000872303727	GC	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccc2[nH]c3c(c2c1)CCCC3)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303745	GE	On-Demand	Anodyne	L3MBTL3	40	34
O=C(c1ccc2[nH]c3c(c2c1)CCCC3)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872303746	GE	On-Demand	Anodyne	L3MBTL3	40	34
CN1CCN(C(=O)c2cc(F)ccc2N2CCOCC2)Cc2cccnc21	ZINC000872303785	FE	On-Demand	Anodyne	SLC6A9	17	42
CN1CCN(C(=O)c2ccc(N3CCC(O)CC3)cc2)Cc2cccnc21	ZINC000872303820	FE	On-Demand	Anodyne	L3MBTL3	28	41
COCc1ccnc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872303856	CE	On-Demand	Anodyne	TYK2	61	36
CN1CCN(C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872303859	FE	On-Demand	Anodyne	GPR119	53	45
CN1CCN(C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872303859	FE	On-Demand	Anodyne	SFRP1	15	42
CN1CCN(C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872303862	FE	On-Demand	Anodyne	GPR119	53	45
CN1CCN(C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872303862	FE	On-Demand	Anodyne	SFRP1	15	42
CN1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)Cc2cccnc21	ZINC000872303881	FD	On-Demand	Anodyne	PREP	40	39
CN1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)Cc2cccnc21	ZINC000872303883	FD	On-Demand	Anodyne	PREP	40	39
CN1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)Cc2cccnc21	ZINC000872303887	FD	On-Demand	Anodyne	SIGMAR1	17	42
CN1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCO2)Cc2cccnc21	ZINC000872303889	FD	On-Demand	Anodyne	SIGMAR1	17	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@@H](N3CCOCC3)CC2)C1	ZINC000872303907	DC	On-Demand	Anodyne	L3MBTL3	42	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC[C@H](N3CCOCC3)CC2)C1	ZINC000872303908	DC	On-Demand	Anodyne	L3MBTL3	42	37
COc1ccc([C@H](CNC(=O)c2cc(C)n(-c3cc(C)on3)c2C)c2c[nH]c3ccccc23)cc1	ZINC000872303974	JK	On-Demand	Anodyne	GHSR	28	40
COc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3cc(C)on3)c2C)c2c[nH]c3ccccc23)cc1	ZINC000872303995	JK	On-Demand	Anodyne	GHSR	28	40
CN1CCN(C(=O)c2ccc(C(N)=O)s2)Cc2cccnc21	ZINC000872304007	DD	On-Demand	Anodyne	SIRT3	66	34
CN1CCN(C(=O)c2ccc(C(N)=O)s2)Cc2cccnc21	ZINC000872304007	DD	On-Demand	Anodyne	SIRT2	62	34
CN1CCN(C(=O)c2ccc(C(N)=O)s2)Cc2cccnc21	ZINC000872304007	DD	On-Demand	Anodyne	SIRT1	54	34
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304015	FE	On-Demand	Anodyne	CPT2	48	43
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304015	FE	On-Demand	Anodyne	PREP	108	46
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304015	FE	On-Demand	Anodyne	SFRP1	41	42
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304015	FE	On-Demand	Anodyne	WNT3	48	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304026	FE	On-Demand	Anodyne	CPT2	48	43
CN1CCN(C(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304026	FE	On-Demand	Anodyne	PREP	108	46
CN1CCN(C(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304026	FE	On-Demand	Anodyne	SFRP1	41	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)Cc2cccnc21	ZINC000872304026	FE	On-Demand	Anodyne	WNT3	48	42
C[C@@H](CCc1ccccc1F)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304037	EG	On-Demand	Anodyne	MC4R	15	41
C[C@H](CCc1ccccc1F)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304039	EG	On-Demand	Anodyne	MC4R	15	41
CN1CCN(C(=O)c2ccc(N3CCCC3)nn2)Cc2cccnc21	ZINC000872304042	ED	On-Demand	Anodyne	SCD1	43	37
N#C[C@@H]1CN(C(=O)[C@H]2CCCCC[C@H]2N)C[C@H]1c1ccccc1	ZINC000872304097	DF	On-Demand	Mild	CCR5	28	45
CC(=O)c1ccccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304105	DE	On-Demand	Anodyne	P2RX7	24	41
CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872304109	CF	On-Demand	Anodyne	KCNA3	39	43
CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872304109	CF	On-Demand	Anodyne	HCN1	84	45
CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872304109	CF	On-Demand	Anodyne	HCN4	66	45
CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872304109	CF	On-Demand	Anodyne	KCNK3	32	41
CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872304109	CF	On-Demand	Anodyne	KCNK9	24	41
O=C(Nc1ccc2[nH]c(-c3ccncc3)nc2c1)[C@]12CCC[C@H]1OCC2	ZINC000872304153	EH	On-Demand	Anodyne	CHEK2	71	36
O=C(Nc1ccc2[nH]c(-c3ccncc3)nc2c1)[C@]12CCC[C@H]1OCC2	ZINC000872304153	EH	On-Demand	Anodyne	HPSE	17	41
O=C(Nc1ccc2[nH]c(-c3ccncc3)nc2c1)[C@]12CCC[C@H]1OCC2	ZINC000872304153	EH	On-Demand	Anodyne	NR2E3	83	46
CN1CCN(C(=O)c2cccc(CS(N)(=O)=O)c2)Cc2cccnc21	ZINC000872304169	FC	On-Demand	Anodyne	TRY2_BOVIN	43	33
N[C@@H]1CCCCC[C@@H]1C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000872304259	EG	On-Demand	Anodyne	KCNH2	44	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000872304259	EG	On-Demand	Anodyne	GLRA1	43	33
COc1ccc([C@@H](CNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c2c[nH]c3ccccc23)cc1	ZINC000872304309	JJ	On-Demand	Anodyne	HDAC8	15	49
COc1ccc([C@@H](CNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c2c[nH]c3ccccc23)cc1	ZINC000872304309	JJ	On-Demand	Anodyne	HDAC1	21	44
COc1ccc([C@H](CNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c2c[nH]c3ccccc23)cc1	ZINC000872304310	JJ	On-Demand	Anodyne	HDAC8	15	49
COc1ccc([C@H](CNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c2c[nH]c3ccccc23)cc1	ZINC000872304310	JJ	On-Demand	Anodyne	HDAC1	21	44
CN1CCN(C(=O)c2cc(F)ccc2O)Cc2cccnc21	ZINC000872304362	DE	On-Demand	Anodyne	P2RX7	23	46
COc1ccc2[nH]cc(CC(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304379	GD	On-Demand	Anodyne	HTR1D	26	40
COc1ccc2[nH]cc(CC(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304379	GD	On-Demand	Anodyne	HTR1B	21	40
COc1ccc2[nH]cc(CC(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304379	GD	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc2[nH]cc(CC(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304380	GD	On-Demand	Anodyne	HTR1D	26	40
COc1ccc2[nH]cc(CC(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304380	GD	On-Demand	Anodyne	HTR1B	21	40
COc1ccc2[nH]cc(CC(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)c2c1	ZINC000872304380	GD	On-Demand	Anodyne	MTNR1A	15	42
CN1CCN(C(=O)c2cc(N3CCNC3=O)ccc2F)Cc2cccnc21	ZINC000872304402	FD	On-Demand	Anodyne	PARP1	43	36
CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)Cc2cccnc21	ZINC000872304432	DD	On-Demand	Bother	HRH4	18	42
CN1CCN(C(=O)c2cccnc2Br)Cc2cccnc21	ZINC000872304441	EE	On-Demand	Anodyne	P2RX7	23	41
COCCCOc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872304467	FF	On-Demand	Anodyne	DRD4	45	34
CN1CCN(C(=O)c2cccc(F)c2Cl)Cc2cccnc21	ZINC000872304481	DF	On-Demand	Anodyne	P2RX7	60	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCC(F)(F)c1ccc(F)cc1	ZINC000872304544	DF	On-Demand	Anodyne	CACNA1G	35	40
CN1CCN(C(=O)c2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000872304554	FF	On-Demand	Anodyne	FABI	50	36
CN1CCN(C(=O)c2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000872304554	FF	On-Demand	Anodyne	HRH3	31	51
CN1CCN(C(=O)c2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000872304554	FF	On-Demand	Anodyne	L3MBTL3	34	44
CN1CCN(C(=O)c2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000872304554	FF	On-Demand	Anodyne	NOD2	40	34
O=C(c1ccc2[nH]ccc2c1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872304573	ED	On-Demand	Anodyne	L3MBTL3	50	36
O=C(c1ccc2[nH]ccc2c1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872304576	ED	On-Demand	Anodyne	L3MBTL3	50	36
CN1CCN(C(=O)c2ccc(F)c(F)c2F)Cc2cccnc21	ZINC000872304580	DF	On-Demand	Anodyne	P2RX7	35	40
C/C(=C/C(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872304581	DF	On-Demand	Anodyne	PTAFR	17	42
CN1CCN(C(=O)[C@H]2CCN(C3CCCCC3)C2)Cc2cccnc21	ZINC000872304613	EF	On-Demand	Anodyne	HRH3	15	44
CN1CCN(C(=O)[C@@H]2CCN(C3CCCCC3)C2)Cc2cccnc21	ZINC000872304615	EF	On-Demand	Anodyne	HRH3	15	44
COc1cc2c(cc1OC)CN(CC(=O)N1CCN(C)c3ncccc3C1)CC2	ZINC000872304626	GD	On-Demand	Anodyne	HTR7	15	41
COc1cc2c(cc1OC)CN(CC(=O)N1CCN(C)c3ncccc3C1)CC2	ZINC000872304626	GD	On-Demand	Anodyne	ABCB1B	70	40
COc1cc2c(cc1OC)CN(CC(=O)N1CCN(C)c3ncccc3C1)CC2	ZINC000872304626	GD	On-Demand	Anodyne	ABCB1	29	48
COc1cc2c(cc1OC)CN(CC(=O)N1CCN(C)c3ncccc3C1)CC2	ZINC000872304626	GD	On-Demand	Anodyne	ABCG2	39	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000872304647	EE	On-Demand	Clean	F2	15	40
COc1cccc([C@@H](C)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872304654	EG	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872304654	EG	On-Demand	Anodyne	PTAFR	18	40
COc1cccc([C@H](C)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872304655	EG	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872304655	EG	On-Demand	Anodyne	PTAFR	18	40
CCCN(CC)C(=O)c1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872304682	GG	On-Demand	Anodyne	OPRD1	23	43
CCN1CCCC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304693	DD	On-Demand	Anodyne	CPT2	43	38
CCN1CCCC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304693	DD	On-Demand	Anodyne	PREP	44	38
CCN1CCCC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304694	DD	On-Demand	Anodyne	CPT2	43	38
CCN1CCCC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304694	DD	On-Demand	Anodyne	PREP	44	38
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000872304715	EE	On-Demand	Anodyne	ACHE	29	48
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000872304715	EE	On-Demand	Anodyne	HTR4	41	39
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000872304715	EE	On-Demand	Anodyne	SIGMAR1	27	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000872304715	EE	On-Demand	Anodyne	CCR3	15	43
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000872304715	EE	On-Demand	Anodyne	CACNA1I	61	41
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)Cc2cccnc21	ZINC000872304718	FE	On-Demand	Anodyne	CPT2	44	38
CN1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)Cc2cccnc21	ZINC000872304718	FE	On-Demand	Anodyne	PREP	86	38
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)Cc2cccnc21	ZINC000872304719	FE	On-Demand	Anodyne	CPT2	44	38
CN1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)Cc2cccnc21	ZINC000872304719	FE	On-Demand	Anodyne	PREP	86	38
COc1ccccc1[C@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872304725	EG	On-Demand	Anodyne	PTAFR	23	41
COc1ccccc1[C@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872304725	EG	On-Demand	Anodyne	DPP8	15	42
C=CC(=O)Nc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1	ZINC000872304731	DE	On-Demand	Anodyne	F13A1	47	37
Cc1ccc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1O	ZINC000872304742	EC	On-Demand	Anodyne	L3MBTL3	58	36
Cc1ccc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1O	ZINC000872304743	EC	On-Demand	Anodyne	L3MBTL3	58	36
C#CCN1CCC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872304748	CC	On-Demand	Mild	PREP	53	38
CC(=O)N[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1c(F)cccc1F	ZINC000872304783	GE	On-Demand	Anodyne	PTAFR	15	41
CN1CCN(C(=O)c2csc(C(C)(C)C)n2)Cc2cccnc21	ZINC000872304785	EF	On-Demand	Anodyne	TRPC6	30	40
O=C(c1ccc2cc[nH]c2c1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872304802	ED	On-Demand	Anodyne	L3MBTL3	57	38
O=C(c1ccc2cc[nH]c2c1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872304803	ED	On-Demand	Anodyne	L3MBTL3	57	38
COc1cccc(OC)c1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872304865	EE	On-Demand	Anodyne	SSTR1	49	39
CC[C@@H](C(=O)N[C@]12CCC[C@H]1OCC2)c1cccc(C(F)(F)F)c1	ZINC000872304895	EI	On-Demand	Anodyne	KCNQ2	35	50
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccncc1	ZINC000872304920	DE	On-Demand	Anodyne	PTAFR	22	44
CN(c1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872304922	DF	On-Demand	Anodyne	CCR5	27	40
CN(c1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872304922	DF	On-Demand	Anodyne	AMY2	46	34
CN(c1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872304923	DF	On-Demand	Anodyne	CCR5	27	40
CN(c1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CCCCC[C@@H]2N)C1	ZINC000872304923	DF	On-Demand	Anodyne	AMY2	46	34
CN1CCN(C(=O)c2cc(F)cc(Cl)c2)Cc2cccnc21	ZINC000872304926	DF	On-Demand	Anodyne	P2RX7	20	40
CN1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])Cc2cccnc21	ZINC000872304946	EE	On-Demand	Bother	P2RX7	20	45
CC[C@@H](C)c1ccc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872304956	FE	On-Demand	Anodyne	L3MBTL3	52	38
CC[C@@H](C)c1ccc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1	ZINC000872304957	FE	On-Demand	Anodyne	L3MBTL3	52	38
CN1CCN(C(=O)c2cccc(Cl)c2F)Cc2cccnc21	ZINC000872304973	DF	On-Demand	Anodyne	P2RX7	61	48
CCNc1ccc(C(=O)N[C@]23CCC[C@H]2OCC3)cc1[N+](=O)[O-]	ZINC000872304976	DE	On-Demand	Bother	TAAR1	18	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000872304987	ED	On-Demand	Anodyne	SIGMAR1	18	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000872304987	ED	On-Demand	Anodyne	CCR3	17	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000872304988	ED	On-Demand	Anodyne	SIGMAR1	18	46
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000872304988	ED	On-Demand	Anodyne	CCR3	17	40
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305007	GE	On-Demand	Anodyne	P2RY12	198	40
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305007	GE	On-Demand	Anodyne	UGCG	38	40
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305007	GE	On-Demand	Anodyne	TGM2	17	40
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(Cl)c1	ZINC000872305011	EF	On-Demand	Anodyne	DRD4	42	33
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(Cl)c1	ZINC000872305011	EF	On-Demand	Anodyne	P2RX7	29	47
O=C(N[C@]12CCC[C@H]1OCC2)C1(Cc2ccccc2)CC1	ZINC000872305022	CF	On-Demand	Anodyne	SLC12A5	47	35
CN1CCN(C(=O)c2cccc(CN3CCOCC3)c2)Cc2cccnc21	ZINC000872305023	FE	On-Demand	Anodyne	FAAH	16	41
COc1ccccc1C[C@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872305026	FG	On-Demand	Anodyne	DPP8	15	41
COc1ccccc1C[C@@H](C)CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872305028	FG	On-Demand	Anodyne	DPP8	15	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872305061	FE	On-Demand	Anodyne	GRPR	46	31
CCC(=O)N1CSC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305073	ED	On-Demand	Anodyne	PREP	34	47
CCC(=O)N1CSC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305075	ED	On-Demand	Anodyne	PREP	34	47
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OCC1CC1	ZINC000872305077	DF	On-Demand	Anodyne	HCN1	61	36
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OCC1CC1	ZINC000872305077	DF	On-Demand	Anodyne	HCN4	54	36
O=C(CCc1c[nH]c2ccccc12)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305083	FD	On-Demand	Anodyne	MC5R	31	47
O=C(CCc1c[nH]c2ccccc12)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305085	FD	On-Demand	Anodyne	MC5R	31	47
CN1CCN(C(=O)Cc2cccnc2)Cc2cccnc21	ZINC000872305089	CD	On-Demand	Anodyne	PTAFR	15	41
CN1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)Cc2cccnc21	ZINC000872305114	FE	On-Demand	Anodyne	SLC6A1	85	35
CN1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)Cc2cccnc21	ZINC000872305115	FE	On-Demand	Anodyne	SLC6A1	85	35
CN1CCN(C(=O)c2ccc(CNC(=O)C3CCCC3)cc2)Cc2cccnc21	ZINC000872305116	GF	On-Demand	Anodyne	NAMPT	30	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)[C@]13CCC[C@H]1OCC3)CC2	ZINC000872305118	EE	On-Demand	Anodyne	CCR2	22	45
COC(=O)N[C@@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872305133	DD	On-Demand	Anodyne	CCR1	54	38
COC(=O)N[C@H](C(=O)N1CCN(C)c2ncccc2C1)C(C)C	ZINC000872305134	DD	On-Demand	Anodyne	CCR1	54	38
COc1ccc(NC(=O)C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872305193	ED	On-Demand	Anodyne	PDGFRB	50	39
CN1CCN(C(=O)Cn2ccnc2)Cc2cccnc21	ZINC000872305201	CC	On-Demand	Anodyne	TBXAS1	41	37
COCCCOc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872305222	FF	On-Demand	Anodyne	HRH3	20	42
Cn1cc(-c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)nn1	ZINC000872305248	DE	On-Demand	Anodyne	HDAC10	21	49
Cn1cc(-c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)nn1	ZINC000872305248	DE	On-Demand	Anodyne	HDAC3	25	49
Cn1cc(-c2cccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)c2)nn1	ZINC000872305248	DE	On-Demand	Anodyne	HDAC6	17	49
CN1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])Cc2cccnc21	ZINC000872305274	EF	On-Demand	Bother	P2RX7	46	44
Cc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(F)c1	ZINC000872305278	CF	On-Demand	Anodyne	P2RX7	27	41
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305295	FD	On-Demand	Anodyne	HRH4	22	56
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305295	FD	On-Demand	Anodyne	PYGL	69	39
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305295	FD	On-Demand	Anodyne	FPR2	22	40
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305296	FD	On-Demand	Anodyne	HRH4	22	56
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305296	FD	On-Demand	Anodyne	PYGL	69	39
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305296	FD	On-Demand	Anodyne	FPR2	22	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OC(F)(F)F	ZINC000872305308	DG	On-Demand	Anodyne	KCNK3	15	40
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1OC(F)(F)F	ZINC000872305308	DG	On-Demand	Anodyne	KCNK9	22	40
CN1CCN(C(=O)c2cccc(F)c2F)Cc2cccnc21	ZINC000872305343	DE	On-Demand	Anodyne	P2RX7	48	44
CCn1cc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305366	FD	On-Demand	Anodyne	CNR1	15	42
CCn1cc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305366	FD	On-Demand	Anodyne	TPSAB1	22	45
CCn1cc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305367	FD	On-Demand	Anodyne	CNR1	15	42
CCn1cc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305367	FD	On-Demand	Anodyne	TPSAB1	22	45
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1F	ZINC000872305389	EG	On-Demand	Anodyne	PTAFR	23	42
CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305398	FD	On-Demand	Anodyne	PREP	23	40
CC[C@@H](C)C(=O)N1CSC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305405	FD	On-Demand	Anodyne	PREP	23	40
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc(-n2ccccc2=O)cc1F	ZINC000872305459	EF	On-Demand	Anodyne	F10	33	59
O=C(N[C@]12CCC[C@H]1OCC2)c1ccccc1C(F)(F)F	ZINC000872305522	CG	On-Demand	Anodyne	RBP4	40	34
COc1cccc(SCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872305527	EF	On-Demand	Anodyne	DRD4	41	31
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)C1	ZINC000872305543	ED	On-Demand	Anodyne	SSTR3	30	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccnc(OCCO)c1	ZINC000872305548	CD	On-Demand	Anodyne	TYK2	54	33
Cc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1F	ZINC000872305592	CF	On-Demand	Anodyne	P2RX7	50	42
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	DRD4	22	42
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	HRH2	26	41
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	CHRM3	20	42
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	SIGMAR1	23	49
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	CCR3	37	47
N#Cc1cccc(CN2CCC(NC(=O)[C@H]3CCCCC[C@H]3N)CC2)c1	ZINC000872305606	FF	On-Demand	Mild	MCHR1	54	49
CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872305654	EG	On-Demand	Anodyne	TRPV1	26	43
CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872305654	EG	On-Demand	Anodyne	P2RX7	46	37
CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)Cc2cccnc21	ZINC000872305654	EG	On-Demand	Anodyne	RBP4	30	46
Cc1ccc2cc(C(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)[nH]c2c1	ZINC000872305660	FD	On-Demand	Anodyne	GRIN2B	20	43
Cc1ccc2cc(C(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)[nH]c2c1	ZINC000872305660	FD	On-Demand	Anodyne	AKR1C3	18	43
Cc1ccc2cc(C(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)[nH]c2c1	ZINC000872305663	FD	On-Demand	Anodyne	GRIN2B	20	43
Cc1ccc2cc(C(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)[nH]c2c1	ZINC000872305663	FD	On-Demand	Anodyne	AKR1C3	18	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	TGM1	15	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	EPHX2	43	69
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	TGM2	70	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	F13A1	61	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	SFRP1	101	43
N[C@@H]1CCCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872305667	GD	On-Demand	Anodyne	WNT3	60	32
CN1CCN(C(=O)c2ccncc2Cl)Cc2cccnc21	ZINC000872305705	DE	On-Demand	Anodyne	P2RX7	38	45
CN1CCN(C(=O)[C@@H](O)c2cccnc2)Cc2cccnc21	ZINC000872305744	CC	On-Demand	Anodyne	PTAFR	19	40
CN1CCN(C(=O)[C@H](O)c2cccnc2)Cc2cccnc21	ZINC000872305746	CC	On-Demand	Anodyne	PTAFR	19	40
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305773	GE	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305773	GE	On-Demand	Anodyne	PREP	83	42
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305773	GE	On-Demand	Anodyne	SFRP1	40	35
CN1CCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305773	GE	On-Demand	Anodyne	WNT3	48	35
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305775	GE	On-Demand	Anodyne	CPT2	43	38
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305775	GE	On-Demand	Anodyne	PREP	83	42
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305775	GE	On-Demand	Anodyne	SFRP1	40	35
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)Cc2cccnc21	ZINC000872305775	GE	On-Demand	Anodyne	WNT3	48	35
CN1CCN(C(=O)c2ccc(N3CCOCC3)c(F)c2)Cc2cccnc21	ZINC000872305781	FE	On-Demand	Anodyne	SLC6A9	20	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1ccc2c(=O)[nH]ccc2c1	ZINC000872305783	CE	On-Demand	Anodyne	ROCK2	26	54
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)c1ncco1	ZINC000872305821	EF	On-Demand	Anodyne	F11	49	42
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)c1ncco1	ZINC000872305823	EF	On-Demand	Anodyne	F11	49	42
CCCC[C@@H](NC(N)=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305824	DD	On-Demand	Anodyne	P2RY12	172	36
CCCC[C@H](NC(N)=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872305826	DD	On-Demand	Anodyne	P2RY12	172	36
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccnc2ccccc12	ZINC000872305827	DF	On-Demand	Anodyne	ADAM17	16	44
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccnc2ccccc12	ZINC000872305827	DF	On-Demand	Anodyne	MTNR1A	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)NCCc1ccnc2ccccc12	ZINC000872305827	DF	On-Demand	Anodyne	HNMT	46	35
COc1ccc2c(c1)CN(C(=O)[C@@H]1CCCCC[C@@H]1N)C2	ZINC000872305852	CE	On-Demand	Anodyne	CPT2	29	40
N#CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872305865	CE	On-Demand	Mild	HCN1	49	33
N#CCOc1ccccc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872305865	CE	On-Demand	Mild	HCN4	43	33
O=C(CCCc1c[nH]c2ccccc12)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305877	GD	On-Demand	Anodyne	MC5R	30	42
O=C(CCCc1c[nH]c2ccccc12)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305878	GD	On-Demand	Anodyne	MC5R	30	42
CN1CCN(C(=O)c2ccc(CN3CCC(CO)CC3)cc2)Cc2cccnc21	ZINC000872305887	GE	On-Demand	Anodyne	ACHE	34	40
CN1CCN(C(=O)c2ccc(CN3CCC(CO)CC3)cc2)Cc2cccnc21	ZINC000872305887	GE	On-Demand	Anodyne	SIGMAR1	24	43
CCOc1ccccc1[C@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(C)=O	ZINC000872305896	GF	On-Demand	Anodyne	PTAFR	24	45
CCOc1ccccc1[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)NC(C)=O	ZINC000872305897	GF	On-Demand	Anodyne	PTAFR	24	45
COCCc1ccc(OC[C@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305907	FD	On-Demand	Anodyne	ADRB2	36	55
COCCc1ccc(OC[C@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305907	FD	On-Demand	Anodyne	ADRB1	66	55
COCCc1ccc(OC[C@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305907	FD	On-Demand	Anodyne	ADRB3	42	39
COCCc1ccc(OC[C@@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305908	FD	On-Demand	Anodyne	ADRB2	36	55
COCCc1ccc(OC[C@@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305908	FD	On-Demand	Anodyne	ADRB1	66	55
COCCc1ccc(OC[C@@H](O)CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1	ZINC000872305908	FD	On-Demand	Anodyne	ADRB3	42	39
CN1CCN(C(=O)c2ccc3c(c2)nnn3C)Cc2cccnc21	ZINC000872305935	DD	On-Demand	Anodyne	HPGD	48	37
COCCn1cc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305936	GD	On-Demand	Anodyne	CNR1	17	44
COCCn1cc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305936	GD	On-Demand	Anodyne	CNR2	19	44
COCCn1cc(C(=O)N2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305936	GD	On-Demand	Anodyne	TPSAB1	18	49
COCCn1cc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305937	GD	On-Demand	Anodyne	CNR1	17	44
COCCn1cc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305937	GD	On-Demand	Anodyne	CNR2	19	44
COCCn1cc(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c2ccccc21	ZINC000872305937	GD	On-Demand	Anodyne	TPSAB1	18	49
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccnc1N1CCCC1	ZINC000872305950	DE	On-Demand	Anodyne	SCN2A	19	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccnc1N1CCCC1	ZINC000872305950	DE	On-Demand	Anodyne	SCN10A	20	47
O=C(c1cc2ccccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305989	ED	On-Demand	Anodyne	HRH4	21	48
O=C(c1cc2ccccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305989	ED	On-Demand	Anodyne	FPR2	23	41
O=C(c1cc2ccccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305989	ED	On-Demand	Anodyne	AKR1C3	20	48
O=C(c1cc2ccccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305990	ED	On-Demand	Anodyne	HRH4	21	48
O=C(c1cc2ccccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305990	ED	On-Demand	Anodyne	FPR2	23	41
O=C(c1cc2ccccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872305990	ED	On-Demand	Anodyne	AKR1C3	20	48
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306014	FD	On-Demand	Anodyne	HRH4	16	48
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306014	FD	On-Demand	Anodyne	PLD1	26	40
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306014	FD	On-Demand	Anodyne	PLD2	40	40
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306014	FD	On-Demand	Anodyne	FPR2	22	40
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306015	FD	On-Demand	Anodyne	HRH4	16	48
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306015	FD	On-Demand	Anodyne	PLD1	26	40
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306015	FD	On-Demand	Anodyne	PLD2	40	40
O=C(c1cc2cc(F)ccc2[nH]1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306015	FD	On-Demand	Anodyne	FPR2	22	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000872306018	FD	On-Demand	Anodyne	CCR5	19	40
CN1CCN(C(=O)c2cccn(C)c2=O)Cc2cccnc21	ZINC000872306033	CC	On-Demand	Anodyne	P2RX7	23	44
COC(=O)c1ccc(CCC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872306037	FE	On-Demand	Anodyne	FAAH	18	41
Cn1nc(C(C)(C)C)cc1C(=O)N[C@]12CCC[C@H]1OCC2	ZINC000872306099	CE	On-Demand	Anodyne	CTSV	40	32
CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])Cc2cccnc21	ZINC000872306100	EE	On-Demand	Bother	P2RX7	18	43
Cc1cccc(C)c1C(=O)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306104	ED	On-Demand	Anodyne	CCR5	25	42
Cc1cccc(C)c1C(=O)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306105	ED	On-Demand	Anodyne	CCR5	25	42
CN1CCN(C(=O)[C@H]2CCCCN2C)Cc2cccnc21	ZINC000872306113	CD	On-Demand	Anodyne	CPT2	45	40
CN1CCN(C(=O)[C@H]2CCCCN2C)Cc2cccnc21	ZINC000872306113	CD	On-Demand	Anodyne	PREP	44	38
COCCOc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872306118	EE	On-Demand	Anodyne	HRH3	16	41
C[C@@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306128	DF	On-Demand	Anodyne	MC4R	40	39
C[C@@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306128	DF	On-Demand	Anodyne	AKT1	16	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000872306147	EC	On-Demand	Anodyne	SIGMAR1	16	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000872306148	EC	On-Demand	Anodyne	SIGMAR1	16	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2ccccc2)C1	ZINC000872306156	DG	On-Demand	Anodyne	CCR5	33	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2ccccc2)C1	ZINC000872306156	DG	On-Demand	Anodyne	SLC18A3	25	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@@H](c2ccccc2)C1	ZINC000872306156	DG	On-Demand	Anodyne	ADAM10	27	47
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2ccccc2)C1	ZINC000872306157	DG	On-Demand	Anodyne	CCR5	33	46
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2ccccc2)C1	ZINC000872306157	DG	On-Demand	Anodyne	SLC18A3	25	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC[C@H](c2ccccc2)C1	ZINC000872306157	DG	On-Demand	Anodyne	ADAM10	27	47
CCOc1ncc(C(=O)N2CCN(C)c3ncccc3C2)cc1Cl	ZINC000872306160	EF	On-Demand	Anodyne	P2RY12	17	42
CC[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872306167	DG	On-Demand	Anodyne	PTAFR	34	40
N#Cc1ccc(CCNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872306174	CE	On-Demand	Mild	CTSC	20	40
N#Cc1ccc(CCNC(=O)[C@H]2CCCCC[C@H]2N)cc1	ZINC000872306174	CE	On-Demand	Mild	GPBAR1	34	44
CN1CCN(C(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306194	GE	On-Demand	Anodyne	PREP	49	41
CN1CCN(C(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306194	GE	On-Demand	Anodyne	L3MBTL3	40	35
CN1CCN(C(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306194	GE	On-Demand	Anodyne	MAP3K12	32	42
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306195	GE	On-Demand	Anodyne	PREP	49	41
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306195	GE	On-Demand	Anodyne	L3MBTL3	40	35
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872306195	GE	On-Demand	Anodyne	MAP3K12	32	42
CN1CCN(C(=O)c2cc(F)c(Cl)cc2F)Cc2cccnc21	ZINC000872306224	EG	On-Demand	Anodyne	P2RX7	49	42
CN1CCN(C(=O)c2ccc(C(F)(F)F)nc2Cl)Cc2cccnc21	ZINC000872306237	FG	On-Demand	Anodyne	P2RX7	47	44
CCC(CC)(CNC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccc(F)cc1	ZINC000872306238	DG	On-Demand	Anodyne	CACNA1G	42	51
CN1CCN(C(=O)[C@@H]2CCCN2C(N)=O)Cc2cccnc21	ZINC000872306239	DC	On-Demand	Anodyne	CPT2	46	40
CN1CCN(C(=O)[C@@H]2CCCN2C(N)=O)Cc2cccnc21	ZINC000872306239	DC	On-Demand	Anodyne	PREP	94	40
COc1ccc(OCC(=O)N2CCN(C)c3ncccc3C2)cc1C	ZINC000872306306	EE	On-Demand	Anodyne	HTR1B	18	44
CN(C)C(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(Cl)c1	ZINC000872306352	GF	On-Demand	Anodyne	AVPR2	48	37
CN(C)C(=O)Nc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(Cl)c1	ZINC000872306352	GF	On-Demand	Anodyne	P2RX7	19	44
CNC(=O)COc1cccc(CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872306372	FD	On-Demand	Anodyne	BRS3	25	44
CN1CCN(C(=O)c2cc(F)c(F)cc2F)Cc2cccnc21	ZINC000872306406	DF	On-Demand	Anodyne	P2RX7	29	40
CN1CCN(C(=O)Cc2cccc(OCC(F)(F)F)c2)Cc2cccnc21	ZINC000872306409	GG	On-Demand	Anodyne	BRS3	36	56
N[C@@H]1CCCCC[C@@H]1C(=O)NCC1CCN(CC2CC2)CC1	ZINC000872306422	DE	On-Demand	Anodyne	CACNA1I	48	34
CN1CCN(C(=O)c2cccnc2C(F)(F)F)Cc2cccnc21	ZINC000872306439	EF	On-Demand	Anodyne	P2RX7	46	46
CN1CCN(C(=O)c2csc([C@@H]3CCCO3)n2)Cc2cccnc21	ZINC000872306452	EE	On-Demand	Anodyne	TRPC6	48	36
CN1CCN(C(=O)c2csc([C@@H]3CCCO3)n2)Cc2cccnc21	ZINC000872306452	EE	On-Demand	Anodyne	TRPC3	41	34
CN1CCN(C(=O)c2csc([C@H]3CCCO3)n2)Cc2cccnc21	ZINC000872306453	EE	On-Demand	Anodyne	TRPC6	48	36
CN1CCN(C(=O)c2csc([C@H]3CCCO3)n2)Cc2cccnc21	ZINC000872306453	EE	On-Demand	Anodyne	TRPC3	41	34
CN1CCN(C(=O)c2ccnc(Cl)c2F)Cc2cccnc21	ZINC000872306459	DE	On-Demand	Anodyne	P2RX7	48	41
O=C1CCCc2cc(C(=O)N3CC[C@@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)ccc2N1	ZINC000872306480	GC	On-Demand	Anodyne	L3MBTL3	42	35
O=C1CCCc2cc(C(=O)N3CC[C@H](N4C(=O)O[C@H]5CNC[C@H]54)C3)ccc2N1	ZINC000872306481	GC	On-Demand	Anodyne	L3MBTL3	42	35
COC(=O)C1CCC(C(=O)N2CCN(C)c3ncccc3C2)CC1	ZINC000872306554	ED	On-Demand	Anodyne	PTR1	43	31
CC(=O)CCCCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872306559	DF	On-Demand	Anodyne	HTR7	15	41
CC(=O)CCCCCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872306559	DF	On-Demand	Anodyne	PAOX	17	40
CN1CCN(C(=O)Cc2cccc(OCC#N)c2)Cc2cccnc21	ZINC000872306567	EE	On-Demand	Mild	BRS3	26	44
CN1CCN(C(=O)c2cncc(N3CCOCC3)c2)Cc2cccnc21	ZINC000872306636	FD	On-Demand	Anodyne	SCN10A	15	42
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306641	GC	On-Demand	Anodyne	PREP	18	43
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306642	GC	On-Demand	Anodyne	PREP	18	43
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306643	GC	On-Demand	Anodyne	PREP	18	43
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306644	GC	On-Demand	Anodyne	PREP	18	43
O=C(c1ccc2n[nH]cc2c1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306645	EC	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1ccc2n[nH]cc2c1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306646	EC	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1ccc2c(c1)Cc1ccccc1-2)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306665	GE	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1ccc2c(c1)Cc1ccccc1-2)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872306666	GE	On-Demand	Anodyne	L3MBTL3	42	35
CN1CCN(C(=O)c2ccc(F)cc2O)Cc2cccnc21	ZINC000872306688	DE	On-Demand	Anodyne	P2RX7	29	49
CN1CCN(C(=O)c2ccc3nc(O)n(C)c3c2)Cc2cccnc21	ZINC000872306696	ED	On-Demand	Anodyne	HPGD	43	33
Cc1cc(F)ccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306708	CF	On-Demand	Anodyne	P2RX7	33	50
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000872306718	CD	On-Demand	Anodyne	CACNA1I	48	36
CN1CCN(C(=O)c2ccc3c(c2)ncn3C)Cc2cccnc21	ZINC000872306725	DE	On-Demand	Anodyne	HPGD	56	44
CCCOc1cccc(CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872306752	EF	On-Demand	Anodyne	BRS3	27	53
CN1CCN(C(=O)c2ccc(F)c(Cl)c2)Cc2cccnc21	ZINC000872306754	DF	On-Demand	Anodyne	P2RX7	26	48
C[C@@H](Cc1ccccc1Cl)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306770	EG	On-Demand	Anodyne	MC4R	51	49
C[C@H](Cc1ccccc1Cl)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306771	EG	On-Demand	Anodyne	MC4R	51	49
C=C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872306772	DG	On-Demand	Mild	PTAFR	32	41
C=C[C@H](CC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872306773	DG	On-Demand	Mild	PTAFR	32	41
CNc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872306774	DD	On-Demand	Anodyne	TRPC6	63	48
CNc1nc(C(=O)N2CCN(C)c3ncccc3C2)cs1	ZINC000872306774	DD	On-Demand	Anodyne	TRPC3	55	43
COCCOc1cc(C(=O)N2CCN(C)c3ncccc3C2)nc2ccccc12	ZINC000872306800	GF	On-Demand	Anodyne	PDGFRB	31	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cccc(S(=O)(=O)c3ccccc3)c2)C1	ZINC000872306810	FF	On-Demand	Anodyne	SFRP1	62	32
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306844	EG	On-Demand	Anodyne	MC4R	62	45
C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306844	EG	On-Demand	Anodyne	TRY2_BOVIN	55	34
CN1CCN(C(=O)c2ccc(C(=O)NC3CC3)cc2)Cc2cccnc21	ZINC000872306847	FE	On-Demand	Anodyne	MAPK11	30	41
CN1CCN(C(=O)c2ccc(C(=O)NC3CC3)cc2)Cc2cccnc21	ZINC000872306847	FE	On-Demand	Anodyne	MAPK14	43	41
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872306848	FF	On-Demand	Anodyne	P2RX7	27	42
CN1CCN(C(=O)c2cc3occc3[nH]2)Cc2cccnc21	ZINC000872306866	CE	On-Demand	Anodyne	HRH4	28	42
CCC[C@@H](NC(N)=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872306882	DC	On-Demand	Anodyne	P2RY12	123	34
COc1ccc(Nc2cccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)c2)cc1	ZINC000872306916	EH	On-Demand	Anodyne	MTNR1B	15	45
COc1ccc(Nc2cccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)c2)cc1	ZINC000872306916	EH	On-Demand	Anodyne	EPHX2	26	43
COc1ccc(Nc2cccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)c2)cc1	ZINC000872306916	EH	On-Demand	Anodyne	AKR1C3	25	49
CN1CCN(C(=O)c2ncccc2C(F)(F)F)Cc2cccnc21	ZINC000872306921	EF	On-Demand	Anodyne	TRPV1	27	45
C[C@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872306956	CF	On-Demand	Anodyne	PTAFR	30	47
C[C@@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872306957	CF	On-Demand	Anodyne	PTAFR	30	47
CC(C)n1nnnc1-c1cccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872306968	EF	On-Demand	Anodyne	CCR3	48	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)C1	ZINC000872307006	DE	On-Demand	Anodyne	EPHX2	15	49
COC(=O)[C@@H](Cc1cccc(OC)c1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307015	ED	On-Demand	Anodyne	TIMP3	72	35
COC(=O)[C@H](Cc1cccc(OC)c1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307016	ED	On-Demand	Anodyne	TIMP3	72	35
CN1CCN(C(=O)c2cccc(Cl)c2O)Cc2cccnc21	ZINC000872307026	DF	On-Demand	Anodyne	P2RX7	51	42
CN1CCN(C(=O)c2cccc(Cl)c2O)Cc2cccnc21	ZINC000872307026	DF	On-Demand	Anodyne	G2YM83_BOTF4	45	33
CN1CCN(C(=O)c2cc(S(C)(=O)=O)ccc2F)Cc2cccnc21	ZINC000872307027	FD	On-Demand	Anodyne	SLC6A9	48	44
CN1CCN(C(=O)c2cc(Cl)nc(C(F)(F)F)c2)Cc2cccnc21	ZINC000872307077	FG	On-Demand	Anodyne	P2RX7	28	40
CN1CCN(C(=O)c2ccc3nsnc3c2)Cc2cccnc21	ZINC000872307178	EE	On-Demand	Anodyne	HPGD	43	33
CN1CCN(C(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307180	GE	On-Demand	Anodyne	PGC	50	33
CN1CCN(C(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307180	GE	On-Demand	Anodyne	REN	43	38
CN1CCN(C(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307180	GE	On-Demand	Anodyne	POLG_HCV1	23	40
CN1CCN(C(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307181	GE	On-Demand	Anodyne	PGC	50	33
CN1CCN(C(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307181	GE	On-Demand	Anodyne	REN	43	38
CN1CCN(C(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872307181	GE	On-Demand	Anodyne	POLG_HCV1	23	40
CN1CCN(C(=O)c2ccc(O)cc2F)Cc2cccnc21	ZINC000872307202	DE	On-Demand	Anodyne	P2RX7	20	41
COc1ccnc(NC(=O)[C@@H]2CCCCC[C@@H]2N)c1	ZINC000872307220	CD	On-Demand	Anodyne	TYK2	64	45
CN1CCN(C(=O)c2ccc3nnn(C)c3c2)Cc2cccnc21	ZINC000872307227	DD	On-Demand	Anodyne	HPGD	43	34
CN1CCN(C(=O)c2csc(Cl)n2)Cc2cccnc21	ZINC000872307229	DE	On-Demand	Anodyne	TRPC6	45	40
C[C@@H](CCCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307236	EH	On-Demand	Anodyne	GHRHR	44	39
C[C@@H](CCCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307236	EH	On-Demand	Anodyne	FAAH	66	37
C[C@@H](CCCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307236	EH	On-Demand	Anodyne	CES1	57	36
C[C@@H](CCCc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307236	EH	On-Demand	Anodyne	CES1D	53	31
CCNS(=O)(=O)c1ccc(CC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307263	GD	On-Demand	Anodyne	NAMPT	20	40
COc1cccc(Nc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)c1	ZINC000872307270	EH	On-Demand	Anodyne	MTNR1A	16	56
COc1cccc(Nc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)c1	ZINC000872307270	EH	On-Demand	Anodyne	MTNR1B	23	56
COc1cccc(Nc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)c1	ZINC000872307270	EH	On-Demand	Anodyne	EPHX2	27	48
COc1cccc(Nc2ccc(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)cc2)c1	ZINC000872307270	EH	On-Demand	Anodyne	AKR1C3	25	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H](c2ccccn2)C2CCC2)C1	ZINC000872307278	CE	On-Demand	Anodyne	TTK	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@H](c2ccccn2)C2CCC2)C1	ZINC000872307279	CE	On-Demand	Anodyne	TTK	20	40
C=CC(=O)NCCC(=O)N1CCN(C)c2ncccc2C1	ZINC000872307282	CC	On-Demand	Anodyne	TGM2	27	40
CN1CCN(C(=O)c2cccnc2I)Cc2cccnc21	ZINC000872307283	GE	On-Demand	Anodyne	P2RX7	23	41
COc1cccc([C@H](CNC(=O)[C@@H]2CCCCC[C@@H]2N)OC)c1	ZINC000872307284	DE	On-Demand	Anodyne	MTNR1A	35	46
COc1cccc([C@H](CNC(=O)[C@@H]2CCCCC[C@@H]2N)OC)c1	ZINC000872307284	DE	On-Demand	Anodyne	MTNR1B	36	46
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)nc1Cl	ZINC000872307316	EE	On-Demand	Anodyne	RBP4	18	40
CN1CCN(C(=O)Cc2cccc(OCc3cccnc3)c2)Cc2cccnc21	ZINC000872307380	GG	On-Demand	Anodyne	BRS3	26	47
O=C(c1ccc(F)c(F)c1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872307386	EC	On-Demand	Anodyne	L3MBTL3	57	37
O=C(c1ccc(F)c(F)c1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872307387	EC	On-Demand	Anodyne	L3MBTL3	57	37
CC[C@@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307398	CF	On-Demand	Anodyne	ACE	40	36
CC[C@@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307398	CF	On-Demand	Anodyne	GHRHR	41	31
CC[C@@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307398	CF	On-Demand	Anodyne	CTSC	20	41
CC[C@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307399	CF	On-Demand	Anodyne	ACE	40	36
CC[C@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307399	CF	On-Demand	Anodyne	GHRHR	41	31
CC[C@H](CCc1ccccc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872307399	CF	On-Demand	Anodyne	CTSC	20	41
Cc1ccc(C[C@@H](C)C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307401	DG	On-Demand	Anodyne	AKT1	16	42
CN1CCN(C(=O)c2ccc(F)c(Cl)c2F)Cc2cccnc21	ZINC000872307436	EG	On-Demand	Anodyne	P2RX7	56	46
CN1CCN(C(=O)c2ccc(Cl)c(F)c2)Cc2cccnc21	ZINC000872307450	DF	On-Demand	Anodyne	P2RX7	24	40
CC(C)n1nnnc1-c1cccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c1	ZINC000872307485	ED	On-Demand	Anodyne	CCR3	65	39
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCC(Oc3cccc(F)c3)CC2)C1	ZINC000872307494	DE	On-Demand	Anodyne	EPHX2	17	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	FKBP1A	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	SIGMAR1	22	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	FAAH	44	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	CES1	42	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	SPHK1	18	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCCCCCc2ccccc2)C1	ZINC000872307498	DG	On-Demand	Anodyne	AMP1_PLAFQ	20	40
CC[C@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872307499	EG	On-Demand	Anodyne	DPP8	15	40
CC[C@@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872307500	EG	On-Demand	Anodyne	DPP8	15	40
COc1cccc([C@H](CNC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)OC)c1	ZINC000872307515	DD	On-Demand	Anodyne	DRD4	41	31
Cc1cc(OCC(=O)N2CCN(C)c3ncccc3C2)ccc1[N+](=O)[O-]	ZINC000872307573	FE	On-Demand	Bother	HTR1B	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000872307578	EG	On-Demand	Anodyne	CCR2	22	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCc2ccccc2OCc2ccccc2)C1	ZINC000872307589	FG	On-Demand	Anodyne	PTGER1	29	47
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccnc(-c2ccccc2)c1	ZINC000872307617	DG	On-Demand	Anodyne	TMPRSS11D	43	33
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccccc1CC(F)(F)F	ZINC000872307625	EG	On-Demand	Anodyne	LNPEP	43	38
CC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307630	DD	On-Demand	Anodyne	MC4R	22	41
CC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307630	DD	On-Demand	Anodyne	HPN	40	34
CN1CCN(C(=O)c2cc(C(F)(F)F)cc(Cl)n2)Cc2cccnc21	ZINC000872307632	FG	On-Demand	Anodyne	TRPV1	23	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccnc(-c3ccccc3)c2)C1	ZINC000872307633	DE	On-Demand	Anodyne	NOS2	66	33
CN(CCC(=O)N1CCN(C)c2ncccc2C1)c1ccncc1	ZINC000872307637	ED	On-Demand	Anodyne	SSTR1	33	40
CSc1c(F)cccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872307656	EG	On-Demand	Anodyne	P2RX7	30	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000872307660	CF	On-Demand	Anodyne	EPHX2	20	40
CN1CCN(C(=O)c2ccc(O[C@@H]3CCOC3)cc2)Cc2cccnc21	ZINC000872307676	FE	On-Demand	Anodyne	CPT2	15	40
CN1CCN(C(=O)c2ccc(O[C@H]3CCOC3)cc2)Cc2cccnc21	ZINC000872307677	FE	On-Demand	Anodyne	CPT2	15	40
CN1CCN(C(=O)[C@H]2CC[C@H](C(F)(F)F)C2)Cc2cccnc21	ZINC000872307679	EF	On-Demand	Anodyne	SSTR1	24	40
CN1CCN(C(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)Cc2cccnc21	ZINC000872307680	EF	On-Demand	Anodyne	SSTR1	24	40
CN1CCN(C(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)Cc2cccnc21	ZINC000872307681	EF	On-Demand	Anodyne	SSTR1	24	40
CN1CCN(C(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)Cc2cccnc21	ZINC000872307682	EF	On-Demand	Anodyne	SSTR1	24	40
COc1ccccc1-n1ncc(C(=O)N2CCN(C)c3ncccc3C2)c1C	ZINC000872307693	GF	On-Demand	Anodyne	HTR1A	24	40
COc1ccccc1-n1ncc(C(=O)N2CCN(C)c3ncccc3C2)c1C	ZINC000872307693	GF	On-Demand	Anodyne	ADRA1D	16	41
CCCOc1ccc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)cc1F	ZINC000872307755	CF	On-Demand	Anodyne	MET	40	36
Cc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1C#N	ZINC000872307762	DE	On-Demand	Mild	DDR1	44	33
N#CCc1cccc2c1CCN(C(=O)[C@H]1CCCCC[C@H]1N)C2	ZINC000872307801	DF	On-Demand	Mild	CTSK	15	50
CN1CCN(C(=O)c2ccc(NCC3CC3)nc2)Cc2cccnc21	ZINC000872307814	EE	On-Demand	Anodyne	BDKRB1	17	40
CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1OC	ZINC000872307901	DG	On-Demand	Anodyne	QRFPR	41	34
CCCOc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2N)cc1OC	ZINC000872307901	DG	On-Demand	Anodyne	ENPP1	69	33
COc1ccc(C(=O)N2CCC[C@H]2C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307917	GE	On-Demand	Anodyne	CPT2	45	43
COc1ccc(C(=O)N2CCC[C@H]2C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307917	GE	On-Demand	Anodyne	PREP	76	47
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307918	GE	On-Demand	Anodyne	CPT2	45	43
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872307918	GE	On-Demand	Anodyne	PREP	76	47
CN1CCN(C(=O)c2ccoc2Cl)Cc2cccnc21	ZINC000872308151	CE	On-Demand	Anodyne	P2RX7	29	41
CN1CCN(C(=O)[C@H]2CCCCN2C2CCCC2)Cc2cccnc21	ZINC000872308167	EF	On-Demand	Anodyne	CPT2	41	36
CN1CCN(C(=O)[C@@H]2CCCCN2C2CCCC2)Cc2cccnc21	ZINC000872308168	EF	On-Demand	Anodyne	CPT2	41	36
CN1CCN(C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872308221	ED	On-Demand	Anodyne	PREP	27	45
CN1CCN(C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872308221	ED	On-Demand	Anodyne	GPR119	33	41
CN1CCN(C(=O)[C@H]2CCCN2c2ccccc2)Cc2cccnc21	ZINC000872308322	EF	On-Demand	Anodyne	CPT2	42	36
CN1CCN(C(=O)[C@H]2CCCN2c2ccccc2)Cc2cccnc21	ZINC000872308322	EF	On-Demand	Anodyne	PREP	74	39
CN1CCN(C(=O)[C@@H]2CCCN2c2ccccc2)Cc2cccnc21	ZINC000872308323	EF	On-Demand	Anodyne	CPT2	42	36
CN1CCN(C(=O)[C@@H]2CCCN2c2ccccc2)Cc2cccnc21	ZINC000872308323	EF	On-Demand	Anodyne	PREP	74	39
O=C(c1c(Cl)cccc1Cl)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308342	FE	On-Demand	Anodyne	L3MBTL3	50	36
O=C(c1c(Cl)cccc1Cl)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308344	FE	On-Demand	Anodyne	L3MBTL3	50	36
CN1CCN(C(=O)c2cccnc2F)Cc2cccnc21	ZINC000872308347	CD	On-Demand	Anodyne	P2RX7	38	41
COc1ccc2[nH]c(C(=O)N3CCN(C)c4ncccc4C3)cc2c1	ZINC000872308348	EF	On-Demand	Anodyne	HRH4	35	65
COc1ccc2[nH]c(C(=O)N3CCN(C)c4ncccc4C3)cc2c1	ZINC000872308348	EF	On-Demand	Anodyne	TUBB2B	44	45
COc1ccc2[nH]c(C(=O)N3CCN(C)c4ncccc4C3)cc2c1	ZINC000872308348	EF	On-Demand	Anodyne	FPR2	24	47
CN1CCN(C(=O)c2ccncc2C(F)(F)F)Cc2cccnc21	ZINC000872308379	EF	On-Demand	Anodyne	P2RX7	40	41
CN1CCN(C(=O)c2ccncc2C(F)(F)F)Cc2cccnc21	ZINC000872308379	EF	On-Demand	Anodyne	RBP4	21	41
CN1CCN(C(=O)c2csc(O)n2)Cc2cccnc21	ZINC000872308392	CD	On-Demand	Anodyne	TRPC6	44	41
CN1CCN(C(=O)c2ccc3c(c2)nc(C(F)F)n3C)Cc2cccnc21	ZINC000872308406	FF	On-Demand	Anodyne	HPGD	48	37
Cc1nc2ccc(C(=O)N3CCN(C)c4ncccc4C3)cc2n1C	ZINC000872308430	EE	On-Demand	Anodyne	HPGD	44	34
CNc1ccc(Cl)c(C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872308446	EF	On-Demand	Anodyne	P2RX7	29	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3ccc(C(F)(F)F)cc3C2)C1	ZINC000872308509	DF	On-Demand	Anodyne	CCR2	35	49
N[C@H]1CCCCC[C@H]1C(=O)NCC[C@H](N)Cc1ccccc1	ZINC000872308524	DD	On-Demand	Anodyne	ANPEP	44	31
N[C@H]1CCCCC[C@H]1C(=O)NCC[C@H](N)Cc1ccccc1	ZINC000872308524	DD	On-Demand	Anodyne	NPFFR2	67	34
N[C@H]1CCCCC[C@H]1C(=O)NCC[C@H](N)Cc1ccccc1	ZINC000872308524	DD	On-Demand	Anodyne	LAP3	60	40
N[C@H]1CCCCC[C@H]1C(=O)NCC[C@H](N)Cc1ccccc1	ZINC000872308524	DD	On-Demand	Anodyne	NPFFR1	65	34
N[C@H](CCNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872308525	DD	On-Demand	Anodyne	ANPEP	44	31
N[C@H](CCNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872308525	DD	On-Demand	Anodyne	NPFFR2	67	34
N[C@H](CCNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872308525	DD	On-Demand	Anodyne	LAP3	60	40
N[C@H](CCNC(=O)[C@@H]1CCCCC[C@@H]1N)Cc1ccccc1	ZINC000872308525	DD	On-Demand	Anodyne	NPFFR1	65	34
CN(CC(=O)N1CCN(C)c2ncccc2C1)C(=O)OCc1ccccc1	ZINC000872308534	FE	On-Demand	Anodyne	SLC12A5	46	33
CN1CCN(C(=O)c2cc(Br)ncc2Cl)Cc2cccnc21	ZINC000872308544	GF	On-Demand	Anodyne	P2RX7	32	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000872308576	FD	On-Demand	Anodyne	F10	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000872308577	FD	On-Demand	Anodyne	F10	20	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC[C@@]2(Cc3ccccc3)C=CCCC2)C1	ZINC000872308596	DG	On-Demand	Anodyne	SLC12A5	44	30
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC[C@]2(Cc3ccccc3)C=CCCC2)C1	ZINC000872308597	DG	On-Demand	Anodyne	SLC12A5	44	30
COc1cccc(C[C@H](O)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872308624	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C[C@@H](O)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872308625	ED	On-Demand	Anodyne	DRD4	41	32
CN1CCN(C(=O)c2cccc3c2CC(=O)CC3)Cc2cccnc21	ZINC000872308668	EE	On-Demand	Anodyne	P2RX7	20	43
CN1CCN(C(=O)c2ccc(C(C)(F)F)cc2)Cc2cccnc21	ZINC000872308676	EG	On-Demand	Anodyne	TRPV1	25	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H]2Cc3ccccc3NC2=O)C1	ZINC000872308684	CC	On-Demand	Anodyne	PYGM	28	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@H]2Cc3ccccc3NC2=O)C1	ZINC000872308685	CC	On-Demand	Anodyne	PYGM	28	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3cc(C(F)(F)F)ccc3C2)C1	ZINC000872308752	DF	On-Demand	Anodyne	CCR2	34	46
COCCOc1cc(OC)ccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872308779	FE	On-Demand	Anodyne	DRD4	40	31
CN1CCN(C(=O)c2cc(F)ccc2Cl)Cc2cccnc21	ZINC000872308830	DF	On-Demand	Anodyne	P2RX7	57	54
C[C@@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc2c(c1)OCO2	ZINC000872308845	EE	On-Demand	Anodyne	NOS2	48	32
C[C@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc2c(c1)OCO2	ZINC000872308846	EE	On-Demand	Anodyne	NOS2	48	32
CN1CCN(C(=O)c2ccnc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872308879	FD	On-Demand	Anodyne	GSK3B	15	47
CN1CCN(C(=O)c2ccnc(NC(=O)C3CC3)c2)Cc2cccnc21	ZINC000872308879	FD	On-Demand	Anodyne	TYK2	58	40
CCOc1ccccc1OCC(=O)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308900	GC	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1OCC(=O)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308900	GC	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1OCC(=O)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308902	GC	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1OCC(=O)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308902	GC	On-Demand	Anodyne	HCN4	41	33
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308934	FD	On-Demand	Anodyne	CPT2	42	37
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308934	FD	On-Demand	Anodyne	PREP	74	38
CN1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308934	FD	On-Demand	Anodyne	WNT3	45	35
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308935	FD	On-Demand	Anodyne	CPT2	42	37
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308935	FD	On-Demand	Anodyne	PREP	74	38
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)Cc2cccnc21	ZINC000872308935	FD	On-Demand	Anodyne	WNT3	45	35
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3c(cccc3C(F)(F)F)C2)C1	ZINC000872308952	DF	On-Demand	Anodyne	RBP4	47	34
O=C(Cc1cccs1)N1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308954	DC	On-Demand	Anodyne	ETHR	33	43
O=C(Cc1cccs1)N1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1	ZINC000872308955	DC	On-Demand	Anodyne	ETHR	33	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@H]2CCCc3c2[nH]c2ccc(Cl)cc32)C1	ZINC000872308986	EG	On-Demand	Anodyne	SIRT1	17	52
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N[C@@H]2CCCc3c2[nH]c2ccc(Cl)cc32)C1	ZINC000872308987	EG	On-Demand	Anodyne	SIRT1	17	52
N[C@@H]1C[C@H]1c1ccc(NC(=O)[C@]23CCC[C@H]2CNC3)cc1	ZINC000872309043	CD	On-Demand	Anodyne	KDM1A	31	44
N#Cc1ccccc1N1CCC(NC(=O)[C@H]2CCCCC[C@H]2N)CC1	ZINC000872309044	EF	On-Demand	Mild	EPHX2	15	42
CCC(=O)Nc1ccccc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872309083	EF	On-Demand	Anodyne	G2YM83_BOTF4	54	35
CC(=O)Nc1cccc(C(=O)N2CCN(C)c3ncccc3C2)c1C	ZINC000872309103	EE	On-Demand	Anodyne	G2YM83_BOTF4	62	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2c3ccccc3C[C@H]2Cc2ccccc2)C1	ZINC000872309110	EG	On-Demand	Anodyne	TPP2	43	32
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2c3ccccc3C[C@@H]2Cc2ccccc2)C1	ZINC000872309111	EG	On-Demand	Anodyne	TPP2	43	32
CN1CCN(C(=O)c2cc(O)ccc2Cl)Cc2cccnc21	ZINC000872309120	DF	On-Demand	Anodyne	P2RX7	41	37
C[C@H](C(=O)N1CCN(C)c2ncccc2C1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872309151	FE	On-Demand	Anodyne	GPR119	30	40
C[C@@H](C(=O)N1CCN(C)c2ncccc2C1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000872309152	FE	On-Demand	Anodyne	GPR119	30	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CCc3cccc(C(F)(F)F)c3C2)C1	ZINC000872309168	DF	On-Demand	Anodyne	RBP4	48	33
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872309272	FD	On-Demand	Anodyne	PGC	50	33
NC1(CC(=O)N[C@]23CCC[C@H]2OCC3)CCN(Cc2ccccc2)CC1	ZINC000872309307	FE	On-Demand	Anodyne	SIGMAR1	54	41
NC1(CC(=O)N[C@]23CCC[C@H]2OCC3)CCN(Cc2ccccc2)CC1	ZINC000872309307	FE	On-Demand	Anodyne	NPFFR1	43	38
N[C@H]1C[C@@H]2C[C@]2(C(=O)NCC[C@H](N)Cc2ccccc2)C1	ZINC000872309319	CD	On-Demand	Anodyne	NPFFR1	62	39
N[C@H](CCNC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)Cc1ccccc1	ZINC000872309320	CD	On-Demand	Anodyne	NPFFR1	62	39
N[C@@H]1C[C@H]1c1ccc(NC(=O)[C@]23CCC[C@H]2OCC3)cc1	ZINC000872309333	CE	On-Demand	Anodyne	KDM1A	31	44
CN1CCN(C(=O)c2cccc(O)c2O)Cc2cccnc21	ZINC000872309357	CD	On-Demand	Clean	P2RX7	32	43
CN1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)Cc2cccnc21	ZINC000872309397	FG	On-Demand	Mild	CNR1	16	43
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872309411	FF	On-Demand	Anodyne	SSTR1	42	36
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872309415	FF	On-Demand	Anodyne	SSTR1	42	36
Cc1oc(-c2ccccc2)nc1CN[C@]12CCC[C@H]1OCC2	ZINC000872309476	CG	On-Demand	Anodyne	PPARG	47	38
Cc1oc(-c2ccccc2)nc1CN[C@]12CCC[C@H]1OCC2	ZINC000872309476	CG	On-Demand	Anodyne	PPARA	50	39
Cc1oc(-c2ccccc2)nc1CN[C@]12CCC[C@H]1OCC2	ZINC000872309476	CG	On-Demand	Anodyne	PDE8B	65	40
CN1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)Cc2cccnc21	ZINC000872309486	DD	On-Demand	Anodyne	HTR3A	16	48
CN1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)Cc2cccnc21	ZINC000872309487	DD	On-Demand	Anodyne	HTR3A	16	48
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1nc(COc2ccccc2)cs1	ZINC000872309496	EH	On-Demand	Anodyne	CPT1A	38	40
C[C@@H]1Cc2cccc(C(=O)N3CCN(C)c4ncccc4C3)c2O1	ZINC000872309499	DE	On-Demand	Anodyne	G2YM83_BOTF4	40	35
C[C@H]1Cc2cccc(C(=O)N3CCN(C)c4ncccc4C3)c2O1	ZINC000872309500	DE	On-Demand	Anodyne	G2YM83_BOTF4	40	35
N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(F)c1F	ZINC000872309506	CE	On-Demand	Anodyne	P2RX7	50	39
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1OCCO	ZINC000872309507	FD	On-Demand	Anodyne	PDGFRB	51	34
CN1CCN(C(=O)c2cnn(C)c2Cl)Cc2cccnc21	ZINC000872309510	DD	On-Demand	Anodyne	P2RX7	38	40
CC(=O)Nc1ccccc1C(F)(F)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872309530	FF	On-Demand	Anodyne	TRPV1	15	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccnc(N3CCSCC3)c2)C1	ZINC000872309531	ED	On-Demand	Anodyne	NOS2	62	33
CN1CCN(C(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)Cc2cccnc21	ZINC000872309644	FD	On-Demand	Anodyne	GPR119	36	43
CN1CCN(C(=O)c2ccc(C(F)(F)F)s2)Cc2cccnc21	ZINC000872309734	EG	On-Demand	Anodyne	TRPV1	15	41
N#Cc1ccc(Cn2cc(NC(=O)[C@H]3CCCCC[C@H]3N)cn2)cc1	ZINC000872309759	EF	On-Demand	Mild	ITK	27	50
N#Cc1ccc(Cn2cc(NC(=O)[C@H]3CCCCC[C@H]3N)cn2)cc1	ZINC000872309759	EF	On-Demand	Mild	PANC	53	36
Cc1cc(C(F)(F)F)nn1CC(=O)N1CCN(C)c2ncccc2C1	ZINC000872309792	FE	On-Demand	Anodyne	CCR1	18	49
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2cccnc2Oc2cccc(C(F)(F)F)c2)C1	ZINC000872309805	GH	On-Demand	Anodyne	P2RY1	19	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(N3CCNCC3)ccn2)C1	ZINC000872309818	DC	On-Demand	Anodyne	PRKD1	53	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(N3CCNCC3)ccn2)C1	ZINC000872309818	DC	On-Demand	Anodyne	MAPKAPK2	40	31
N[C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(N3CCNCC3)ccn2)C1	ZINC000872309818	DC	On-Demand	Anodyne	KARS	45	34
CC(=O)c1ccc(N2CCN(C(=O)CN[C@]34CCC[C@H]3OCC4)CC2)c(F)c1	ZINC000872309830	GD	On-Demand	Anodyne	NPY2R	42	33
CC(=O)c1ccc(N2CCN(C(=O)CN[C@]34CCC[C@H]3OCC4)CC2)c(F)c1	ZINC000872309830	GD	On-Demand	Anodyne	SLC6A9	18	45
CN1CCN(C(=O)c2cc(Cl)cc(F)c2N)Cc2cccnc21	ZINC000872309844	EF	On-Demand	Anodyne	P2RX7	42	39
N#Cc1ccc(Cn2cc(NC(=O)[C@]34C[C@H](N)C[C@H]3C4)cn2)cc1	ZINC000872309865	DD	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)[C@]34C[C@H](N)C[C@H]3C4)cn2)cc1	ZINC000872309865	DD	On-Demand	Mild	PANC	53	37
N[C@@H]1CCCCC[C@@H]1C(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000872309879	DG	On-Demand	Anodyne	CCR5	34	46
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cc(N2CCNCC2)ccn1	ZINC000872309886	DD	On-Demand	Anodyne	PRKD1	73	44
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cc(N2CCNCC2)ccn1	ZINC000872309886	DD	On-Demand	Anodyne	TYK2	58	34
N[C@@H]1CCCCC[C@@H]1C(=O)Nc1cc(N2CCNCC2)ccn1	ZINC000872309886	DD	On-Demand	Anodyne	KARS	47	38
CN1CCN(C(=O)[C@H](C#N)CCc2ccccc2)Cc2cccnc21	ZINC000872309897	EF	On-Demand	Mild	PTAFR	36	40
CN1CCN(C(=O)[C@@H](C#N)CCc2ccccc2)Cc2cccnc21	ZINC000872309898	EF	On-Demand	Mild	PTAFR	36	40
CN1CCN(C(=O)[C@H]2CCN(c3ccccc3F)C2)Cc2cccnc21	ZINC000872309957	FF	On-Demand	Anodyne	SSTR1	29	41
CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3F)C2)Cc2cccnc21	ZINC000872309958	FF	On-Demand	Anodyne	SSTR1	29	41
N[C@H]1C[C@@H]2C[C@]2(C(=O)Nc2ccc([C@@H]3C[C@H]3N)cc2)C1	ZINC000872309973	CD	On-Demand	Anodyne	KDM1A	35	50
N[C@H]1CCCCC[C@H]1C(=O)Nc1ccc([C@@H]2C[C@H]2N)cc1	ZINC000872309981	CE	On-Demand	Anodyne	KDM1A	38	53
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872310005	EF	On-Demand	Anodyne	UGCG	21	42
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	SIGMAR1	25	40
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	CCR3	29	42
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	UTS2R	23	42
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	CCR2	15	46
Cc1ccc(CN2CC[C@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310019	DD	On-Demand	Anodyne	MCHR1	33	46
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	SIGMAR1	25	40
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	CCR3	29	42
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	UTS2R	23	42
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	CCR2	15	46
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1	ZINC000872310020	DD	On-Demand	Anodyne	MCHR1	33	46
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	DRD2	23	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	DRD4	46	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	ACHE	67	60
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	SLC6A3	17	48
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	SIGMAR1	75	47
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	BCHE	20	49
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	CCR3	40	41
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	NPFFR2	40	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	CACNA1G	37	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	CACNA1I	41	37
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	CYP2J2	43	31
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000872310021	EF	On-Demand	Anodyne	NPFFR1	53	42
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCc2ccccc2C1	ZINC000872310029	DD	On-Demand	Anodyne	DPP8	21	46
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310045	ED	On-Demand	Anodyne	MME	49	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310045	ED	On-Demand	Anodyne	TIMP3	79	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310045	ED	On-Demand	Anodyne	ACE2	45	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310045	ED	On-Demand	Anodyne	QRFPR	41	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310045	ED	On-Demand	Anodyne	BRCA1	43	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310046	ED	On-Demand	Anodyne	MME	49	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310046	ED	On-Demand	Anodyne	TIMP3	79	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310046	ED	On-Demand	Anodyne	ACE2	45	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310046	ED	On-Demand	Anodyne	QRFPR	41	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310046	ED	On-Demand	Anodyne	BRCA1	43	30
CCOc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310054	DE	On-Demand	Anodyne	ADRB1	29	40
CCOc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310055	DE	On-Demand	Anodyne	ADRB1	29	40
CN1CCN(C(=O)c2cn(C)c3ccc(F)cc23)Cc2cccnc21	ZINC000872310068	EF	On-Demand	Anodyne	P2RX7	20	42
COc1ccc(C(=O)N2CCN(C)c3ncccc3C2)cc1Cl	ZINC000872310122	EF	On-Demand	Anodyne	RBP4	16	40
O=C(CN[C@]12CCC[C@H]1OCC2)NC1C2CC3CC(C2)CC1C3	ZINC000872310124	DE	On-Demand	Anodyne	HSD11B1	43	34
COC(=O)c1ccc(CC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872310131	ED	On-Demand	Anodyne	KCNJ1	40	31
CN1CCN(C(=O)c2cc3c([nH]2)CCCC3)Cc2cccnc21	ZINC000872310143	DE	On-Demand	Anodyne	HRH4	26	60
O=C(CN[C@]12CCC[C@H]1OCC2)NCC1(N2CCOCC2)CCCCC1	ZINC000872310148	FD	On-Demand	Anodyne	HCN1	40	31
O=C(CN[C@]12CCC[C@H]1OCC2)NCC1(N2CCOCC2)CCCCC1	ZINC000872310148	FD	On-Demand	Anodyne	HCN4	40	31
N#Cc1ccc(Cn2cc(NC(=O)[C@]34CCC[C@H]3CNC4)cn2)cc1	ZINC000872310156	EE	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)[C@]34CCC[C@H]3CNC4)cn2)cc1	ZINC000872310156	EE	On-Demand	Mild	PANC	53	37
N#Cc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310162	DD	On-Demand	Mild	ADRB1	26	40
N#Cc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310163	DD	On-Demand	Mild	ADRB1	26	40
COc1ccc(N2CCN(C(=O)CN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872310166	FD	On-Demand	Clean	MMP13	16	40
COc1ccc(N2CCN(C(=O)CN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872310166	FD	On-Demand	Clean	NPBWR1	44	31
CN1CCN(C(=O)c2cn(C)nc2Cl)Cc2cccnc21	ZINC000872310227	DD	On-Demand	Anodyne	P2RX7	27	40
CCOC(=O)C1=C(CN[C@]23CCC[C@H]2OCC3)NC(=O)N[C@@H]1c1ccccc1	ZINC000872310271	GE	On-Demand	Anodyne	SLC27A4	74	34
CCOC(=O)C1=C(CN[C@]23CCC[C@H]2OCC3)NC(=O)N[C@H]1c1ccccc1	ZINC000872310272	GE	On-Demand	Anodyne	SLC27A4	74	34
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	CHRM3	15	48
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	SIGMAR1	22	47
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	CCR3	30	47
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	MCHR1	34	44
Cc1ccc(CN2CC[C@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310286	EF	On-Demand	Anodyne	BIRC2	36	43
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	CHRM3	15	48
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	SIGMAR1	22	47
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	CCR3	30	47
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	MCHR1	34	44
Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H]3CCCCC[C@@H]3N)C2)cc1	ZINC000872310287	EF	On-Demand	Anodyne	BIRC2	36	43
CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)Cc2cccnc21	ZINC000872310297	EE	On-Demand	Anodyne	SSTR1	53	39
CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)Cc2cccnc21	ZINC000872310298	EE	On-Demand	Anodyne	SSTR1	53	39
O=S(=O)(CCN[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1	ZINC000872310299	EE	On-Demand	Anodyne	PSEN2	51	32
O=S(=O)(CCN[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1	ZINC000872310299	EE	On-Demand	Anodyne	PSEN1	41	32
COC(=O)c1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310337	ED	On-Demand	Anodyne	ADRB2	21	43
COC(=O)c1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310337	ED	On-Demand	Anodyne	ADRB1	39	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310338	ED	On-Demand	Anodyne	ADRB2	21	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310338	ED	On-Demand	Anodyne	ADRB1	39	40
c1csc(-c2noc(CN[C@]34CCC[C@H]3OCC4)n2)c1	ZINC000872310349	CF	On-Demand	Anodyne	ETHR	29	40
CN1CCN(C2CCN(C(=O)[C@]34CCC[C@H]3CNC4)CC2)CC1	ZINC000872310434	DC	On-Demand	Anodyne	L3MBTL3	40	39
CN1CCN(C(=O)[C@H]2CCCN(CC(F)F)C2)Cc2cccnc21	ZINC000872310454	ED	On-Demand	Anodyne	SLC6A1	120	35
CN1CCN(C(=O)[C@@H]2CCCN(CC(F)F)C2)Cc2cccnc21	ZINC000872310455	ED	On-Demand	Anodyne	SLC6A1	120	35
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1	ZINC000872310461	CD	On-Demand	Anodyne	ADRB2	32	46
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1	ZINC000872310461	CD	On-Demand	Anodyne	ADRB1	49	38
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1	ZINC000872310462	CD	On-Demand	Anodyne	ADRB2	32	46
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1	ZINC000872310462	CD	On-Demand	Anodyne	ADRB1	49	38
C[C@@H]1Cc2ccccc2N1C(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310474	DE	On-Demand	Anodyne	DRD4	23	43
CN1CCN(C(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310514	ED	On-Demand	Anodyne	PREP	27	45
CN1CCN(C(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310514	ED	On-Demand	Anodyne	GPR119	33	41
CN1CCC(CNC(=O)[C@]23CCC[C@H]2CNC3)(c2ccccc2)CC1	ZINC000872310529	EE	On-Demand	Anodyne	KCNA3	45	36
CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872310532	EG	On-Demand	Anodyne	SLC6A3	19	42
CN1CCC(CNC(=O)[C@@H]2CCCCC[C@@H]2N)(c2ccccc2)CC1	ZINC000872310543	EF	On-Demand	Anodyne	KCNA3	50	39
C[C@@H](CNC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccc(S(C)(=O)=O)cc1	ZINC000872310591	FE	On-Demand	Anodyne	CTSK	19	41
CN1CCC(CNC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)(c2ccccc2)CC1	ZINC000872310613	ED	On-Demand	Anodyne	KCNA3	48	37
CN1CCN(C2CCN(C(=O)[C@@H]3CCCCC[C@@H]3N)CC2)CC1	ZINC000872310627	DD	On-Demand	Anodyne	L3MBTL3	75	47
COCc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872310630	DF	On-Demand	Anodyne	TSHR	47	30
COCc1cc(NC(=O)[C@@H]2CCCCC[C@@H]2N)ccc1OC	ZINC000872310630	DF	On-Demand	Anodyne	QRFPR	51	42
O=C(Nc1ccccc1)c1ccc(CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310634	EH	On-Demand	Anodyne	KCNK3	41	37
N#Cc1cc(F)ccc1N1CCN(C(=O)[C@H]2CCCCC[C@H]2N)CC1	ZINC000872310643	EE	On-Demand	Mild	CTSK	22	47
NS(=O)(=O)c1ccc(OCCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310656	ED	On-Demand	Anodyne	CA7	24	41
CC[C@@H](NC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1OC	ZINC000872310685	DG	On-Demand	Anodyne	AMY2	44	30
CN1CCN(C(=O)c2cccc(S(=O)(=O)C(F)F)c2)Cc2cccnc21	ZINC000872310693	GE	On-Demand	Anodyne	AKR1C3	53	38
CC(=O)Nc1cccc(CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872310725	EE	On-Demand	Anodyne	P2RY14	42	32
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)c1cnn(C)c1	ZINC000872310739	DD	On-Demand	Anodyne	PTAFR	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000872310744	FE	On-Demand	Anodyne	CTSS	17	41
CN1CCN(C(=O)[C@@H]2CC[C@H]3C[C@H]3C2)Cc2cccnc21	ZINC000872310800	CE	On-Demand	Anodyne	SSTR1	68	43
CN1CCN(C(=O)[C@@H]2CC[C@H]3C[C@@H]3C2)Cc2cccnc21	ZINC000872310801	CE	On-Demand	Anodyne	SSTR1	68	43
CN1CCN(C(=O)[C@@H]2CC[C@@H]3C[C@H]3C2)Cc2cccnc21	ZINC000872310802	CE	On-Demand	Anodyne	SSTR1	68	43
CN1CCN(C(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)Cc2cccnc21	ZINC000872310803	CE	On-Demand	Anodyne	SSTR1	68	43
C[C@H](NC(=O)CN[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1	ZINC000872310807	DF	On-Demand	Anodyne	PRCP	15	43
C[C@@H](NC(=O)CN[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1	ZINC000872310808	DF	On-Demand	Anodyne	PRCP	15	43
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310819	GE	On-Demand	Mild	PTAFR	15	40
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310819	GE	On-Demand	Mild	TGM2	15	41
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310820	GE	On-Demand	Mild	PTAFR	15	40
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872310820	GE	On-Demand	Mild	TGM2	15	41
O=C(N1CCC(c2nc(C3CCC3)no2)CC1)[C@]12CCC[C@H]1CNC2	ZINC000872310822	EE	On-Demand	Anodyne	ETHR	55	50
N#CCc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310874	DD	On-Demand	Mild	ADRB1	22	40
N#CCc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872310875	DD	On-Demand	Mild	ADRB1	22	40
COC(=O)c1sccc1NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872310903	DD	On-Demand	Anodyne	FAS	43	47
COCc1cc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)ccc1OC	ZINC000872310963	CD	On-Demand	Anodyne	QRFPR	41	34
COc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872310973	EF	On-Demand	Anodyne	SSTR1	54	38
N#Cc1ccc(N2CCN(C(=O)[C@H]3CCCCC[C@H]3N)CC2)cc1	ZINC000872310985	EE	On-Demand	Mild	CTSK	19	64
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCC(Cc2ccccc2)CC1	ZINC000872310995	EF	On-Demand	Anodyne	GRIN2B	59	41
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCC(Cc2ccccc2)CC1	ZINC000872310995	EF	On-Demand	Anodyne	CCR3	23	40
CN1CCN(C(=O)Cc2nsc3ccccc23)Cc2cccnc21	ZINC000872311021	EF	On-Demand	Anodyne	HTR1A	20	42
CN1CCN(C(=O)Cc2nsc3ccccc23)Cc2cccnc21	ZINC000872311021	EF	On-Demand	Anodyne	DRD2	24	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872311034	EF	On-Demand	Anodyne	ETHR	57	54
O=C(CN[C@]12CCC[C@H]1OCC2)NCCCc1ccccc1	ZINC000872311035	DE	On-Demand	Anodyne	CRTM	34	41
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000872311063	DE	On-Demand	Anodyne	SSTR1	21	44
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	DRD2	15	40
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	DRD4	42	40
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	ACHE	34	41
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	SLC6A1	46	32
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	HRH3	15	53
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	SIGMAR1	46	57
CN1CCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311217	FE	On-Demand	Anodyne	FAAH	21	40
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	DRD2	15	40
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	DRD4	42	40
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	ACHE	34	41
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	SLC6A1	46	32
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	HRH3	15	53
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	SIGMAR1	46	57
CN1CCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)Cc2cccnc21	ZINC000872311218	FE	On-Demand	Anodyne	FAAH	21	40
CN1CCN(C(=O)c2cccc3c2OCCCO3)Cc2cccnc21	ZINC000872311249	EE	On-Demand	Anodyne	G2YM83_BOTF4	40	34
CN1CCN(C(=O)[C@@H](O)c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872311256	EE	On-Demand	Anodyne	AKT3	41	37
CN1CCN(C(=O)[C@H](O)c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872311257	EE	On-Demand	Anodyne	AKT3	41	37
C[C@@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc(Cl)cc1	ZINC000872311268	EG	On-Demand	Anodyne	AKT3	42	38
C[C@H](C(=O)N1CCN(C)c2ncccc2C1)c1ccc(Cl)cc1	ZINC000872311269	EG	On-Demand	Anodyne	AKT3	42	38
CN1CCN(C(=O)c2ccc(-n3cnnn3)cn2)Cc2cccnc21	ZINC000872311274	EC	On-Demand	Anodyne	KCNJ1	50	34
CN1CCN(C(=O)[C@H]2CCc3ccccc3C2)Cc2cccnc21	ZINC000872311281	DF	On-Demand	Anodyne	SSTR1	38	41
CN1CCN(C(=O)[C@@H]2CCc3ccccc3C2)Cc2cccnc21	ZINC000872311282	DF	On-Demand	Anodyne	SSTR1	38	41
CN1CCN(C(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)Cc2cccnc21	ZINC000872311310	FE	On-Demand	Anodyne	GPR119	23	41
CN1CCN(C(=O)[C@@H]2CSC(c3ccccc3O)=N2)Cc2cccnc21	ZINC000872311340	FE	On-Demand	Anodyne	FPTA	23	41
CN1CCN(C(=O)[C@H]2CSC(c3ccccc3O)=N2)Cc2cccnc21	ZINC000872311341	FE	On-Demand	Anodyne	FPTA	23	41
CC(=O)N1CCN(c2ccc(NC(=O)[C@@H]3CCCCC[C@@H]3N)cc2)CC1	ZINC000872311388	FE	On-Demand	Anodyne	EPHX2	17	43
N#Cc1ccc2c(c1)C[C@H](NC(=O)[C@H]1CCCCC[C@H]1N)C2	ZINC000872311394	CE	On-Demand	Mild	CA7	15	46
N#Cc1ccc2c(c1)C[C@@H](NC(=O)[C@H]1CCCCC[C@H]1N)C2	ZINC000872311395	CE	On-Demand	Mild	CA7	15	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	ACE	20	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	SSTR2	31	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MME	26	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	EDNRB	46	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	EDNRA	30	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	TACR1	34	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MC4R	47	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	CCKAR	105	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	BRS3	27	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	NMBR	49	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MC3R	63	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MC5R	66	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MMP2	26	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MMP8	33	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	GRPR	78	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	ECE1	63	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MMP11	87	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	CCKBR	90	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	GHSR	69	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	MC1R	91	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	NPR	26	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	KISS1R	75	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872311401	GD	On-Demand	Anodyne	ERAP2	41	35
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1Cl	ZINC000872311429	DE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1Cl	ZINC000872311430	DE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1ccc2ccccc2c1	ZINC000872311476	EF	On-Demand	Anodyne	ADRB2	17	51
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1ccc2ccccc2c1	ZINC000872311477	EF	On-Demand	Anodyne	ADRB2	17	51
COc1cccc(OCCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872311484	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872311484	EE	On-Demand	Anodyne	MTNR1B	16	40
CN1CCN(C(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)Cc2cccnc21	ZINC000872311489	GF	On-Demand	Anodyne	GPR119	49	46
CN1CCN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)Cc2cccnc21	ZINC000872311490	GF	On-Demand	Anodyne	GPR119	49	46
CN1CCN(C(=O)c2ccc(CF)cc2)Cc2cccnc21	ZINC000872311506	CF	On-Demand	Anodyne	FABI	41	34
CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2Cl)Cc2cccnc21	ZINC000872311511	EF	On-Demand	Bother	P2RX7	44	44
CN1CCN(C(=O)c2cc3cc(Cl)sc3[nH]2)Cc2cccnc21	ZINC000872311512	EG	On-Demand	Anodyne	HRH4	34	63
CN1CCN(C(=O)c2cc3cc(Cl)sc3[nH]2)Cc2cccnc21	ZINC000872311512	EG	On-Demand	Anodyne	PYGL	26	40
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	FKBP1A	16	43
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	UL80	43	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	CPT2	45	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	PREP	91	39
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	SFRP1	38	41
CN1CCN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)Cc2cccnc21	ZINC000872311536	GF	On-Demand	Anodyne	WNT3	45	41
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000872311559	FD	On-Demand	Anodyne	EPHX2	20	40
N#Cc1c(NC(=O)CCN[C@]23CCC[C@H]2OCC3)sc2c1CCCC2	ZINC000872311615	FG	On-Demand	Mild	VIPR1	31	50
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1F	ZINC000872311618	CD	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1ccccc1F	ZINC000872311619	CD	On-Demand	Anodyne	ADRB2	17	40
CN1CCN(C(=O)c2c(Cl)cncc2Cl)Cc2cccnc21	ZINC000872311681	EF	On-Demand	Anodyne	P2RX7	20	40
C[C@@H](CC(=O)N1CCN(C)c2ncccc2C1)n1ccnc1	ZINC000872311694	CD	On-Demand	Anodyne	CYP26A1	54	32
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2ccccc12	ZINC000872311741	EF	On-Demand	Anodyne	ADRB2	22	51
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2ccccc12	ZINC000872311741	EF	On-Demand	Anodyne	ADRB1	21	51
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2ccccc12	ZINC000872311742	EF	On-Demand	Anodyne	ADRB2	22	51
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2ccccc12	ZINC000872311742	EF	On-Demand	Anodyne	ADRB1	21	51
O=C(c1cccc(CN[C@]23CCC[C@H]2OCC3)c1)N1CCCCC1	ZINC000872311807	EG	On-Demand	Anodyne	L3MBTL3	46	40
CN1CCN(C(=O)c2cc(F)cnc2O)Cc2cccnc21	ZINC000872311846	DD	On-Demand	Anodyne	P2RX7	21	40
CN1CCN(C(=O)c2ccc(Cn3ccnn3)cc2)Cc2cccnc21	ZINC000872311848	ED	On-Demand	Anodyne	FABI	45	34
O=C([C@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311849	DF	On-Demand	Anodyne	CHRNA7	44	35
O=C([C@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311849	DF	On-Demand	Anodyne	C3AR1	44	45
O=C([C@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311849	DF	On-Demand	Anodyne	NAMPT	40	40
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311850	DF	On-Demand	Anodyne	CHRNA7	44	35
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311850	DF	On-Demand	Anodyne	C3AR1	44	45
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872311850	DF	On-Demand	Anodyne	NAMPT	40	40
CN1CCN(C(=O)c2cscc2C(F)(F)F)Cc2cccnc21	ZINC000872311874	EG	On-Demand	Anodyne	TRPV1	17	41
CN1CCN(C(=O)c2cscc2C(F)(F)F)Cc2cccnc21	ZINC000872311874	EG	On-Demand	Anodyne	P2RX7	36	40
N#Cc1cccc(OCCN[C@]23CCC[C@H]2OCC3)c1	ZINC000872311878	CE	On-Demand	Mild	CHRNA10	16	43
CN1CCN(C(=O)c2ccc(C(=O)N3CCOCC3)cc2)Cc2cccnc21	ZINC000872311911	GD	On-Demand	Anodyne	PIK3CA	15	41
CN1CCN(C(=O)c2ccc(C(=O)N3CCOCC3)cc2)Cc2cccnc21	ZINC000872311911	GD	On-Demand	Anodyne	MTOR	20	41
Cc1ccc(F)c2[nH]c(C(=O)N3CCN(C)c4ncccc4C3)cc12	ZINC000872311935	EG	On-Demand	Anodyne	HRH4	38	60
CN1CCN(C(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872311938	FE	On-Demand	Anodyne	SMO	40	40
CN1CCN(C(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872311938	FE	On-Demand	Anodyne	L3MBTL3	46	37
CN1CCN(C(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872311939	FE	On-Demand	Anodyne	SMO	40	40
CN1CCN(C(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)Cc2cccnc21	ZINC000872311939	FE	On-Demand	Anodyne	L3MBTL3	46	37
CN1CCN(C(=O)c2ccsc2Cl)Cc2cccnc21	ZINC000872311953	DF	On-Demand	Anodyne	P2RX7	35	41
O=C(CN[C@]12CCC[C@H]1OCC2)NCC1(c2ccccc2)CCOCC1	ZINC000872311965	FE	On-Demand	Anodyne	KCNA3	43	35
CN1CCN(C(=O)c2ccsc2C(F)(F)F)Cc2cccnc21	ZINC000872311966	EG	On-Demand	Anodyne	P2RX7	26	41
CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccsc2)Cc2cccnc21	ZINC000872311993	DF	On-Demand	Anodyne	NPBWR1	104	39
CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	ZINC000872312030	IH	On-Demand	Anodyne	NR2E3	61	33
CN1CCN(C(=O)[C@@H]2COCCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312057	GD	On-Demand	Anodyne	GPR119	27	40
CN1CCN(C(=O)[C@H]2COCCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312058	GD	On-Demand	Anodyne	GPR119	27	40
CN1CCN(C(=O)c2cccn(C(C)(C)C)c2=O)Cc2cccnc21	ZINC000872312069	EE	On-Demand	Anodyne	P2RX7	23	41
O=C(/C=C/c1ccccc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312089	DF	On-Demand	Anodyne	ITGAL	94	39
O=C(/C=C/c1ccccc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312089	DF	On-Demand	Anodyne	RBP4	71	37
O=C(/C=C\c1ccccc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312091	DF	On-Demand	Anodyne	ITGAL	94	39
O=C(/C=C\c1ccccc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312091	DF	On-Demand	Anodyne	RBP4	71	37
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	CTSB	26	48
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	CTSK	28	48
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	CTSS	15	41
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	CAPN2	47	34
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	NPR	55	32
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	NAAA	49	50
O=C(NC1(C(=O)N2C[C@H]3COC[C@H]3C2)CC1)OCc1ccccc1	ZINC000872312106	ED	On-Demand	Anodyne	SLC12A5	60	36
O=C(/C=C\c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312134	EG	On-Demand	Anodyne	PTGER2	18	57
O=C(/C=C\c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312134	EG	On-Demand	Anodyne	ITGAL	48	43
O=C(/C=C\c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312134	EG	On-Demand	Anodyne	PTGER3	21	47
O=C(/C=C/c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312143	EG	On-Demand	Anodyne	PTGER2	18	57
O=C(/C=C/c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312143	EG	On-Demand	Anodyne	ITGAL	48	43
O=C(/C=C/c1ccccc1OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872312143	EG	On-Demand	Anodyne	PTGER3	21	47
O=C(c1cccc(Oc2ccccn2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872312145	DF	On-Demand	Anodyne	CFTR	33	48
Cc1cocc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312163	CE	On-Demand	Anodyne	P2RX7	18	41
O=C(/C=C\c1ccc(F)c2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872312199	DG	On-Demand	Anodyne	ITGAL	69	35
O=C(/C=C/c1ccc(F)c2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872312203	DG	On-Demand	Anodyne	ITGAL	69	35
CC(C)(C)OC(=O)N1CCC(c2ncc(C(=O)N3C[C@H]4COC[C@H]4C3)o2)CC1	ZINC000872312219	GF	On-Demand	Anodyne	GPR119	47	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	ACE	113	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	GHRHR	82	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	P2RY12	156	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CELA1	24	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	MME	114	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	ANPEP	52	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	TACR1	18	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	MC4R	59	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CMA1	63	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTRA_BOVIN	75	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	FCER2	63	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	KLK3	82	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTSB	79	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	TRY2_BOVIN	69	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	PAPA1_CARPA	73	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	TRY1_BOVIN	41	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CYSP_TRYCR	75	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CCKAR	17	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTSG	45	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTSK	69	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTSL	63	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CPA1	22	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	NPFFR2	64	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	TIMP3	81	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CAPNS1	87	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	MMP3	21	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	HLA-DRB1	87	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CELA2A	65	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	REN	62	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTSS	37	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CAPN1	131	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CAPN2	134	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	ACE2	91	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	TGM2	28	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	FPR1	71	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	CTRB_BOVIN	56	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	NPR	53	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	GAG-PRO	41	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	BLA1_STEMA	48	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	PSMB8	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312238	ED	On-Demand	Anodyne	NPFFR1	59	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	CTSD	100	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	PGC	63	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	REN	84	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	REN1	18	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	BACE1	75	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872312239	GF	On-Demand	Anodyne	FPR1	47	39
CN1CCN(C(=O)[C@H](CO)NC(=O)c2ccc(F)cc2)Cc2cccnc21	ZINC000872312246	FC	On-Demand	Anodyne	UGCG	37	44
CN1CCN(C(=O)[C@H](CO)NC(=O)c2ccc(F)cc2)Cc2cccnc21	ZINC000872312246	FC	On-Demand	Anodyne	MC4R	28	41
COc1cc(NC(=O)[C@@]23C[C@@H](N)C[C@@H]2C3)c2nccc(OC)c2c1	ZINC000872312284	EE	On-Demand	Anodyne	PDGFRA	44	34
O=C(/C=C/c1ccccc1OC(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312357	EF	On-Demand	Anodyne	ITGAL	87	41
O=C(/C=C\c1ccccc1OC(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312361	EF	On-Demand	Anodyne	ITGAL	87	41
Cc1ccc(CO[C@@H](C)C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872312371	EF	On-Demand	Anodyne	UGCG	19	41
Cc1ccc(CO[C@H](C)C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000872312373	EF	On-Demand	Anodyne	UGCG	19	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872312399	EH	On-Demand	Anodyne	MDM2	71	32
COc1cccc(C(C)(C)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872312438	EF	On-Demand	Anodyne	DRD4	40	30
O=C(/C=C\c1ccsc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312492	DF	On-Demand	Anodyne	ITGAL	75	35
O=C(/C=C/c1ccsc1C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872312493	DF	On-Demand	Anodyne	ITGAL	75	35
O=c1cc(CN[C@]23CCC[C@H]2OCC3)c2ccc(O)cc2o1	ZINC000872312527	DE	On-Demand	Anodyne	HSD17B3	32	47
CN1CCN(C(=O)c2cnccc2C(F)(F)F)Cc2cccnc21	ZINC000872312535	EF	On-Demand	Anodyne	TRPV1	16	42
CN1CCN(C(=O)c2cnccc2C(F)(F)F)Cc2cccnc21	ZINC000872312535	EF	On-Demand	Anodyne	P2RX7	40	41
CN1CCN(C(=O)c2cnccc2C(F)(F)F)Cc2cccnc21	ZINC000872312535	EF	On-Demand	Anodyne	RBP4	22	50
Cc1ccc(C(=O)N2CCN(C)c3ncccc3C2)c(F)c1F	ZINC000872312607	DF	On-Demand	Anodyne	P2RX7	39	41
CN1CCN(C(=O)[C@H](CO)NC(=O)Cc2ccc(F)cc2)Cc2cccnc21	ZINC000872312617	GC	On-Demand	Anodyne	UGCG	33	42
CN1CCN(C(=O)[C@H](CO)NC(=O)Cc2ccc(F)cc2)Cc2cccnc21	ZINC000872312617	GC	On-Demand	Anodyne	MC4R	36	46
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872312619	GD	On-Demand	Anodyne	LPL	42	34
COC1CC(C(=O)N2CCN(C)c3ncccc3C2)C1	ZINC000872312637	CD	On-Demand	Anodyne	SSTR1	53	38
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	CTSB	30	41
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	CTSK	27	41
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	PREP	24	42
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	CAPNS1	47	32
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	CAPN1	43	35
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	CAPN2	78	35
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	NPR	63	35
O=C(NCC1(C(=O)N2C[C@H]3COC[C@H]3C2)CCCC1)OCc1ccccc1	ZINC000872312650	FF	On-Demand	Anodyne	SLC12A5	63	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)[C@@]13C[C@@H](N)C[C@@H]1C3)CC2	ZINC000872312656	EE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)[C@@]13C[C@@H](N)C[C@@H]1C3)CC2	ZINC000872312657	EE	On-Demand	Anodyne	SLC18A2	48	36
CN1CCN(C(=O)[C@@H](Cc2cccnc2)C2CCCC2)Cc2cccnc21	ZINC000872312660	FG	On-Demand	Anodyne	C3AR1	44	42
CN1CCN(C(=O)[C@H](Cc2cccnc2)C2CCCC2)Cc2cccnc21	ZINC000872312662	FG	On-Demand	Anodyne	C3AR1	44	42
CN1CCN(C(=O)[C@@H](CO)c2ccccc2)Cc2cccnc21	ZINC000872312703	DD	On-Demand	Anodyne	CHRM4	19	40
CN1CCN(C(=O)[C@@H](CO)c2ccccc2)Cc2cccnc21	ZINC000872312703	DD	On-Demand	Anodyne	CHRM5	26	40
CN1CCN(C(=O)[C@H](CO)c2ccccc2)Cc2cccnc21	ZINC000872312705	DD	On-Demand	Anodyne	CHRM4	19	40
CN1CCN(C(=O)[C@H](CO)c2ccccc2)Cc2cccnc21	ZINC000872312705	DD	On-Demand	Anodyne	CHRM5	26	40
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc(C(F)(F)F)c1	ZINC000872312709	EF	On-Demand	Anodyne	PDS	43	38
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc(C(F)(F)F)c1	ZINC000872312714	EF	On-Demand	Anodyne	PDS	43	38
C/C(=C/c1ccccn1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312731	CD	On-Demand	Anodyne	Q59401_ENTCL	54	33
C/C(=C\c1ccccn1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872312733	CD	On-Demand	Anodyne	Q59401_ENTCL	54	33
CC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312766	DD	On-Demand	Anodyne	MC4R	22	41
CC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312766	DD	On-Demand	Anodyne	HPN	40	34
COc1ccc2c(CN[C@]34CCC[C@H]3OCC4)cc(=O)oc2c1	ZINC000872312770	DF	On-Demand	Anodyne	MAOB	23	43
CCCOc1cccc(CNC(=O)CN[C@]23CCC[C@H]2OCC3)c1	ZINC000872312771	EE	On-Demand	Anodyne	PDS	42	32
CN1CCN(C(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312803	GE	On-Demand	Anodyne	GPR119	46	42
CN1CCN(C(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312804	GE	On-Demand	Anodyne	GPR119	46	42
CN1CCN(C(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312805	GE	On-Demand	Anodyne	GPR119	46	42
CN1CCN(C(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872312806	GE	On-Demand	Anodyne	GPR119	46	42
CN1CCN(C(=O)[C@H]2C[C@@H]3C[C@@H]3C2)Cc2cccnc21	ZINC000872312866	CD	On-Demand	Anodyne	SSTR1	66	44
CN1CCN(C(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)Cc2cccnc21	ZINC000872312869	CD	On-Demand	Anodyne	SSTR1	66	44
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC[C@H]2Cc3ccccc3CN2)C1	ZINC000872312870	CC	On-Demand	Anodyne	PNMT	37	43
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NC[C@@H]2Cc3ccccc3CN2)C1	ZINC000872312871	CC	On-Demand	Anodyne	PNMT	37	43
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(Cc2ccccc2)CC1	ZINC000872312872	ED	On-Demand	Anodyne	SIGMAR1	60	40
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(Cc2ccccc2)CC1	ZINC000872312872	ED	On-Demand	Anodyne	NPFFR1	40	38
CC(=O)N1CCC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312887	DC	On-Demand	Anodyne	CPT2	44	39
CC(=O)N1CCC[C@@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312887	DC	On-Demand	Anodyne	PREP	95	41
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872312909	GD	On-Demand	Anodyne	SLC12A5	51	36
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872312913	GD	On-Demand	Anodyne	SLC12A5	51	36
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872312917	GD	On-Demand	Anodyne	SLC12A5	51	36
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872312921	GD	On-Demand	Anodyne	SLC12A5	51	36
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312933	ED	On-Demand	Anodyne	ADRB2	25	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312933	ED	On-Demand	Anodyne	ADRB1	60	54
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312933	ED	On-Demand	Anodyne	ADRB3	34	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312935	ED	On-Demand	Anodyne	ADRB2	25	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312935	ED	On-Demand	Anodyne	ADRB1	60	54
CC(=O)Nc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872312935	ED	On-Demand	Anodyne	ADRB3	34	45
Cc1ncc(C(F)(F)F)cc1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872312948	FF	On-Demand	Anodyne	TRPV1	16	42
CCn1c(O)nc2cc(C(=O)N3CCN(C)c4ncccc4C3)ccc21	ZINC000872312955	FE	On-Demand	Anodyne	HPGD	44	37
CN1CCN(C(=O)c2ccc3c(c2)nc(O)n3C2CC2)Cc2cccnc21	ZINC000872312959	FF	On-Demand	Anodyne	HPGD	44	34
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1cccc(C(F)(F)F)c1	ZINC000872312984	EF	On-Demand	Anodyne	CCR2	47	37
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	ZINC000872312997	JH	On-Demand	Anodyne	NR2E3	43	30
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)C1	ZINC000872313005	DD	On-Demand	Anodyne	EPHX2	18	40
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1ccc(F)cc1C(F)(F)F	ZINC000872313056	FF	On-Demand	Anodyne	P2RX7	24	46
COc1ccc(Nc2ccc(C(=O)N3C[C@H]4COC[C@H]4C3)cc2)c(OC)c1	ZINC000872313095	FG	On-Demand	Anodyne	AKR1C3	30	44
COc1ccc(Nc2ccc(C(=O)N3C[C@H]4COC[C@H]4C3)cc2)c(OC)c1	ZINC000872313095	FG	On-Demand	Anodyne	AKR1C2	48	44
COc1ccc(Nc2ccc(C(=O)N3C[C@H]4COC[C@H]4C3)cc2)c(OC)c1	ZINC000872313095	FG	On-Demand	Anodyne	LRRK2	15	43
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1cccnc1Cl	ZINC000872313098	CD	On-Demand	Anodyne	G2YM83_BOTF4	69	34
O=C(c1cccc(Oc2ccc(Cl)cn2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872313112	EG	On-Demand	Anodyne	CFTR	23	42
COC(=O)c1cccc(NC(=O)CN[C@]23CCC[C@H]2OCC3)c1	ZINC000872313119	DD	On-Demand	Anodyne	HIF1A	15	45
O[C@H](CN[C@]12CCC[C@H]1OCC2)c1cccc(Cl)c1	ZINC000872313129	CF	On-Demand	Anodyne	ADRB3	35	42
O[C@@H](CN[C@]12CCC[C@H]1OCC2)c1cccc(Cl)c1	ZINC000872313130	CF	On-Demand	Anodyne	ADRB3	35	42
O=C(c1csc(NC2CCCCC2)n1)N1C[C@H]2COC[C@H]2C1	ZINC000872313132	DF	On-Demand	Anodyne	TRPC6	60	39
O=C(c1csc(NC2CCCCC2)n1)N1C[C@H]2COC[C@H]2C1	ZINC000872313132	DF	On-Demand	Anodyne	TRPC3	54	39
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(OC(F)(F)F)cc1	ZINC000872313143	EF	On-Demand	Anodyne	EPHX2	55	44
CCCC[C@](C)(F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872313144	BE	On-Demand	Anodyne	EST1_PIG	43	32
CCCC[C@@](C)(F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872313145	BE	On-Demand	Anodyne	EST1_PIG	43	32
O=C(CCN[C@]12CCC[C@H]1OCC2)NCc1ccccc1Cl	ZINC000872313160	DF	On-Demand	Anodyne	P2RX7	24	42
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872313176	CE	On-Demand	Anodyne	OXTR	54	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000872313176	CE	On-Demand	Anodyne	SLC18A3	15	40
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872313177	CE	On-Demand	Anodyne	OXTR	54	36
N[C@@H]1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000872313177	CE	On-Demand	Anodyne	SLC18A3	15	40
COc1ccc2c(c1)CC[C@H]2C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872313210	CD	On-Demand	Anodyne	PPARD	26	41
COc1ccc2c(c1)CC[C@H]2C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872313210	CD	On-Demand	Anodyne	MTNR1B	15	42
O=C(/C=C\c1csc(C(F)(F)F)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872313224	DF	On-Demand	Anodyne	ITGAL	55	35
O=C(N1CC[C@]2(CCc3ccccc32)C1)[C@]12CCC[C@H]1CNC2	ZINC000872313226	DE	On-Demand	Anodyne	OXTR	53	37
O=C(/C=C/c1csc(C(F)(F)F)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872313227	DF	On-Demand	Anodyne	ITGAL	55	35
O=C(N1CC[C@@]2(CCc3ccccc32)C1)[C@]12CCC[C@H]1CNC2	ZINC000872313228	DE	On-Demand	Anodyne	OXTR	53	37
O=C(CN[C@]12CCC[C@H]1OCC2)OCc1ccccc1	ZINC000872313240	CE	On-Demand	Anodyne	SLC12A5	73	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	ZINC000872313248	HF	On-Demand	Anodyne	CA2	19	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	ZINC000872313248	HF	On-Demand	Anodyne	CA1	18	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	ZINC000872313248	HF	On-Demand	Anodyne	CA4	20	40
CN1CCN(C(=O)c2ccccc2NC(=O)C2CC2)Cc2cccnc21	ZINC000872313260	FF	On-Demand	Anodyne	G2YM83_BOTF4	54	37
CN1CCN(C(=O)[C@H](CO)NC(=O)c2cccc(F)n2)Cc2cccnc21	ZINC000872313264	FC	On-Demand	Anodyne	P2RY12	57	37
CCOC(=O)[C@@H](NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccccc1	ZINC000872313291	DD	On-Demand	Anodyne	TIMP3	50	32
CN1CCN(C(=O)Cc2nnc(-c3ccccc3)o2)Cc2cccnc21	ZINC000872313318	EE	On-Demand	Anodyne	CALCRL	16	51
N#Cc1cccc(NC(=O)CN[C@]23CCC[C@H]2OCC3)c1	ZINC000872313338	CD	On-Demand	Mild	MCHR1	37	42
CN1CCN(C(=O)c2cscc2Cl)Cc2cccnc21	ZINC000872313350	DF	On-Demand	Anodyne	P2RX7	37	44
N#Cc1c(NC(=O)CN[C@]23CCC[C@H]2OCC3)sc2c1CCCCC2	ZINC000872313393	FG	On-Demand	Mild	VIPR1	31	49
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1cccc(OCC(F)(F)F)c1	ZINC000872313404	FF	On-Demand	Anodyne	PDS	41	35
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(N2CCOCC2)cc1	ZINC000872313428	ED	On-Demand	Anodyne	MTOR	52	35
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(N2CCOCC2)cc1	ZINC000872313428	ED	On-Demand	Anodyne	STAT6	52	33
CC(=O)N1CCC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872313440	DC	On-Demand	Anodyne	CPT2	44	39
CC(=O)N1CCC[C@H]1C(=O)N1CCN(C)c2ncccc2C1	ZINC000872313440	DC	On-Demand	Anodyne	PREP	95	41
Cc1ccc(F)c2[nH]c(C(=O)N3C[C@H]4COC[C@H]4C3)cc12	ZINC000872313441	CE	On-Demand	Anodyne	HRH4	35	57
CN1CCN(C(=O)[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)Cc2cccnc21	ZINC000872313482	GF	On-Demand	Anodyne	PREP	15	41
O=C(CN[C@]12CCC[C@H]1OCC2)NCC1(c2ccccc2)CCCC1	ZINC000872313491	EF	On-Demand	Anodyne	KCNA3	45	38
O=C(CCN[C@]12CCC[C@H]1OCC2)N1CCN(c2ccc(F)cc2)CC1	ZINC000872313523	FE	On-Demand	Anodyne	SSTR1	31	42
COC(=O)[C@@H](Cc1ccc(OC(F)(F)F)cc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872313562	GD	On-Demand	Anodyne	UGCG	21	49
COC(=O)[C@@H](Cc1ccc(OC(F)(F)F)cc1)NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2	ZINC000872313562	GD	On-Demand	Anodyne	TIMP3	55	42
CO[C@H]1CC[C@@H](C(=O)N2CCN(C)c3ncccc3C2)C1	ZINC000872313575	CD	On-Demand	Anodyne	SSTR1	41	37
CO[C@@H]1CC[C@@H](C(=O)N2CCN(C)c3ncccc3C2)C1	ZINC000872313576	CD	On-Demand	Anodyne	SSTR1	41	37
Cc1cc(CN[C@]23CCC[C@H]2OCC3)c2ccccc2n1	ZINC000872313630	CG	On-Demand	Anodyne	ADAM17	80	39
COc1cccc([S@](=O)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872313640	FD	On-Demand	Anodyne	DRD4	40	30
COc1cccc([S@@](=O)CC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872313641	FD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	PLG	17	40
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	GHRHR	56	32
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	PGC	51	34
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	TRY2_BOVIN	74	33
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	PAPA1_CARPA	39	45
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	TRY1_BOVIN	15	40
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	CTSK	18	42
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	CTSL	35	46
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	REN	58	39
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	CTSS	27	46
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313656	GE	On-Demand	Anodyne	FPR1	53	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	PLG	17	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	GHRHR	56	32
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	PGC	51	34
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	TRY2_BOVIN	74	33
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	PAPA1_CARPA	39	45
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	TRY1_BOVIN	15	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	CTSK	18	42
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	CTSL	35	46
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	REN	58	39
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	CTSS	27	46
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872313657	GE	On-Demand	Anodyne	FPR1	53	40
O=C(c1cccc(S(=O)(=O)C(F)(F)F)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872313709	ED	On-Demand	Anodyne	AKR1C3	52	42
O=C(c1cccc(S(=O)(=O)C(F)(F)F)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872313709	ED	On-Demand	Anodyne	SFRP1	42	37
O=C(c1cc2c(C3CC3)cccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872313732	CF	On-Demand	Anodyne	GRIN2B	22	43
O=C(c1cc2c(C3CC3)cccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872313732	CF	On-Demand	Anodyne	HRH4	22	44
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(F)c(Cl)c1	ZINC000872313740	DF	On-Demand	Anodyne	ERBB4	47	32
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(F)c(Cl)c1	ZINC000872313740	DF	On-Demand	Anodyne	MCHR1	28	50
O[C@@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2[nH]ccc12	ZINC000872313742	DE	On-Demand	Anodyne	ADRB1	18	60
O[C@H](CN[C@]12CCC[C@H]1OCC2)COc1cccc2[nH]ccc12	ZINC000872313743	DE	On-Demand	Anodyne	ADRB1	18	60
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1ccc2c(c1)OCO2	ZINC000872313744	DD	On-Demand	Anodyne	NOS2	95	39
O=C(OCc1ccccc1)N1CC(O)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313745	EC	On-Demand	Anodyne	GRIN2B	17	40
O=C(OCc1ccccc1)N1CC(O)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313745	EC	On-Demand	Anodyne	PREP	22	40
O=C(OCc1ccccc1)N1CC(O)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313745	EC	On-Demand	Anodyne	TGM2	28	44
O=C(OCc1ccccc1)N1CC(O)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313745	EC	On-Demand	Anodyne	F13A1	30	44
O=C(OCc1ccccc1)N1CC(O)(C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313745	EC	On-Demand	Anodyne	SLC12A5	49	34
O=C(c1ccc(CF)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872313747	BD	On-Demand	Anodyne	L3MBTL3	43	44
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872313765	EG	On-Demand	Anodyne	ITGAL	87	36
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872313766	EG	On-Demand	Anodyne	ITGAL	87	36
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1cccnc1	ZINC000872313782	CC	On-Demand	Anodyne	NAMPT	48	39
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872313796	DG	On-Demand	Anodyne	OXTR	40	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872313796	DG	On-Demand	Anodyne	SLC18A3	15	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872313797	DG	On-Demand	Anodyne	OXTR	40	36
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872313797	DG	On-Demand	Anodyne	SLC18A3	15	40
Cc1ccccc1CN1CCC(NC(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872313811	FE	On-Demand	Anodyne	SIGMAR1	16	45
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)Cc2cccnc21	ZINC000872313839	GD	On-Demand	Anodyne	CA6	17	41
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)Cc2cccnc21	ZINC000872313839	GD	On-Demand	Anodyne	CA7	20	50
CN1CCN(C(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)Cc2cccnc21	ZINC000872313839	GD	On-Demand	Anodyne	CA13	39	50
O=C(CN[C@]12CCC[C@H]1OCC2)NCC1(c2ccccc2)CC1	ZINC000872313841	DE	On-Demand	Anodyne	KCNA3	45	37
CC(=O)N[C@@H](CCC(C)C)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872313848	ED	On-Demand	Anodyne	MC4R	19	40
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@H]1Cc2ccccc2CN1	ZINC000872313854	DD	On-Demand	Anodyne	PNMT	39	45
N[C@@H]1CCCCC[C@@H]1C(=O)NC[C@@H]1Cc2ccccc2CN1	ZINC000872313855	DD	On-Demand	Anodyne	PNMT	39	45
CN1CCN(C(=O)[C@@H](O)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872313903	FF	On-Demand	Anodyne	TRPV1	24	47
CN1CCN(C(=O)[C@H](O)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872313905	FF	On-Demand	Anodyne	TRPV1	24	47
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872313930	GC	On-Demand	Anodyne	TGM2	51	38
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872313930	GC	On-Demand	Anodyne	F13A1	57	38
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313963	FE	On-Demand	Anodyne	PREP	23	40
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313963	FE	On-Demand	Anodyne	TGM2	26	41
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313963	FE	On-Demand	Anodyne	F13A1	30	41
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313963	FE	On-Demand	Anodyne	SLC12A5	59	37
O=C(OCc1ccccc1)N1CC[C@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313964	FE	On-Demand	Anodyne	PREP	23	40
O=C(OCc1ccccc1)N1CC[C@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313964	FE	On-Demand	Anodyne	TGM2	26	41
O=C(OCc1ccccc1)N1CC[C@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313964	FE	On-Demand	Anodyne	F13A1	30	41
O=C(OCc1ccccc1)N1CC[C@]2(C[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313964	FE	On-Demand	Anodyne	SLC12A5	59	37
O=C(OCc1ccccc1)N1CC[C@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313965	FE	On-Demand	Anodyne	PREP	23	40
O=C(OCc1ccccc1)N1CC[C@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313965	FE	On-Demand	Anodyne	TGM2	26	41
O=C(OCc1ccccc1)N1CC[C@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313965	FE	On-Demand	Anodyne	F13A1	30	41
O=C(OCc1ccccc1)N1CC[C@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313965	FE	On-Demand	Anodyne	SLC12A5	59	37
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313966	FE	On-Demand	Anodyne	PREP	23	40
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313966	FE	On-Demand	Anodyne	TGM2	26	41
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313966	FE	On-Demand	Anodyne	F13A1	30	41
O=C(OCc1ccccc1)N1CC[C@@]2(C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872313966	FE	On-Demand	Anodyne	SLC12A5	59	37
CCOc1ccccc1NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872313992	DE	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872313992	DE	On-Demand	Anodyne	HCN4	43	33
CN1CCN(C(=O)c2ccc(C3CC3)cc2)Cc2cccnc21	ZINC000872314015	DG	On-Demand	Anodyne	SMO	26	42
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1ccc(CN2CCCC2)cc1	ZINC000872314016	FE	On-Demand	Anodyne	NPFFR1	40	41
CN1CCN(C(=O)[C@H]2CCCN2C=O)Cc2cccnc21	ZINC000872314022	CC	On-Demand	Anodyne	PREP	47	38
CN1CCN(C(=O)[C@@H]2CCCN2C=O)Cc2cccnc21	ZINC000872314023	CC	On-Demand	Anodyne	PREP	47	38
O=C(CN[C@]12CCC[C@H]1OCC2)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872314036	FD	On-Demand	Anodyne	L3MBTL3	55	36
N#Cc1ccc(N2CCN(C(=O)[C@H]3CCCCC[C@H]3N)CC2)cn1	ZINC000872314052	ED	On-Demand	Mild	CTSK	17	47
O=C(CN[C@]12CCC[C@H]1OCC2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872314130	FD	On-Demand	Bother	SSTR1	44	44
O=C(CN[C@]12CCC[C@H]1OCC2)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000872314132	FE	On-Demand	Anodyne	EPHX2	63	40
Oc1nc(CN[C@]23CCC[C@H]2OCC3)nc2c1oc1ccccc12	ZINC000872314136	EF	On-Demand	Anodyne	PIM1	17	43
Oc1nc(CN[C@]23CCC[C@H]2OCC3)nc2c1oc1ccccc12	ZINC000872314136	EF	On-Demand	Anodyne	CDC7	21	43
Oc1nc(CN[C@]23CCC[C@H]2OCC3)nc2c1oc1ccccc12	ZINC000872314136	EF	On-Demand	Anodyne	PIM3	25	43
CN1CCN(C(=O)c2cccc3c2C(=O)CC3)Cc2cccnc21	ZINC000872314150	DE	On-Demand	Anodyne	P2RX7	22	42
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872314153	EF	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872314153	EF	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872314154	EF	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872314154	EF	On-Demand	Anodyne	HCN4	42	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	P2RY12	136	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	PTAFR	15	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	UGCG	39	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	MC4R	73	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CTRA_BOVIN	43	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CTSB	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	TRY2_BOVIN	52	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CYSP_TRYCR	63	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CTSL	41	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CAPNS1	66	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	HLA-DRB1	60	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CELA2A	51	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CAPN1	82	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	CAPN2	91	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	ACE2	46	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314175	GE	On-Demand	Anodyne	TGM2	23	47
O=C(/C(=C/c1ccccc1)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872314183	DF	On-Demand	Anodyne	RBP4	47	34
O=C(/C(=C\c1ccccc1)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872314184	DF	On-Demand	Anodyne	RBP4	47	34
CN1CCN(C(=O)c2cccc(N3CCCC3)c2)Cc2cccnc21	ZINC000872314197	EF	On-Demand	Anodyne	HPGD	44	36
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc2c(c1)CCC2	ZINC000872314254	DE	On-Demand	Anodyne	PTPRF	41	32
CN1CCN(C(=O)c2ccc(C(F)(F)F)c(O)n2)Cc2cccnc21	ZINC000872314276	FE	On-Demand	Anodyne	TRPV1	21	42
N[C@@H]1CCCCC[C@@H]1C(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872314295	DF	On-Demand	Anodyne	EPHX2	15	44
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872314325	ED	On-Demand	Anodyne	ETHR	36	40
N[C@@H]1CCCCC[C@@H]1C(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872314326	ED	On-Demand	Anodyne	ETHR	36	40
CC(C)c1cccc(C(C)C)c1NC(=O)CN[C@]12CCC[C@H]1OCC2	ZINC000872314337	EI	On-Demand	Anodyne	SOAT1	42	40
N#Cc1cccc(NC(=O)CCN[C@]23CCC[C@H]2OCC3)c1	ZINC000872314344	CE	On-Demand	Mild	MCHR1	34	40
O=C(c1ccc(-c2cn[nH]c2)cn1)N1C[C@H]2COC[C@H]2C1	ZINC000872314347	CD	On-Demand	Anodyne	ROCK2	43	37
CC(C)(C)OC(=O)N1CCC(c2cc(C(=O)N3C[C@H]4COC[C@H]4C3)on2)CC1	ZINC000872314364	GF	On-Demand	Anodyne	GPR119	43	42
O=C(c1ccc(B(O)O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314381	CB	On-Demand	Reactive	L3MBTL3	45	45
C#CCCOc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872314382	CD	On-Demand	Mild	L3MBTL3	37	40
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	CELA1	20	48
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	PREP	66	57
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	LGMN	64	40
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	TGM2	24	41
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	KLK5	42	45
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	F13A1	28	41
O=C([C@@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314389	FD	On-Demand	Anodyne	SLC12A5	58	36
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	CELA1	20	48
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	PREP	66	57
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	LGMN	64	40
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	TGM2	24	41
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	KLK5	42	45
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	F13A1	28	41
O=C([C@H]1COCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314390	FD	On-Demand	Anodyne	SLC12A5	58	36
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872314391	EE	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872314392	EE	On-Demand	Anodyne	GPR119	31	41
CN1CCN(C(=O)[C@H]2CCCCN2)Cc2cccnc21	ZINC000872314400	CD	On-Demand	Anodyne	CCR4	20	41
CN1CCN(C(=O)[C@@H]2CCCCN2)Cc2cccnc21	ZINC000872314401	CD	On-Demand	Anodyne	CCR4	20	41
CC(=O)Nc1ccccc1C(F)(F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314411	DD	On-Demand	Anodyne	RBP4	84	39
CN1CCN(C(=O)[C@@H](N)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872314424	FF	On-Demand	Anodyne	TRPV1	25	44
CN1CCN(C(=O)[C@@H](N)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872314424	FF	On-Demand	Anodyne	AKT3	23	43
CN1CCN(C(=O)[C@H](N)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872314425	FF	On-Demand	Anodyne	TRPV1	25	44
CN1CCN(C(=O)[C@H](N)c2ccc(C(F)(F)F)cc2)Cc2cccnc21	ZINC000872314425	FF	On-Demand	Anodyne	AKT3	23	43
O=C(c1cccc(S(=O)(=O)C(F)F)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872314441	ED	On-Demand	Anodyne	AKR1C3	47	42
C=C(Cl)C[C@@H](N)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314446	CD	On-Demand	Mild	DPP8	29	42
C=C(Cl)C[C@H](N)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314447	CD	On-Demand	Mild	DPP8	29	42
COc1cc(N)c(Cl)cc1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314479	CD	On-Demand	Anodyne	HTR4	116	53
O=C(Cc1cc2cc(Cl)ccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872314480	DE	On-Demand	Anodyne	PYGL	69	40
O=C(c1ccccc1NCC(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872314486	DE	On-Demand	Anodyne	RBP4	66	37
COc1cccc(C[C@H](N)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872314489	ED	On-Demand	Anodyne	DPP7	30	49
COc1cccc(C[C@H](N)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872314489	ED	On-Demand	Anodyne	AKT1	19	50
COc1cccc(C[C@@H](N)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872314490	ED	On-Demand	Anodyne	DPP7	30	49
COc1cccc(C[C@@H](N)C(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000872314490	ED	On-Demand	Anodyne	AKT1	19	50
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314502	DD	On-Demand	Anodyne	SLC6A3	15	43
O=C([C@@H]1CNC[C@H]1c1ccc(Cl)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872314502	DD	On-Demand	Anodyne	MC4R	32	42
O=C(CN1CCCC[C@@H](OCc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314526	FD	On-Demand	Anodyne	ACE	30	48
O=C(CN1CCCC[C@@H](OCc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314526	FD	On-Demand	Anodyne	PREP	53	39
O=C(CN1CCCC[C@H](OCc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314527	FD	On-Demand	Anodyne	ACE	30	48
O=C(CN1CCCC[C@H](OCc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314527	FD	On-Demand	Anodyne	PREP	53	39
CO/C(=C\c1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314541	CD	On-Demand	Anodyne	TLR4	28	46
CO/C(=C/c1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314542	CD	On-Demand	Anodyne	TLR4	28	46
CC(C)(C)OC(=O)N1CCC(n2nncc2C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872314577	GD	On-Demand	Anodyne	MTOR	18	40
CC(C)(C)OC(=O)N1CCC(n2nncc2C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872314577	GD	On-Demand	Anodyne	GPR119	44	44
CN1CCN(C(=O)c2ccc(F)cc2N)Cc2cccnc21	ZINC000872314587	DD	On-Demand	Anodyne	P2RX7	26	47
CCOC(=O)[C@@H](N)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314591	CB	On-Demand	Anodyne	DPP8	22	41
O=C(/C=C/c1cccc(O)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872314597	CD	On-Demand	Anodyne	ITGAL	65	40
O=C(/C=C\c1cccc(O)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872314598	CD	On-Demand	Anodyne	ITGAL	65	40
CC(C)(C)OC(=O)N1CCC(C#CC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872314609	ED	On-Demand	Mild	GPR119	28	40
O=C(CCc1cc(C(F)(F)F)ccc1Br)N1C[C@H]2COC[C@H]2C1	ZINC000872314613	GH	On-Demand	Anodyne	LIPG	40	33
CN1CCN(C(=O)[C@@H]2CNC[C@H]2c2ccc(Cl)cc2)Cc2cccnc21	ZINC000872314617	FF	On-Demand	Anodyne	MC4R	32	42
CN1CCN(C(=O)[C@H]2C[C@@H](O)CN2)Cc2cccnc21	ZINC000872314632	CB	On-Demand	Anodyne	DPP8	15	40
O=C(CCc1ccccc1)NC1CCN(C(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872314634	GE	On-Demand	Anodyne	C3AR1	43	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314655	FE	On-Demand	Anodyne	GHRHR	48	33
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314655	FE	On-Demand	Anodyne	TGM2	27	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314655	FE	On-Demand	Anodyne	F13A1	31	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314655	FE	On-Demand	Anodyne	SLC12A5	68	38
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314657	FE	On-Demand	Anodyne	GHRHR	48	33
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314657	FE	On-Demand	Anodyne	TGM2	27	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314657	FE	On-Demand	Anodyne	F13A1	31	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000872314657	FE	On-Demand	Anodyne	SLC12A5	68	38
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3C[C@H]4COC[C@H]4C3)ccc21	ZINC000872314672	FG	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)N3C[C@H]4COC[C@H]4C3)cc21	ZINC000872314678	FF	On-Demand	Anodyne	GPR119	31	42
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc2nc(C(F)(F)F)[nH]c2c1	ZINC000872314708	FF	On-Demand	Anodyne	MCHR1	16	40
O=C(N1C[C@H]2COC[C@H]2C1)C(F)(F)Cc1ccccc1	ZINC000872314731	CD	On-Demand	Anodyne	RBP4	54	35
CN(C)CCc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872314743	CD	On-Demand	Anodyne	L3MBTL3	47	40
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314844	FD	On-Demand	Anodyne	TGM2	22	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314844	FD	On-Demand	Anodyne	F13A1	25	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314844	FD	On-Demand	Anodyne	SLC12A5	67	39
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314845	FD	On-Demand	Anodyne	TGM2	22	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314845	FD	On-Demand	Anodyne	F13A1	25	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314845	FD	On-Demand	Anodyne	SLC12A5	67	39
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314846	FD	On-Demand	Anodyne	TGM2	22	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314846	FD	On-Demand	Anodyne	F13A1	25	41
C[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314846	FD	On-Demand	Anodyne	SLC12A5	67	39
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314847	FD	On-Demand	Anodyne	TGM2	22	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314847	FD	On-Demand	Anodyne	F13A1	25	41
C[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000872314847	FD	On-Demand	Anodyne	SLC12A5	67	39
O=C(N[C@@H]1[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)[C@H]2C=C[C@H]1C2)OCc1ccccc1	ZINC000872314872	GE	On-Demand	Anodyne	CTSK	18	44
O=C(N[C@@H]1[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)[C@H]2C=C[C@H]1C2)OCc1ccccc1	ZINC000872314872	GE	On-Demand	Anodyne	CTSL	25	44
O=C(N[C@@H]1[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)[C@H]2C=C[C@H]1C2)OCc1ccccc1	ZINC000872314872	GE	On-Demand	Anodyne	NAAA	47	47
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314883	ED	On-Demand	Anodyne	PREP	18	43
CN(CC(=O)N1C[C@H]2COC[C@H]2C1)C(=O)OCc1ccccc1	ZINC000872314941	DD	On-Demand	Anodyne	SLC12A5	67	34
CC[C@@H](C)[C@H](N)C(=O)N1CCN(C)c2ncccc2C1	ZINC000872314947	CD	On-Demand	Anodyne	DPP8	26	62
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1nc2ccccc2s1	ZINC000872314953	DF	On-Demand	Anodyne	CSNK1D	39	47
CC(=O)Nc1cccnc1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872314986	CC	On-Demand	Anodyne	G2YM83_BOTF4	44	31
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1nccs1	ZINC000872315030	CD	On-Demand	Anodyne	MAP1	91	39
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872315044	FF	On-Demand	Anodyne	HRH4	27	47
O=C(c1cc(=O)c2cc(Br)ccc2o1)N1C[C@H]2COC[C@H]2C1	ZINC000872315060	FE	On-Demand	Anodyne	GPR35	49	35
O=C(N1C[C@H]2COC[C@H]2C1)C(F)(F)c1ccccc1Br	ZINC000872315077	EF	On-Demand	Anodyne	RBP4	59	34
CC(C)(C)OC(=O)N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872315092	EE	On-Demand	Anodyne	CTSK	16	47
CC(C)(C)OC(=O)N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872315092	EE	On-Demand	Anodyne	FPR1	44	35
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1nc2c(s1)CCCC2	ZINC000872315098	DE	On-Demand	Anodyne	SLC27A1	31	41
O=C(CCN[C@]12CCC[C@H]1OCC2)Nc1ccc(N2CCOCC2)cc1	ZINC000872315113	FE	On-Demand	Anodyne	MTOR	44	35
O=C(CCN[C@]12CCC[C@H]1OCC2)Nc1ccc(N2CCOCC2)cc1	ZINC000872315113	FE	On-Demand	Anodyne	STAT6	43	33
O=C(CCN[C@]12CCC[C@H]1OCC2)OCc1ccccc1	ZINC000872315119	CE	On-Demand	Anodyne	SLC12A5	73	39
CN(CCC(=O)N1C[C@H]2COC[C@H]2C1)C(=O)OCc1ccccc1	ZINC000872315144	ED	On-Demand	Anodyne	NPR	51	33
O=C(Nc1ccccc1)c1cccc(CN[C@]23CCC[C@H]2OCC3)c1	ZINC000872315152	EH	On-Demand	Anodyne	KCNK3	83	39
O=C(c1ccc(OC(F)(F)Cl)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315157	DF	On-Demand	Anodyne	L3MBTL3	40	43
C=CC(=O)Nc1cccc(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872315165	CD	On-Demand	Anodyne	EGFR	23	42
C=CC(=O)Nc1cccc(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872315165	CD	On-Demand	Anodyne	TGM2	59	37
C=CC(=O)Nc1cccc(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872315165	CD	On-Demand	Anodyne	F13A1	94	41
N#C[C@H](c1cccs1)N1CCN(C(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872315203	FD	On-Demand	Mild	PTAFR	29	40
N#C[C@@H](c1cccs1)N1CCN(C(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872315206	FD	On-Demand	Mild	PTAFR	29	40
O=C(CN[C@]12CCC[C@H]1OCC2)NOCc1ccccc1	ZINC000872315233	CD	On-Demand	Anodyne	SLC12A5	61	38
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	F2	41	38
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	ACE	50	49
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	FKBP1A	68	43
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CELA1	28	64
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	GRIN2B	21	41
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	ELANE	26	43
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CTRA_BOVIN	64	34
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	TRY1_BOVIN	54	34
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CTSG	44	34
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CPT1A	30	40
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CPT2	49	39
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	PREP	156	75
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	CELA2A	52	34
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	LGMN	85	51
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	TGM2	27	40
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	KLK5	40	57
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	F13A1	29	40
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	WNT3	42	34
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	SLC12A5	62	40
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315236	ED	On-Demand	Anodyne	TMPRSS11D	58	38
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	GRIN2B	36	47
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	CCR5	16	43
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	PREP	58	50
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	TGM2	37	44
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	KLK5	39	40
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	F13A1	40	44
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315252	ED	On-Demand	Anodyne	SLC12A5	49	39
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	GRIN2B	36	47
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	CCR5	16	43
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	PREP	58	50
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	TGM2	37	44
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	KLK5	39	40
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	F13A1	40	44
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872315253	ED	On-Demand	Anodyne	SLC12A5	49	39
O=C(CN[C@]12CCC[C@H]1OCC2)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000872315257	FE	On-Demand	Mild	CCR2	55	36
N#Cc1c(NC(=O)CCN[C@]23CCC[C@H]2OCC3)sc2c1CCC2	ZINC000872315259	EF	On-Demand	Mild	VIPR1	30	48
O=C(c1cc(=O)c2ccc(F)cc2o1)N1C[C@H]2COC[C@H]2C1	ZINC000872315276	DD	On-Demand	Anodyne	KCNH2	15	47
C[C@@](N)(C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000872315280	DC	On-Demand	Bother	CACNA1C	56	38
C[C@@](N)(C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000872315280	DC	On-Demand	Bother	CACNA1D	85	35
CN1CCN(C(=O)c2ccccc2N)Cc2cccnc21	ZINC000872315322	CD	On-Demand	Anodyne	P2RX7	25	40
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(N2CCCCC2)nc1	ZINC000872315333	EE	On-Demand	Anodyne	DGAT1	38	40
COC(=O)N[C@@H](CC(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315378	CC	On-Demand	Anodyne	CAPN1	17	43
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA2	51	44
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA1	52	44
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA7	32	40
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA5B	31	43
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA4	31	42
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA5A	30	43
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA14	26	40
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA12	36	44
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CA9	43	44
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	CYNT	16	40
NS(=O)(=O)c1ccc(CCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315391	DD	On-Demand	Anodyne	A6YCJ1_9METZ	24	42
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1nc2ccc(F)cc2s1	ZINC000872315423	EF	On-Demand	Anodyne	CSNK1D	45	45
CC[C@@H](C)c1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872315488	CF	On-Demand	Anodyne	L3MBTL3	35	40
C/C(=C/C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000872315522	EG	On-Demand	Anodyne	CACNA1B	54	35
C/C(=C/C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000872315522	EG	On-Demand	Anodyne	CCR2	71	38
CCN1CCC(NC(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872315533	EC	On-Demand	Anodyne	DRD4	21	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	ACE	40	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	GHRHR	61	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	P2RY12	171	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CELA1	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	ELANE	27	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTRA_BOVIN	65	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CASP3	15	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	KLK3	83	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTSB	71	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	PAPA1_CARPA	77	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CYSP_TRYCR	65	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTSG	44	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTSK	59	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTSL	55	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	PREP	16	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CAPNS1	70	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CELA2A	53	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	MMP11	68	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CTSS	35	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CAPN1	92	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CASP1	26	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	CAPN2	144	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	TGM2	41	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	KLK5	41	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	TPSAB1	47	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	NPR	77	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	NAAA	32	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315535	FD	On-Demand	Anodyne	PSMB5	42	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	ACE	40	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	GHRHR	61	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	P2RY12	171	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CELA1	23	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	ELANE	27	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTRA_BOVIN	65	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CASP3	15	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	KLK3	83	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTSB	71	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	PAPA1_CARPA	77	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CYSP_TRYCR	65	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTSG	44	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTSK	59	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTSL	55	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	PREP	16	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CAPNS1	70	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CELA2A	53	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	MMP11	68	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CTSS	35	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CAPN1	92	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CASP1	26	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	CAPN2	144	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	TGM2	41	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	KLK5	41	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	TPSAB1	47	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	NPR	77	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	NAAA	32	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315536	FD	On-Demand	Anodyne	PSMB5	42	41
O=C(c1cccc(C2OCCO2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872315538	CD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315552	EE	On-Demand	Anodyne	HPGD	45	39
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	PGC	54	38
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	PAPA1_CARPA	41	44
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CCKAR	57	38
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CTSK	25	48
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CTSL	30	44
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	TACR3	16	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	REN	73	42
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CTSS	18	44
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CAPN1	16	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	KLK5	23	42
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	FPR1	53	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872315564	FF	On-Demand	Anodyne	CTRB_BOVIN	38	43
O=C(C1CCN(C2CC2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872315575	CC	On-Demand	Anodyne	L3MBTL3	51	35
Cc1cccc(C(=O)NNC(=O)CN[C@]23CCC[C@H]2OCC3)c1	ZINC000872315581	DD	On-Demand	Reactive	KCNK3	45	35
O=C(Cc1ccccc1)OCCN[C@]12CCC[C@H]1OCC2	ZINC000872315585	CE	On-Demand	Anodyne	SLC12A5	46	35
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872315589	FE	On-Demand	Anodyne	GPR119	34	45
O=C(COCc1cccnc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315599	CC	On-Demand	Anodyne	CHRNA7	49	40
O=C(COCc1cccnc1)N1C[C@H]2COC[C@H]2C1	ZINC000872315599	CC	On-Demand	Anodyne	ACHP_LYMST	24	40
c1ccc(CCCCN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872315617	CG	On-Demand	Anodyne	SIGMAR1	16	40
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872315631	GD	On-Demand	Mild	PTAFR	29	43
N#C[C@@H](c1ccc(F)cc1)N1CCN(C(=O)CN[C@]23CCC[C@H]2OCC3)CC1	ZINC000872315632	GD	On-Demand	Mild	PTAFR	29	43
COc1cccc(C2=NO[C@@H](C(=O)N3C[C@H]4COC[C@H]4C3)C2)c1	ZINC000872315648	DD	On-Demand	Anodyne	LUCI_PHOPY	34	47
COc1cccc(C2=NO[C@H](C(=O)N3C[C@H]4COC[C@H]4C3)C2)c1	ZINC000872315649	DD	On-Demand	Anodyne	LUCI_PHOPY	34	47
CCOc1ccccc1NC(=O)CCN[C@]12CCC[C@H]1OCC2	ZINC000872315663	DF	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1NC(=O)CCN[C@]12CCC[C@H]1OCC2	ZINC000872315663	DF	On-Demand	Anodyne	HCN4	42	32
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	ACE	20	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	SSTR2	83	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	GHRHR	33	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MME	26	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	EDNRB	40	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	EDNRA	36	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	TACR1	43	60
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MC4R	48	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	CCKAR	154	60
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	CTSL	24	59
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	PGA	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	BRS3	27	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	NMBR	48	46
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MC3R	61	37
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MC5R	66	33
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MMP2	28	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MMP8	36	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	GRPR	69	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	ECE1	66	46
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	REN	54	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	REN1	28	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	SSTR3	22	52
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MMP11	104	38
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	CCKBR	126	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	GHSR	70	52
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MMP9	26	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MC1R	87	37
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	MMP1	20	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	FPR1	51	55
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	NPR	27	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	KISS1R	66	33
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315676	GF	On-Demand	Anodyne	ERAP2	42	37
O=C(c1ccccc1S(=O)(=O)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872315693	ED	On-Demand	Anodyne	SFRP1	48	36
CCOc1ccccc1C(F)(F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315695	DE	On-Demand	Anodyne	RBP4	45	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315695	DE	On-Demand	Anodyne	HCN1	46	31
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872315714	FD	On-Demand	Anodyne	PKM	33	40
CCCCCCCC[C@H](O)CCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315717	DF	On-Demand	Mild	CQSS	54	35
CCCCCCCC[C@@H](O)CCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315718	DF	On-Demand	Mild	CQSS	54	35
O=C(c1ccccc1N1CCOCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872315744	DD	On-Demand	Anodyne	AKR1C3	16	44
O=C(c1cc2occc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872315804	BD	On-Demand	Anodyne	HRH4	22	43
COC(=O)c1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315808	FD	On-Demand	Anodyne	ACOX1	60	37
COC(=O)c1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315808	FD	On-Demand	Anodyne	ABCB1	76	48
COC(=O)c1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315809	FD	On-Demand	Anodyne	ACOX1	60	37
COC(=O)c1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315809	FD	On-Demand	Anodyne	ABCB1	76	48
CC(C)(C)OC(=O)NC[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872315813	FE	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872315814	FE	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)(n2cccn2)CC1	ZINC000872315816	GD	On-Demand	Anodyne	GPR119	17	41
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872315817	DC	On-Demand	Anodyne	PREP	37	41
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872315818	DC	On-Demand	Anodyne	PREP	37	41
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)cc1	ZINC000872315820	HH	On-Demand	Anodyne	MCHR1	17	41
CN(CCCC(=O)N1C[C@H]2COC[C@H]2C1)C1=NS(=O)(=O)c2ccccc21	ZINC000872315833	GC	On-Demand	Anodyne	KCNA3	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	F2	21	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	ACE	82	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	GHRHR	80	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	P2RY12	44	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CELA1	25	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	MME	93	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	TACR1	17	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTSD	35	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	PGC	69	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	MC4R	67	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CMA1	42	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTRA_BOVIN	44	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	FCER2	43	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTSB	48	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	PAPA1_CARPA	77	54
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	TRY1_BOVIN	25	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CYSP_TRYCR	69	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CCKAR	68	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTSK	55	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTSL	58	54
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CACNA1B	49	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	PGA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	TIMP3	57	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	TACR3	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CAPNS1	60	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	HLA-DRB1	35	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CELA2A	51	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	REN	102	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	REN1	25	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CCKBR	32	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTSS	33	54
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CAPN1	90	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CAPN2	63	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	ACE2	79	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	KLK5	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	FPR1	82	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	CTRB_BOVIN	53	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872315844	FE	On-Demand	Anodyne	BLA1_STEMA	43	33
COc1cccc(C(=O)N2C[C@H]3COC[C@H]3C2)n1	ZINC000872315846	BC	On-Demand	Anodyne	ALS	62	32
CC(=O)c1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315847	FD	On-Demand	Anodyne	ACOX1	70	36
CC(=O)c1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315847	FD	On-Demand	Anodyne	ABCB1	78	49
CC(=O)c1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315848	FD	On-Demand	Anodyne	ACOX1	70	36
CC(=O)c1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872315848	FD	On-Demand	Anodyne	ABCB1	78	49
O=C1OCC[C@@H]1Sc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872315972	ED	On-Demand	Anodyne	L3MBTL3	40	39
O=C1OCC[C@H]1Sc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872315973	ED	On-Demand	Anodyne	L3MBTL3	40	39
O=C([C@@H]1CSC(c2ccccc2O)=N1)N1C[C@H]2COC[C@H]2C1	ZINC000872315975	DD	On-Demand	Anodyne	FPTA	24	43
O=C([C@H]1CSC(c2ccccc2O)=N1)N1C[C@H]2COC[C@H]2C1	ZINC000872315976	DD	On-Demand	Anodyne	FPTA	24	43
O=C(N[C@@H](CO)C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc(F)n1	ZINC000872315987	DB	On-Demand	Anodyne	P2RY12	68	39
C#CCOc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872316014	CD	On-Demand	Mild	L3MBTL3	41	42
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	F2	41	38
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	ACE	50	49
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	FKBP1A	68	43
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CELA1	28	64
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	GRIN2B	21	41
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	ELANE	26	43
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CTRA_BOVIN	64	34
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	TRY1_BOVIN	54	34
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CTSG	44	34
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CPT1A	30	40
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CPT2	49	39
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	PREP	156	75
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	CELA2A	52	34
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	LGMN	85	51
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	TGM2	27	40
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	KLK5	40	57
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	F13A1	29	40
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	WNT3	42	34
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	SLC12A5	62	40
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316042	ED	On-Demand	Anodyne	TMPRSS11D	58	38
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316060	GC	On-Demand	Anodyne	PREP	18	48
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316061	GC	On-Demand	Anodyne	PREP	18	48
COCCc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872316091	ED	On-Demand	Anodyne	ADRB2	26	54
COCCc1ccc(OC[C@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872316091	ED	On-Demand	Anodyne	ADRB1	49	54
COCCc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872316092	ED	On-Demand	Anodyne	ADRB2	26	54
COCCc1ccc(OC[C@@H](O)CN[C@]23CCC[C@H]2OCC3)cc1	ZINC000872316092	ED	On-Demand	Anodyne	ADRB1	49	54
N#Cc1ccccc1OC[C@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316098	DD	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316098	DD	On-Demand	Mild	CASR	41	43
N#Cc1ccccc1OC[C@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316098	DD	On-Demand	Mild	CYP2D6	17	43
N#Cc1ccccc1OC[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316099	DD	On-Demand	Mild	ADRB1	62	42
N#Cc1ccccc1OC[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316099	DD	On-Demand	Mild	CASR	41	43
N#Cc1ccccc1OC[C@@H](O)CN[C@]12CCC[C@H]1OCC2	ZINC000872316099	DD	On-Demand	Mild	CYP2D6	17	43
COC(=O)C1CCN(C(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872316201	EC	On-Demand	Anodyne	CHRM2	15	40
COC(=O)C1CCN(C(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872316201	EC	On-Demand	Anodyne	PTR1	45	32
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316215	CD	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316215	CD	On-Demand	Anodyne	CTSK	18	41
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316232	ED	On-Demand	Anodyne	PAPA1_CARPA	26	51
O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1C[C@H]2COC[C@H]2C1	ZINC000872316249	CC	On-Demand	Bother	CACNA1D	54	34
O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1C[C@H]2COC[C@H]2C1	ZINC000872316250	CC	On-Demand	Bother	CACNA1D	54	34
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316259	DD	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316260	DD	On-Demand	Anodyne	GPR119	35	40
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	CTSB	19	43
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	CTSK	22	43
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	CTSL	28	43
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	CAPN2	44	35
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	NAAA	27	46
O=C(N[C@@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316269	FD	On-Demand	Anodyne	SLC12A5	43	35
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	CTSB	19	43
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	CTSK	22	43
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	CTSL	28	43
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	CAPN2	44	35
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	NAAA	27	46
O=C(N[C@]1(C(=O)N2C[C@H]3COC[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000872316272	FD	On-Demand	Anodyne	SLC12A5	43	35
O=C(Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1)OCC(F)(F)F	ZINC000872316287	FF	On-Demand	Anodyne	EPHX2	31	45
CC(=O)CCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316309	CE	On-Demand	Anodyne	PAOX	43	41
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3C[C@H]4COC[C@H]4C3)ccc21	ZINC000872316373	FF	On-Demand	Anodyne	GPR119	22	46
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316377	DC	On-Demand	Anodyne	PAPA1_CARPA	35	42
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316377	DC	On-Demand	Anodyne	CTSK	15	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872316383	FF	On-Demand	Anodyne	CTSK	24	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872316383	FF	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872316384	FF	On-Demand	Anodyne	CTSK	24	47
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872316384	FF	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872316397	FF	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872316399	FE	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872316408	FE	On-Demand	Anodyne	GPR119	31	41
O=C(c1ccc(C2OCCO2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316413	CD	On-Demand	Anodyne	L3MBTL3	37	43
O=C([C@H](F)Cc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316480	CD	On-Demand	Anodyne	ACE	59	36
O=C([C@H](F)Cc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316480	CD	On-Demand	Anodyne	MME	57	35
O=C([C@@H](F)Cc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316481	CD	On-Demand	Anodyne	ACE	59	36
O=C([C@@H](F)Cc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316481	CD	On-Demand	Anodyne	MME	57	35
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316510	ED	On-Demand	Anodyne	POLG_HCV1	27	49
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316511	ED	On-Demand	Anodyne	POLG_HCV1	27	49
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	MME	49	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	CMA1	48	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	ACE2	59	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	PLM2_PLAFA	44	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	PSMB8	52	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316517	FD	On-Demand	Anodyne	GPR142	52	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	MME	49	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	CMA1	48	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	ACE2	59	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	PLM2_PLAFA	44	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	PSMB8	52	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316519	FD	On-Demand	Anodyne	GPR142	52	34
O=C(CN[C@]12CCC[C@H]1OCC2)Nc1ccc(Cl)c(F)c1	ZINC000872316542	DF	On-Demand	Anodyne	ENV	47	42
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	SLC6A1	51	37
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	CELA1	20	46
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	GRIN2B	23	44
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	CTSL	16	40
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	CCR5	22	46
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	PREP	100	57
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	TGM2	39	43
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	DPP7	54	39
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	KLK5	41	43
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	F13A1	38	43
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316550	FE	On-Demand	Anodyne	SLC12A5	59	40
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	SLC6A1	51	37
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	CELA1	20	46
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	GRIN2B	23	44
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	CTSL	16	40
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	CCR5	22	46
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	PREP	100	57
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	TGM2	39	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	DPP7	54	39
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	KLK5	41	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	F13A1	38	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)C1	ZINC000872316551	FE	On-Demand	Anodyne	SLC12A5	59	40
Cc1oc(-c2ccccc2)nc1CN1CCN(C)c2ncccc2C1	ZINC000872316590	EG	On-Demand	Anodyne	PPARG	61	38
Cc1oc(-c2ccccc2)nc1CN1CCN(C)c2ncccc2C1	ZINC000872316590	EG	On-Demand	Anodyne	PPARA	62	38
Cc1oc(-c2ccccc2)nc1CN1CCN(C)c2ncccc2C1	ZINC000872316590	EG	On-Demand	Anodyne	PDE8B	68	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316591	FC	On-Demand	Anodyne	F2	22	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316591	FC	On-Demand	Anodyne	PREP	21	50
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316592	FC	On-Demand	Anodyne	F2	22	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316592	FC	On-Demand	Anodyne	PREP	21	50
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872316594	FD	On-Demand	Anodyne	GPR119	34	40
O=C(c1ccc(-c2nnc(S)o2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316600	DD	On-Demand	Anodyne	CYP73A16	58	42
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CTSB	39	42
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CYSP_TRYCR	42	42
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CTSK	28	42
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CTSL	39	42
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	PREP	38	56
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CAPN1	48	38
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	CAPN2	85	38
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	TGM2	37	46
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	KLK5	40	44
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	NPR	65	40
O=C(NCCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872316601	EE	On-Demand	Anodyne	NAAA	30	44
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N1C[C@H]3COC[C@H]3C1)=NO2	ZINC000872316613	GD	On-Demand	Anodyne	GPR119	15	50
Nc1nc(Cl)ccc1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872316614	CD	On-Demand	Anodyne	CXCR3	32	42
C[C@@H](CC(=O)N1C[C@H]2COC[C@H]2C1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872316619	FF	On-Demand	Anodyne	GPR119	30	44
COc1ccccc1[C@H](C)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316626	FE	On-Demand	Anodyne	HTR1A	44	37
COc1ccccc1[C@H](C)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316626	FE	On-Demand	Anodyne	DRD4	27	42
COc1ccccc1[C@H](C)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316626	FE	On-Demand	Anodyne	HTR7	42	36
CC(=O)Nc1cccc(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872316636	FD	On-Demand	Anodyne	DRD4	21	48
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)N3C[C@H]4COC[C@H]4C3)cc2CC1	ZINC000872316641	GF	On-Demand	Anodyne	GPR119	38	42
Cc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1F	ZINC000872316642	EE	On-Demand	Anodyne	ABCC1	45	33
Cn1c(=O)c(CN[C@]23CCC[C@H]2OCC3)cc2ccccc21	ZINC000872316663	CE	On-Demand	Anodyne	NPSR1	31	42
c1cc(CN2CCCCC2)ccc1CN[C@]12CCC[C@H]1OCC2	ZINC000872316716	DG	On-Demand	Anodyne	HRH3	18	45
c1ccc(CN2CCCO[C@H](CN[C@]34CCC[C@H]3OCC4)C2)cc1	ZINC000872316752	EF	On-Demand	Anodyne	DRD4	21	45
c1ccc(CN2CCCO[C@@H](CN[C@]34CCC[C@H]3OCC4)C2)cc1	ZINC000872316753	EF	On-Demand	Anodyne	DRD4	21	45
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	HTR1A	51	46
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	DRD2	28	46
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	DRD4	21	41
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	HTR2A	40	46
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	DRD3	35	42
c1ccc(N2CCN(CCCN[C@]34CCC[C@H]3OCC4)CC2)cc1	ZINC000872316766	EE	On-Demand	Anodyne	HTR7	53	42
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872316831	EI	On-Demand	Reactive	L3MBTL3	43	44
O=C(c1ccccc1)N1CC[C@H](CN[C@]23CCC[C@H]2OCC3)C1	ZINC000872316867	DE	On-Demand	Anodyne	L3MBTL3	43	33
O=C(c1ccccc1)N1CC[C@@H](CN[C@]23CCC[C@H]2OCC3)C1	ZINC000872316868	DE	On-Demand	Anodyne	L3MBTL3	43	33
O=C(c1c(C(F)(F)F)ccnc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872316885	DE	On-Demand	Anodyne	RBP4	44	33
CCCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316905	CD	On-Demand	Anodyne	HTR1A	29	42
CCCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316905	CD	On-Demand	Anodyne	HTR2A	17	40
CCCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316905	CD	On-Demand	Anodyne	DRD3	49	39
CCOC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872316910	CD	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1N(CCC(N)=O)C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316931	GD	On-Demand	Anodyne	HTR1A	22	41
C[C@H](C(=O)Nc1ccccc1Cl)N1CCN(C)c2ncccc2C1	ZINC000872316944	EG	On-Demand	Anodyne	EPHB3	53	33
Cc1ccccc1CNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316985	DD	On-Demand	Anodyne	P2RX7	19	42
C/C(=C/C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1C(F)(F)F	ZINC000872316986	EG	On-Demand	Anodyne	RBP4	91	39
C[C@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316995	DD	On-Demand	Anodyne	CHRM2	15	40
C[C@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872316995	DD	On-Demand	Anodyne	CPT1A	86	37
Cc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317022	EE	On-Demand	Anodyne	ACOX1	84	38
Cc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317022	EE	On-Demand	Anodyne	ABCB1	73	45
Cc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317023	EE	On-Demand	Anodyne	ACOX1	84	38
Cc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317023	EE	On-Demand	Anodyne	ABCB1	73	45
CC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872317031	BD	On-Demand	Anodyne	HTR1A	17	44
CC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872317031	BD	On-Demand	Anodyne	DRD4	27	40
CCCCCCCCOCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317033	CE	On-Demand	Mild	UGCG	25	45
CCCCCCCCOCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317033	CE	On-Demand	Mild	CES2	22	45
CCCCCCCCOCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317033	CE	On-Demand	Mild	GBA2	54	45
CCCCCCCCOCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317033	CE	On-Demand	Mild	CES2C	21	45
C[C@@H](NC(=O)CN1CCN(C)c2ncccc2C1)C(=O)N(C)C	ZINC000872317042	DB	On-Demand	Anodyne	ADRA1D	17	40
C[C@H](NC(=O)CN1CCN(C)c2ncccc2C1)C(=O)N(C)C	ZINC000872317043	DB	On-Demand	Anodyne	ADRA1D	17	40
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317049	FD	On-Demand	Anodyne	FKBP1A	71	39
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317049	FD	On-Demand	Anodyne	CPT1A	84	39
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317049	FD	On-Demand	Anodyne	CPT2	46	39
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317049	FD	On-Demand	Anodyne	PREP	49	38
O=C(/C=C/c1ccnc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872317069	CE	On-Demand	Anodyne	ITGAL	42	34
O=C(/C=C\c1ccnc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872317070	CE	On-Demand	Anodyne	ITGAL	42	34
COc1ccc(OC)c([C@H](C)NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317082	GE	On-Demand	Anodyne	DRD2	15	40
COc1ccc(OC)c([C@H](C)NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317082	GE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(OC)c([C@H](C)NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317082	GE	On-Demand	Anodyne	DRD3	22	40
CCOC(=O)N1CCC(NC(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872317129	GD	On-Demand	Anodyne	CHRM1	21	45
CCOC(=O)N1CCC(NC(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872317129	GD	On-Demand	Anodyne	GRIN2B	22	41
CCOC(=O)N1CCC(NC(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872317129	GD	On-Demand	Anodyne	SSTR5	44	35
CCOC(=O)N1CCC(NC(=O)CN2CCN(C)c3ncccc3C2)CC1	ZINC000872317129	GD	On-Demand	Anodyne	CCR8	32	43
COCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317147	CC	On-Demand	Anodyne	HTR1A	35	41
COCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317147	CC	On-Demand	Anodyne	DRD2	39	41
COCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317147	CC	On-Demand	Anodyne	DRD4	28	41
COCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317147	CC	On-Demand	Anodyne	HTR2C	19	41
COCCCNC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317147	CC	On-Demand	Anodyne	DRD3	59	41
CCCCN1CCN(C)c2ncccc2C1	ZINC000872317169	BE	On-Demand	Anodyne	HTR1A	17	40
CCCCN1CCN(C)c2ncccc2C1	ZINC000872317169	BE	On-Demand	Anodyne	DRD2	15	46
CC(=O)Nc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317208	FD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)Nc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317208	FD	On-Demand	Anodyne	ADRB1	45	45
CC(=O)Nc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317208	FD	On-Demand	Anodyne	ADRB3	32	40
CC(=O)Nc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317208	FD	On-Demand	Anodyne	ACOX1	65	44
CC(=O)Nc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317208	FD	On-Demand	Anodyne	ABCB1	75	43
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317209	FD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317209	FD	On-Demand	Anodyne	ADRB1	45	45
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317209	FD	On-Demand	Anodyne	ADRB3	32	40
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317209	FD	On-Demand	Anodyne	ACOX1	65	44
CC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317209	FD	On-Demand	Anodyne	ABCB1	75	43
COc1ccc(CNC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)cc1OC	ZINC000872317210	GE	On-Demand	Anodyne	HCRTR1	15	40
CC(=O)c1ccccc1OCCN1CCN(C)c2ncccc2C1	ZINC000872317225	EF	On-Demand	Anodyne	ADRA1D	15	40
CC(=O)c1ccccc1OCCN1CCN(C)c2ncccc2C1	ZINC000872317225	EF	On-Demand	Anodyne	ABCB1	43	40
CC[C@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317238	DE	On-Demand	Anodyne	CPT1A	72	35
CC[C@@H]1CCCCN1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317239	DE	On-Demand	Anodyne	CPT1A	72	35
CCOC(=O)[C@@H]1CCCN(C(=O)CN2CCN(C)c3ncccc3C2)C1	ZINC000872317245	FD	On-Demand	Anodyne	SLC6A1	63	32
CCNC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872317253	CC	On-Demand	Anodyne	HTR1A	15	40
COC(=O)c1sccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317270	FD	On-Demand	Anodyne	MAPK8	15	51
COC(=O)c1sccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317270	FD	On-Demand	Anodyne	FAS	63	48
C[C@@H]1CCCN(C(=O)CN2CCN(C)c3ncccc3C2)C1	ZINC000872317279	DD	On-Demand	Anodyne	CHRM2	16	44
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317349	EE	On-Demand	Anodyne	CHRM2	15	45
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317349	EE	On-Demand	Anodyne	DRD4	35	58
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317349	EE	On-Demand	Anodyne	TPP2	58	35
Cc1cccc(NC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)c1	ZINC000872317387	DF	On-Demand	Anodyne	KCNK3	42	34
Cc1cccc(NC(=O)[C@@H](C)N2CCN(C)c3ncccc3C2)c1	ZINC000872317388	DF	On-Demand	Anodyne	KCNK3	42	34
CC(=O)c1cccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317413	FD	On-Demand	Anodyne	DRD4	40	31
CC(=O)c1cccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317413	FD	On-Demand	Anodyne	ACOX1	81	39
CC(=O)c1cccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317413	FD	On-Demand	Anodyne	ABCB1	75	59
CC(=O)c1cccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317414	FD	On-Demand	Anodyne	DRD4	40	31
CC(=O)c1cccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317414	FD	On-Demand	Anodyne	ACOX1	81	39
CC(=O)c1cccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317414	FD	On-Demand	Anodyne	ABCB1	75	59
Cc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317417	DD	On-Demand	Anodyne	HTR1A	20	42
Cc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317417	DD	On-Demand	Anodyne	HTR7	21	42
Cc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872317417	DD	On-Demand	Anodyne	NAMPT	15	40
COc1ccc(C)cc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317529	EE	On-Demand	Anodyne	DRD4	32	43
COc1ccc(C)cc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317529	EE	On-Demand	Anodyne	SLC9A1	44	32
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	HTR1A	23	46
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	DRD2	19	46
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	DRD1	16	42
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	DRD3	19	40
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	ADRA2C	16	45
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	HTR7	20	46
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	ABCB1B	66	38
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	ABCB1	28	47
COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ncccc3C1)CC2	ZINC000872317554	GD	On-Demand	Anodyne	ABCG2	38	41
COc1ccccc1COC[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872317557	FD	On-Demand	Anodyne	ABCB1	64	37
COc1ccccc1COC[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872317558	FD	On-Demand	Anodyne	ABCB1	64	37
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCN(C)c2ncccc2C1	ZINC000872317563	GG	On-Demand	Anodyne	TRPV1	30	43
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCN(C)c2ncccc2C1	ZINC000872317563	GG	On-Demand	Anodyne	RBP4	44	31
Cc1cccc(C(C)C)c1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317573	FG	On-Demand	Anodyne	ACOX1	44	32
Cc1cccc(C(C)C)c1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317573	FG	On-Demand	Anodyne	SOAT1	45	36
COC(=O)[C@@H](CC(C)C)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317576	ED	On-Demand	Anodyne	CTSK	30	40
COC(=O)[C@@H](CC(C)C)NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872317576	ED	On-Demand	Anodyne	PLM1_PLAFA	41	31
Cc1ccc(N2CCCC2)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872317586	DE	On-Demand	Anodyne	HCRTR1	53	38
C[C@H](NC(=O)CN1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872317616	EE	On-Demand	Anodyne	P2RX3	19	40
C[C@H](NC(=O)CN1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872317616	EE	On-Demand	Anodyne	PRCP	15	45
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA2	108	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA1	95	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA7	74	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA13	24	41
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA5B	66	43
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA4	65	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA5A	71	43
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA14	56	40
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA12	80	42
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA9	85	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CAH_METTE	24	41
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CYNT	28	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	NCE103	21	44
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	CA15	16	41
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	P96878_MYCTU	40	35
NS(=O)(=O)c1ccc(CC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872317619	DB	On-Demand	Anodyne	A6YCJ1_9METZ	23	41
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCN(C)c2ncccc2C1	ZINC000872317622	FE	On-Demand	Bother	COLA	57	33
C[C@@H](NC(=O)CN1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872317635	EE	On-Demand	Anodyne	P2RX3	19	40
C[C@@H](NC(=O)CN1CCN(C)c2ncccc2C1)c1ccc(F)cc1	ZINC000872317635	EE	On-Demand	Anodyne	PRCP	15	45
C[C@@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCN(C)c2ncccc2C1	ZINC000872317742	FD	On-Demand	Anodyne	CHRM2	15	44
C[C@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCN(C)c2ncccc2C1	ZINC000872317743	FD	On-Demand	Anodyne	CHRM2	15	44
COCCCCN1CCN(C)c2ncccc2C1	ZINC000872317786	BD	On-Demand	Anodyne	HTR1A	31	40
COCCCCN1CCN(C)c2ncccc2C1	ZINC000872317786	BD	On-Demand	Anodyne	DRD2	31	40
COCCCCN1CCN(C)c2ncccc2C1	ZINC000872317786	BD	On-Demand	Anodyne	HTR2A	16	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317810	FF	On-Demand	Anodyne	ALOX5	28	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317810	FF	On-Demand	Anodyne	LTA4H	24	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317810	FF	On-Demand	Anodyne	FFAR1	45	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317811	FF	On-Demand	Anodyne	ALOX5	28	40
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317811	FF	On-Demand	Anodyne	LTA4H	24	40
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872317811	FF	On-Demand	Anodyne	FFAR1	45	43
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317832	EC	On-Demand	Anodyne	CTSK	18	41
CCCCCN1CCN(C)c2ncccc2C1	ZINC000872317833	BF	On-Demand	Anodyne	HTR1A	25	42
CCCCCN1CCN(C)c2ncccc2C1	ZINC000872317833	BF	On-Demand	Anodyne	DRD2	19	42
CN(C)C(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1	ZINC000872317837	DE	On-Demand	Anodyne	HTR1A	17	41
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317842	DD	On-Demand	Anodyne	PREP	45	69
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317842	DD	On-Demand	Anodyne	SFRP1	22	41
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317842	DD	On-Demand	Anodyne	WNT3	33	41
Cc1cccc(C(=O)NNC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317847	FD	On-Demand	Reactive	KCNK3	49	35
Cc1cccc(C(=O)NNC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872317847	FD	On-Demand	Reactive	KCNK9	41	35
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317875	DD	On-Demand	Anodyne	PAPA1_CARPA	33	48
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872317875	DD	On-Demand	Anodyne	CTSK	21	45
COc1ccc2c(CN3CCN(C)c4ncccc4C3)cc(=O)oc2c1	ZINC000872317887	FF	On-Demand	Anodyne	CYP19A1	18	52
COc1ccc2c(CN3CCN(C)c4ncccc4C3)cc(=O)oc2c1	ZINC000872317887	FF	On-Demand	Anodyne	CYP11B1	20	47
COc1ccc2c(CN3CCN(C)c4ncccc4C3)cc(=O)oc2c1	ZINC000872317887	FF	On-Demand	Anodyne	MAOB	32	40
O=C(c1cc2c(Br)cccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872317889	EF	On-Demand	Anodyne	GRIN2B	18	42
O=C(c1cc2c(Br)cccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872317889	EF	On-Demand	Anodyne	HRH4	25	63
C[C@H](C(=O)Nc1nccs1)N1CCN(C)c2ncccc2C1	ZINC000872317900	DD	On-Demand	Anodyne	MAP1	111	38
C[C@@H](C(=O)Nc1nccs1)N1CCN(C)c2ncccc2C1	ZINC000872317901	DD	On-Demand	Anodyne	MAP1	111	38
C[C@H](C(=O)Nc1cccnc1Cl)N1CCN(C)c2ncccc2C1	ZINC000872317940	EE	On-Demand	Anodyne	G2YM83_BOTF4	71	38
CC(=O)Nc1ccc2c(CN3CCN(C)c4ncccc4C3)cc(=O)oc2c1	ZINC000872317961	GF	On-Demand	Anodyne	ABL2	42	34
COC[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872317991	CC	On-Demand	Anodyne	ABCB1	65	39
COC(=O)c1ccc(CN2CCN(C)c3ncccc3C2)c(F)c1	ZINC000872318000	EE	On-Demand	Anodyne	BDKRB1	24	40
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872318003	GF	On-Demand	Anodyne	GPR119	40	43
CCOC[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872318012	CC	On-Demand	Anodyne	ABCB1	60	37
Cc1cc(C)cc(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318014	DF	On-Demand	Anodyne	DRD4	19	48
CNS(=O)(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872318020	CC	On-Demand	Anodyne	HTR7	27	41
CC(=O)Oc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318026	DE	On-Demand	Anodyne	NOD1	16	40
CC(=O)Oc1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318026	DE	On-Demand	Anodyne	NOD2	45	41
O=CNc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318031	CC	On-Demand	Anodyne	L3MBTL3	45	44
CC(=O)c1ccccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872318047	EE	On-Demand	Anodyne	G2YM83_BOTF4	59	34
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318065	ED	On-Demand	Anodyne	PREP	18	43
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318066	FC	On-Demand	Anodyne	PREP	53	50
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318066	FC	On-Demand	Anodyne	TGM2	17	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318066	FC	On-Demand	Anodyne	KLK5	31	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318066	FC	On-Demand	Anodyne	F13A1	26	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318066	FC	On-Demand	Anodyne	Q9NAW4_PLAFA	43	53
Cc1ccc(NC(=O)c2nnc(CN3CCN(C)c4ncccc4C3)s2)cc1	ZINC000872318084	GF	On-Demand	Anodyne	NOD2	42	36
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872318087	FD	On-Demand	Anodyne	GRIN2B	26	44
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872318087	FD	On-Demand	Anodyne	PREP	32	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872318087	FD	On-Demand	Anodyne	TGM2	43	44
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872318087	FD	On-Demand	Anodyne	F13A1	49	44
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000872318087	FD	On-Demand	Anodyne	SLC12A5	42	33
COC(=O)c1ccc2c(O)nc(CN3CCN(C)c4ncccc4C3)nc2c1	ZINC000872318104	GD	On-Demand	Anodyne	ABCG2	17	40
CCOCCCN1CCN(C)c2ncccc2C1	ZINC000872318119	BD	On-Demand	Anodyne	HRH3	23	42
CCOCCCN1CCN(C)c2ncccc2C1	ZINC000872318119	BD	On-Demand	Anodyne	HTR5A	18	40
CC(=O)c1ccc(NC(=O)CCN2CCN(C)c3ncccc3C2)cc1	ZINC000872318163	FF	On-Demand	Anodyne	PRNP	56	39
CC(=O)c1ccc(NC(=O)CCN2CCN(C)c3ncccc3C2)cc1	ZINC000872318163	FF	On-Demand	Anodyne	NOD2	43	37
O=C(c1sc(N2CCCC2)nc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872318172	EE	On-Demand	Anodyne	LIPA	51	32
COC(=O)c1cccc(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318227	FD	On-Demand	Anodyne	FLT4	19	46
CC(C)(C(=O)N1C[C@H]2COC[C@H]2C1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000872318246	GG	On-Demand	Anodyne	ALOX5	22	41
CC(C)(C(=O)N1C[C@H]2COC[C@H]2C1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000872318246	GG	On-Demand	Anodyne	FFAR1	40	42
CC(C)(C(=O)N1C[C@H]2COC[C@H]2C1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000872318247	GG	On-Demand	Anodyne	ALOX5	22	41
CC(C)(C(=O)N1C[C@H]2COC[C@H]2C1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000872318247	GG	On-Demand	Anodyne	FFAR1	40	42
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318267	EE	On-Demand	Anodyne	CTSD	17	40
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318267	EE	On-Demand	Anodyne	CTSK	16	44
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318267	EE	On-Demand	Anodyne	ECE1	37	40
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318267	EE	On-Demand	Anodyne	PGA5	22	40
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318267	EE	On-Demand	Anodyne	POLG_HCV1	22	41
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318268	EE	On-Demand	Anodyne	CTSD	17	40
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318268	EE	On-Demand	Anodyne	CTSK	16	44
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318268	EE	On-Demand	Anodyne	ECE1	37	40
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318268	EE	On-Demand	Anodyne	PGA5	22	40
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318268	EE	On-Demand	Anodyne	POLG_HCV1	22	41
CSc1ccc(NC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318289	EF	On-Demand	Anodyne	IMDH_CRYPV	23	41
CSc1ccc(NC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318289	EF	On-Demand	Anodyne	NOD2	33	45
O=C(/C=C\c1ccc(O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318297	CD	On-Demand	Anodyne	F3	26	47
O=C(/C=C\c1ccc(O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318297	CD	On-Demand	Anodyne	SSSIM	15	45
O=C(/C=C/c1ccc(O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318298	CD	On-Demand	Anodyne	F3	26	47
O=C(/C=C/c1ccc(O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872318298	CD	On-Demand	Anodyne	SSSIM	15	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318306	DD	On-Demand	Anodyne	PREP	54	71
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318306	DD	On-Demand	Anodyne	SFRP1	23	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318306	DD	On-Demand	Anodyne	WNT3	33	41
O=C(/C=C/c1cccc(OC2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872318318	EG	On-Demand	Anodyne	ITGAL	36	44
O=C(/C=C\c1cccc(OC2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872318319	EG	On-Demand	Anodyne	ITGAL	36	44
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318321	CD	On-Demand	Anodyne	CTSK	16	41
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	DRD2	15	43
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	LTA4H	35	44
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	HRH3	17	48
COc1cccc(OCCN2CCN(C)c3ncccc3C2)c1	ZINC000872318331	DE	On-Demand	Anodyne	ABCB1	15	45
COC(=O)[C@@H](c1ccccc1)N1CCN(C)c2ncccc2C1	ZINC000872318356	DE	On-Demand	Anodyne	NPY2R	25	42
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3C[C@H]4COC[C@H]4C3)nn2)CC1	ZINC000872318372	GD	On-Demand	Anodyne	GPR119	45	42
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318373	GC	On-Demand	Anodyne	PREP	54	42
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318374	GC	On-Demand	Anodyne	PREP	54	42
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318375	GC	On-Demand	Anodyne	PREP	54	42
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318376	GC	On-Demand	Anodyne	PREP	54	42
C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCN(C)c2ncccc2C1	ZINC000872318381	GF	On-Demand	Mild	VIPR1	26	42
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCN(C)c2ncccc2C1	ZINC000872318382	GF	On-Demand	Mild	VIPR1	26	42
COc1ccccc1/C(C)=C\C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318391	CE	On-Demand	Anodyne	KCNA3	40	38
COc1ccccc1/C(C)=C/C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872318392	CE	On-Demand	Anodyne	KCNA3	40	38
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872318403	ED	On-Demand	Anodyne	PREP	46	43
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872318404	ED	On-Demand	Anodyne	PREP	46	43
COc1ccc(NC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)cc1	ZINC000872318422	EE	On-Demand	Anodyne	P2RY1	24	40
C=CC(=O)NCc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872318440	DD	On-Demand	Anodyne	TGM2	40	38
COc1ccc(NC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)cc1OC	ZINC000872318484	FE	On-Demand	Anodyne	ENPP1	73	42
O=C(CCc1ccc(Cl)c(Cl)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872318506	DG	On-Demand	Anodyne	OPRK1	21	40
O=C(CCc1ccc(Cl)c(Cl)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872318506	DG	On-Demand	Anodyne	SIGMAR1	15	43
CC(=O)N[C@H]1CCCN(C(=O)CN2CCN(C)c3ncccc3C2)C1	ZINC000872318556	EC	On-Demand	Anodyne	CHRM2	15	40
CC(=O)N[C@@H]1CCCN(C(=O)CN2CCN(C)c3ncccc3C2)C1	ZINC000872318557	EC	On-Demand	Anodyne	CHRM2	15	40
CC(=O)c1cccc(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318591	EE	On-Demand	Anodyne	DRD4	19	46
CC(=O)c1cccc(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318591	EE	On-Demand	Anodyne	PRNP	45	35
CCCCNC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872318604	CD	On-Demand	Anodyne	HTR1A	27	44
CCCCNC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872318604	CD	On-Demand	Anodyne	DRD3	27	40
CC(=O)c1ccc(NC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)cc1	ZINC000872318610	FF	On-Demand	Anodyne	TRPV1	18	40
CC(=O)c1ccc(NC(=O)[C@H](C)N2CCN(C)c3ncccc3C2)cc1	ZINC000872318610	FF	On-Demand	Anodyne	PRNP	49	40
CC(=O)c1ccc(NC(=O)[C@@H](C)N2CCN(C)c3ncccc3C2)cc1	ZINC000872318611	FF	On-Demand	Anodyne	TRPV1	18	40
CC(=O)c1ccc(NC(=O)[C@@H](C)N2CCN(C)c3ncccc3C2)cc1	ZINC000872318611	FF	On-Demand	Anodyne	PRNP	49	40
Cc1cccc(CNC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318623	DD	On-Demand	Anodyne	DRD4	19	41
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	HTR1A	48	51
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	DRD2	55	40
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	DRD4	26	40
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	ADRA1D	24	42
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	HTR2A	40	42
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	HTR2C	29	40
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	ADRA1A	35	42
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	DRD3	73	41
CC(=O)NCCCN1CCN(C)c2ncccc2C1	ZINC000872318644	CC	On-Demand	Anodyne	HTR7	46	43
C#Cc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cn1	ZINC000872318655	BC	On-Demand	Mild	L3MBTL3	31	40
CCOC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872318701	CD	On-Demand	Anodyne	DRD4	18	41
CCOC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872318701	CD	On-Demand	Anodyne	HTR7	40	38
COC(=O)c1ccc(C)c(NC(=O)CN2CCN(C)c3ncccc3C2)c1	ZINC000872318705	FE	On-Demand	Anodyne	ACOX1	40	34
COCCCS(=O)(=O)NCCN1CCN(C)c2ncccc2C1	ZINC000872318722	EC	On-Demand	Anodyne	HTR7	24	43
CCOC(=O)N1CCN(C(=O)[C@H](C)N2CCN(C)c3ncccc3C2)CC1	ZINC000872318732	GD	On-Demand	Anodyne	P2RY12	66	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2CCN(C)c3ncccc3C2)CC1	ZINC000872318733	GD	On-Demand	Anodyne	P2RY12	66	36
CCOc1cc(CN2CCN(C)c3ncccc3C2)ccc1[N+](=O)[O-]	ZINC000872318862	EF	On-Demand	Bother	SSTR5	65	38
COc1ccccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872318883	ED	On-Demand	Anodyne	HTR1A	48	39
COc1ccccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872318883	ED	On-Demand	Anodyne	DRD4	35	44
COc1ccccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872318883	ED	On-Demand	Anodyne	ADRA1D	27	42
COc1ccccc1NC(=O)CN1CCN(C)c2ncccc2C1	ZINC000872318883	ED	On-Demand	Anodyne	DRD3	43	37
CN(C)C(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872318892	CD	On-Demand	Anodyne	ADRA1D	16	40
COCCCCCN1CCN(C)c2ncccc2C1	ZINC000872318916	CE	On-Demand	Anodyne	HTR1A	31	42
COCCCCCN1CCN(C)c2ncccc2C1	ZINC000872318916	CE	On-Demand	Anodyne	DRD2	27	42
COCCOc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318935	GD	On-Demand	Anodyne	HTR1A	16	46
COCCOc1ccc(CNC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318935	GD	On-Demand	Anodyne	HTR7	17	46
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CTSB	40	43
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CYSP_TRYCR	38	41
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CTSK	28	43
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CTSL	39	43
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	PREP	39	52
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CAPNS1	43	33
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CAPN1	50	41
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	CAPN2	89	41
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	TGM2	38	44
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	KLK5	40	42
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	NPR	66	39
O=C(NCCCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872318974	ED	On-Demand	Anodyne	NAAA	39	44
CC(=O)c1ccc(NC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318982	EE	On-Demand	Anodyne	PRNP	66	40
CC(=O)c1ccc(NC(=O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872318982	EE	On-Demand	Anodyne	NOD2	42	36
COC[C@@H](C)OC[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319000	DC	On-Demand	Anodyne	ABCB1	43	34
COC[C@@H](C)OC[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319001	DC	On-Demand	Anodyne	ABCB1	43	34
COc1cccc(S(=O)(=O)CCN2CCN(C)c3ncccc3C2)c1	ZINC000872319062	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(S(=O)(=O)CCN2CCN(C)c3ncccc3C2)c1	ZINC000872319062	FD	On-Demand	Anodyne	HTR7	21	41
N#Cc1cccc(OCC(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872319118	CD	On-Demand	Mild	CPT1A	59	43
N#Cc1cccc(OCC(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872319118	CD	On-Demand	Mild	CPT2	41	35
N#Cc1cccc(OCC(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872319118	CD	On-Demand	Mild	CHRNA10	17	44
CCOC(=O)CCCCCN1CCN(C)c2ncccc2C1	ZINC000872319121	DE	On-Demand	Anodyne	HTR1A	32	41
CCOC(=O)CCCCCN1CCN(C)c2ncccc2C1	ZINC000872319121	DE	On-Demand	Anodyne	DRD2	19	41
CCOC(=O)CCCCCN1CCN(C)c2ncccc2C1	ZINC000872319121	DE	On-Demand	Anodyne	DRD4	16	40
CCOC(=O)CCCCCN1CCN(C)c2ncccc2C1	ZINC000872319121	DE	On-Demand	Anodyne	HTR7	51	41
CCOC(=O)CCCCCN1CCN(C)c2ncccc2C1	ZINC000872319121	DE	On-Demand	Anodyne	FAAH	21	41
C#CCCCCCN1CCN(C)c2ncccc2C1	ZINC000872319137	CF	On-Demand	Mild	HTR1A	15	42
CN(C)c1ccc(NC(=O)CCN2CCN(C)c3ncccc3C2)cc1	ZINC000872319150	FE	On-Demand	Anodyne	ABCB1B	41	33
COc1cccc(OC)c1OC[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319161	FD	On-Demand	Anodyne	DRD4	20	41
COc1cccc(OC)c1OC[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319161	FD	On-Demand	Anodyne	ABCB1	79	45
COc1cccc(OC)c1OC[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319162	FD	On-Demand	Anodyne	DRD4	20	41
COc1cccc(OC)c1OC[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319162	FD	On-Demand	Anodyne	ABCB1	79	45
CCOC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319169	CE	On-Demand	Anodyne	HTR1A	31	40
CCOC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319169	CE	On-Demand	Anodyne	DRD2	19	40
CCOC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319169	CE	On-Demand	Anodyne	DRD4	17	41
CCOC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319169	CE	On-Demand	Anodyne	HTR7	47	40
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	CTSB	28	43
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	CTSK	26	43
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	CAPN2	42	34
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	TGM2	33	42
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	NPR	53	33
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	F13A1	29	42
O=C(Nc1ccccc1C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319176	FG	On-Demand	Anodyne	NAAA	26	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	PLG	16	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	ACE	73	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	GHRHR	58	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CELA1	28	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	ELANE	40	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	MME	44	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTRA_BOVIN	63	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CASP3	18	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	BMP1	19	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	KLK3	87	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTSB	76	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	PAPA1_CARPA	80	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CYSP_TRYCR	64	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTSG	43	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTSK	65	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTSL	56	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	PREP	22	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CAPNS1	75	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	HLA-DRB1	41	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CELA2A	51	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	MMP11	50	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTSS	37	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CAPN1	96	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CASP1	29	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CTRC	15	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CAPN2	150	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	PLAU	17	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	CASP9	30	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	TGM2	40	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	KLK5	42	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	TPSAB1	39	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	NPR	83	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	NAAA	53	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	PSMB5	49	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	BIRC2	26	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	Q6PRC7_IXORI	50	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319212	DD	On-Demand	Anodyne	SLC12A5	40	33
N#Cc1ccc(C(=O)NNC(=O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872319220	DB	On-Demand	Reactive	CTRB_BOVIN	44	32
CC(=O)[C@@](C#N)(CCN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872319221	CE	On-Demand	Mild	CYP2J2	43	30
CC(=O)[C@](C#N)(CCN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872319222	CE	On-Demand	Mild	CYP2J2	43	30
CC(C)(C)OC(=O)N1CCN(CCN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319227	ED	On-Demand	Anodyne	GPR119	40	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319249	ED	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319250	ED	On-Demand	Anodyne	GPR119	35	40
O=C(c1ccc(N2CCOC2=O)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319259	DD	On-Demand	Anodyne	L3MBTL3	36	42
CN(CC(=O)N1C[C@H]2COC[C@H]2C1)c1ccc(C(F)(F)F)cc1C=O	ZINC000872319263	FE	On-Demand	Anodyne	LIPG	40	33
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	GRIN2B	38	50
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	CCR5	18	43
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	PREP	59	50
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	TGM2	44	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	KLK5	39	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	F13A1	51	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872319264	FE	On-Demand	Anodyne	SLC12A5	49	42
Cc1cccc(C(=O)NNC(=O)CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872319265	DC	On-Demand	Reactive	KCNK3	56	41
Cc1cccc(C(=O)NNC(=O)CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872319265	DC	On-Demand	Reactive	KCNK9	45	41
O=C(Cc1cccs1)Nc1nc(CC(=O)N2C[C@H]3COC[C@H]3C2)cs1	ZINC000872319277	GE	On-Demand	Anodyne	CA5B	32	41
O=C(Cc1cccs1)Nc1nc(CC(=O)N2C[C@H]3COC[C@H]3C2)cs1	ZINC000872319277	GE	On-Demand	Anodyne	CA5A	32	41
O=C(Cc1cccs1)Nc1nc(CC(=O)N2C[C@H]3COC[C@H]3C2)cs1	ZINC000872319277	GE	On-Demand	Anodyne	ETHR	21	40
Cc1nn(CC(=O)N2C[C@H]3COC[C@H]3C2)c(C)c1Cl	ZINC000872319328	CD	On-Demand	Anodyne	CCR1	19	46
CN(CCN1CCN(C)c2ncccc2C1)Cc1ccccc1	ZINC000872319373	DE	On-Demand	Anodyne	SIGMAR1	24	43
CC(C)(C)OC(=O)N1CC[C@@H](CCN2C[C@H]3COC[C@H]3C2)C1	ZINC000872319403	DE	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](CCN2C[C@H]3COC[C@H]3C2)C1	ZINC000872319404	DE	On-Demand	Anodyne	GPR119	37	40
CN(CC(=O)N1C[C@H]2COC[C@H]2C1)C1=NS(=O)(=O)c2ccccc21	ZINC000872319405	EC	On-Demand	Anodyne	KCNA3	38	45
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	ACE	35	43
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	KLK3	55	33
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CTSB	53	45
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CYSP_TRYCR	51	43
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CTSK	37	45
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CTSL	45	45
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	PREP	28	55
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CAPNS1	60	35
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CAPN1	67	38
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CASP1	24	40
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	CAPN2	111	39
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	TGM2	37	42
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	KLK5	41	38
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	NPR	72	40
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	F13A1	27	41
O=C(NCC(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872319435	DD	On-Demand	Anodyne	NAAA	49	47
O=C(c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319441	GH	On-Demand	Anodyne	LIPE	28	61
O=C(c1ccnc(-n2ccnc2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872319442	CC	On-Demand	Anodyne	NOS2	61	35
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872319454	FC	On-Demand	Anodyne	SFRP1	119	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872319454	FC	On-Demand	Anodyne	WNT3	74	33
CCCCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319458	CG	On-Demand	Mild	LASR	40	34
CCCCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872319458	CG	On-Demand	Mild	CQSS	58	37
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	ACE	22	40
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	CPT1A	37	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	CPT2	50	39
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	PREP	133	70
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	SFRP1	48	44
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	WNT3	55	44
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319459	ED	On-Demand	Anodyne	L3MBTL3	59	40
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	ACE	22	40
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	CPT1A	37	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	CPT2	50	39
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	PREP	133	70
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	SFRP1	48	44
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	WNT3	55	44
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872319460	ED	On-Demand	Anodyne	L3MBTL3	59	40
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872319499	FG	On-Demand	Anodyne	GRIN2B	35	53
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872319499	FG	On-Demand	Anodyne	HRH4	15	40
CNS(=O)(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319686	ED	On-Demand	Anodyne	HTR7	20	40
CNS(=O)(=O)c1ccc(CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319686	ED	On-Demand	Anodyne	NOD2	41	35
COC(=O)c1ccc2nc(CN3CCN(C)c4ncccc4C3)[nH]c2c1	ZINC000872319739	FE	On-Demand	Anodyne	DRD4	23	47
COC(=O)c1ccc2nc(CN3CCN(C)c4ncccc4C3)[nH]c2c1	ZINC000872319739	FE	On-Demand	Anodyne	CXCR4	23	44
COC(=O)c1ccc2nc(CN3CCN(C)c4ncccc4C3)[nH]c2c1	ZINC000872319739	FE	On-Demand	Anodyne	ABCG2	21	42
C[C@@H](NC(=O)CN1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000872319772	DE	On-Demand	Anodyne	PRCP	16	45
CCC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872319804	CE	On-Demand	Anodyne	HTR1A	26	40
CCC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872319804	CE	On-Demand	Anodyne	DRD2	21	40
CCC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872319804	CE	On-Demand	Anodyne	DRD4	16	40
COCCc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319810	FD	On-Demand	Anodyne	ADRB1	23	44
COCCc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319810	FD	On-Demand	Anodyne	ACOX1	45	34
COCCc1ccc(OC[C@@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319810	FD	On-Demand	Anodyne	ABCB1	72	43
COCCc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319811	FD	On-Demand	Anodyne	ADRB1	23	44
COCCc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319811	FD	On-Demand	Anodyne	ACOX1	45	34
COCCc1ccc(OC[C@H](O)CN2CCN(C)c3ncccc3C2)cc1	ZINC000872319811	FD	On-Demand	Anodyne	ABCB1	72	43
CCOP(=O)(OCC)[C@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319812	ED	On-Demand	Anodyne	ADAM9	50	32
CCOP(=O)(OCC)[C@@H](O)CN1CCN(C)c2ncccc2C1	ZINC000872319813	ED	On-Demand	Anodyne	ADAM9	50	32
COC(=O)c1cccc(CN2CCN(C)c3ncccc3C2)c1Cl	ZINC000872319918	EF	On-Demand	Anodyne	G2YM83_BOTF4	45	32
C=C(C)CCN1CCN(C)c2ncccc2C1	ZINC000872319924	BE	On-Demand	Mild	DRD4	20	40
COC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319936	CD	On-Demand	Anodyne	HTR1A	55	41
COC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319936	CD	On-Demand	Anodyne	DRD2	44	41
COC(=O)CCCCN1CCN(C)c2ncccc2C1	ZINC000872319936	CD	On-Demand	Anodyne	HTR7	67	41
CNC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872320018	CC	On-Demand	Anodyne	HTR7	64	39
CNC(=O)CCCN1CCN(C)c2ncccc2C1	ZINC000872320018	CC	On-Demand	Anodyne	CYP2J2	43	30
CCC(=O)CCN1CCN(C)c2ncccc2C1	ZINC000872320024	BD	On-Demand	Anodyne	DRD4	19	41
c1ccc(Cn2cc(CN3C[C@H]4COC[C@H]4C3)nn2)cc1	ZINC000872320110	CD	On-Demand	Anodyne	FIMH	15	45
O=C(N1C[C@H]2COC[C@H]2C1)C(F)(F)c1ccccc1	ZINC000872320132	CD	On-Demand	Anodyne	RBP4	51	34
O=C(CCN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872320137	CD	On-Demand	Anodyne	CTSL	18	43
O=C(CCN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872320137	CD	On-Demand	Anodyne	NPR	56	33
O=C(CCN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872320137	CD	On-Demand	Anodyne	SLC12A5	52	33
O=C(Cn1cccc(C(F)(F)F)c1=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320145	DC	On-Demand	Anodyne	RBP4	51	35
O=S(=O)(CCN1C[C@H]2COC[C@H]2C1)Cc1ccccc1	ZINC000872320146	CD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320147	FD	On-Demand	Anodyne	CNR2	15	56
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320147	FD	On-Demand	Anodyne	L3MBTL3	58	41
O=C1CCCCN1Cc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320164	ED	On-Demand	Anodyne	L3MBTL3	63	45
O=[N+]([O-])c1cccc([C@H](O)CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872320188	CD	On-Demand	Bother	CACNA1D	52	34
O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@H]3COC[C@H]3C2)c1	ZINC000872320189	CD	On-Demand	Bother	CACNA1D	52	34
CCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320203	BE	On-Demand	Mild	LASR	40	34
CCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320203	BE	On-Demand	Mild	CQSS	58	37
O=C(c1ccc(SC(F)(F)F)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320211	DG	On-Demand	Anodyne	L3MBTL3	28	41
CC(C)(C)OC(=O)N1CCC(CC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872320233	EE	On-Demand	Anodyne	GPR119	40	42
C[C@@](O)(C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1C(F)(F)F	ZINC000872320239	EE	On-Demand	Anodyne	HSD11B1	16	45
C[C@@](O)(C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1C(F)(F)F	ZINC000872320239	EE	On-Demand	Anodyne	RBP4	80	39
C[C@@](O)(C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1C(F)(F)F	ZINC000872320239	EE	On-Demand	Anodyne	SFRP1	59	32
C[C@@](O)(C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1C(F)(F)F	ZINC000872320239	EE	On-Demand	Anodyne	WNT3	50	32
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	ACE	26	42
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CELA1	18	41
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTRA_BOVIN	56	33
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	KLK3	72	35
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTSB	61	45
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CYSP_TRYCR	56	44
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTSG	42	33
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTSK	50	45
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTSL	49	45
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	PREP	18	42
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CAPNS1	62	35
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CELA2A	41	33
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CTSS	28	44
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CAPN1	78	42
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CASP1	25	45
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	CAPN2	127	41
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	TGM2	39	43
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	NPR	65	36
O=C(N[C@@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320244	GF	On-Demand	Anodyne	NAAA	18	44
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	ACE	26	42
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CELA1	18	41
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTRA_BOVIN	56	33
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	KLK3	72	35
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTSB	61	45
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CYSP_TRYCR	56	44
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTSG	42	33
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTSK	50	45
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTSL	49	45
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	PREP	18	42
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CAPNS1	62	35
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CELA2A	41	33
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CTSS	28	44
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CAPN1	78	42
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CASP1	25	45
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	CAPN2	127	41
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	TGM2	39	43
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	NPR	65	36
O=C(N[C@H](C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1)OCc1ccccc1	ZINC000872320245	GF	On-Demand	Anodyne	NAAA	18	44
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1C[C@H]2COC[C@H]2C1	ZINC000872320246	EC	On-Demand	Anodyne	LPL	46	37
C[C@@](O)(C(=O)N1C[C@H]2COC[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000872320256	EE	On-Demand	Anodyne	CACNA1B	54	34
O=C1[C@@H](N2C[C@H]3COC[C@H]3C2)CCCN1Cc1ccccc1	ZINC000872320272	DD	On-Demand	Anodyne	SAP2	34	41
O=C1[C@H](N2C[C@H]3COC[C@H]3C2)CCCN1Cc1ccccc1	ZINC000872320273	DD	On-Demand	Anodyne	SAP2	34	41
COc1ccc2c(C)c(CCC(=O)N3C[C@H]4COC[C@H]4C3)c(=O)oc2c1	ZINC000872320280	FE	On-Demand	Anodyne	MAOB	38	49
COc1ccc2c(C)c(CCC(=O)N3C[C@H]4COC[C@H]4C3)c(=O)oc2c1	ZINC000872320280	FE	On-Demand	Anodyne	NQO1	46	47
CC(=O)Oc1ccc(CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320281	CD	On-Demand	Anodyne	LTA4H	16	40
O[C@@H](CN1C[C@H]2COC[C@H]2C1)c1ccccc1Cl	ZINC000872320282	CD	On-Demand	Anodyne	OPRL1	36	40
C=CC(=O)Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320284	CD	On-Demand	Anodyne	TGM2	73	44
C=CC(=O)Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320284	CD	On-Demand	Anodyne	F13A1	108	46
C=CC(=O)Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320284	CD	On-Demand	Anodyne	L3MBTL3	30	40
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1C[C@H]2COC[C@H]2C1	ZINC000872320285	DD	On-Demand	Anodyne	LUCI_PHOPY	24	45
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1C[C@H]2COC[C@H]2C1	ZINC000872320286	DD	On-Demand	Anodyne	LUCI_PHOPY	24	45
O=Cc1cccc(OCC(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320288	CC	On-Demand	Anodyne	CPT2	40	32
CC[C@H](NC(=O)[C@]12CCC[C@H]1OCC2)C(=O)c1ccccc1	ZINC000872320290	DF	On-Demand	Anodyne	TIMP3	73	34
CCCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320295	CF	On-Demand	Mild	LASR	40	34
CCCCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320295	CF	On-Demand	Mild	CQSS	58	37
CC(C)c1ccc2cc(C(=O)N3C[C@H]4COC[C@H]4C3)[nH]c2c1	ZINC000872320311	CG	On-Demand	Anodyne	GRIN2B	19	42
CC(C)c1ccc2cc(C(=O)N3C[C@H]4COC[C@H]4C3)[nH]c2c1	ZINC000872320311	CG	On-Demand	Anodyne	HRH4	31	46
CC(C)(C)OC(=O)N1CCC(CCCN2C[C@H]3COC[C@H]3C2)CC1	ZINC000872320312	EF	On-Demand	Anodyne	GPR119	43	45
NC(=O)[C@@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320323	CB	On-Demand	Anodyne	CHRM2	17	44
NC(=O)[C@@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320323	CB	On-Demand	Anodyne	CHRM3	28	44
NC(=O)[C@@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320323	CB	On-Demand	Anodyne	CYP2J2	46	33
NC(=O)[C@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320324	CB	On-Demand	Anodyne	CHRM2	17	44
NC(=O)[C@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320324	CB	On-Demand	Anodyne	CHRM3	28	44
NC(=O)[C@](O)(CN1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320324	CB	On-Demand	Anodyne	CYP2J2	46	33
O=C(CN1C[C@H]2COC[C@H]2C1)NOCc1ccccc1	ZINC000872320332	CC	On-Demand	Anodyne	NAAA	18	40
COc1ccccc1/C=C(/C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320333	EG	On-Demand	Anodyne	TLR4	19	46
COC(=O)N[C@H](CC(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320348	CC	On-Demand	Anodyne	CAPN1	17	43
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1C[C@H]2COC[C@H]2C1	ZINC000872320371	ED	On-Demand	Anodyne	PIK3CG	19	40
O=C(c1cc2c(Cl)c(Cl)ccc2[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872320372	EG	On-Demand	Anodyne	HRH4	26	63
C[C@H](CN1C[C@H]2COC[C@H]2C1)NC(=O)OC(C)(C)C	ZINC000872320410	CD	On-Demand	Anodyne	CTSK	17	40
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320420	ED	On-Demand	Anodyne	L3MBTL3	30	41
O=C(Cc1ccccc1)OCCN1C[C@H]2COC[C@H]2C1	ZINC000872320430	CD	On-Demand	Anodyne	LTA4H	25	40
O=C(Cc1ccccc1)OCCN1C[C@H]2COC[C@H]2C1	ZINC000872320430	CD	On-Demand	Anodyne	SIGMAR1	18	42
O=C(c1ccc(SC(F)F)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320448	CF	On-Demand	Anodyne	L3MBTL3	32	41
O=C([C@@H]1CC(c2ccccc2)=NO1)N1C[C@H]2COC[C@H]2C1	ZINC000872320457	CD	On-Demand	Anodyne	LUCI_PHOPY	51	40
O=C([C@H]1CC(c2ccccc2)=NO1)N1C[C@H]2COC[C@H]2C1	ZINC000872320458	CD	On-Demand	Anodyne	LUCI_PHOPY	51	40
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA2	102	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA6	21	47
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA1	92	48
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA7	69	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA13	27	47
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA4	60	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA14	49	38
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA12	76	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA9	86	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CAH_METTE	26	47
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CYNT	26	45
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	NCE103	23	50
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	CA15	18	47
NS(=O)(=O)c1ccc(CCN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320462	CC	On-Demand	Anodyne	A6YCJ1_9METZ	25	47
O=C(N/C(=C/c1ccco1)C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320465	FE	On-Demand	Anodyne	ADAM12	23	40
O=C(N/C(=C\c1ccco1)C(=O)N1C[C@H]2COC[C@H]2C1)c1ccccc1	ZINC000872320466	FE	On-Demand	Anodyne	ADAM12	23	40
CCCCSCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320478	BD	On-Demand	Anodyne	CES1	17	42
CCCCSCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320478	BD	On-Demand	Anodyne	EST1_PIG	49	42
COC(=O)Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320481	CD	On-Demand	Anodyne	L3MBTL3	38	40
O=C(N1C[C@H]2COC[C@H]2C1)C(O)(c1ccccc1)c1ccccc1	ZINC000872320482	DE	On-Demand	Anodyne	CHRM2	17	43
O=C(N1C[C@H]2COC[C@H]2C1)C(O)(c1ccccc1)c1ccccc1	ZINC000872320482	DE	On-Demand	Anodyne	CHRM1	18	43
O=C(N1C[C@H]2COC[C@H]2C1)C(O)(c1ccccc1)c1ccccc1	ZINC000872320482	DE	On-Demand	Anodyne	CHRM3	22	43
CCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320498	BE	On-Demand	Anodyne	LASR	40	34
CCCCCCC(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320498	BE	On-Demand	Anodyne	CQSS	58	37
CCOC(=O)Nc1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320508	DD	On-Demand	Anodyne	ACR	45	35
Cc1ccccc1CC(=O)NNC(=O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320512	DC	On-Demand	Reactive	TK	17	41
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA2	16	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA6	23	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA1	16	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA7	23	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA13	41	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3COC[C@H]3C2)ccc1Cl	ZINC000872320528	EC	On-Demand	Anodyne	CA4	15	45
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCCCC2)cc1	ZINC000872320530	EE	On-Demand	Anodyne	SLC27A1	33	40
Cc1cc(C(=O)N2C[C@H]3COC[C@H]3C2)c(C)n1Cc1ccccc1	ZINC000872320533	DF	On-Demand	Anodyne	PLA2G2A	49	35
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320540	GD	On-Demand	Anodyne	CNR2	15	73
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320540	GD	On-Demand	Anodyne	L3MBTL3	63	42
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320550	DD	On-Demand	Anodyne	MAOA	33	42
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320550	DD	On-Demand	Anodyne	MAOB	20	46
O=C(/C=C\c1ccc2c(c1)OCO2)N1C[C@H]2COC[C@H]2C1	ZINC000872320552	CD	On-Demand	Anodyne	ITGAL	22	42
O=C(/C=C\c1ccc2c(c1)OCO2)N1C[C@H]2COC[C@H]2C1	ZINC000872320552	CD	On-Demand	Anodyne	DYRK2	65	35
O=C(/C=C/c1ccc2c(c1)OCO2)N1C[C@H]2COC[C@H]2C1	ZINC000872320553	CD	On-Demand	Anodyne	ITGAL	22	42
O=C(/C=C/c1ccc2c(c1)OCO2)N1C[C@H]2COC[C@H]2C1	ZINC000872320553	CD	On-Demand	Anodyne	DYRK2	65	35
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872320562	GD	On-Demand	Clean	MMP13	21	42
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872320562	GD	On-Demand	Clean	MMP3	26	42
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872320563	GD	On-Demand	Clean	MMP13	21	42
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872320563	GD	On-Demand	Clean	MMP3	26	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CTSD	109	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	PGC	69	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CMA1	33	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CTRA_BOVIN	20	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	PAPA1_CARPA	36	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CTSK	22	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CTSL	24	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	PGA	39	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	BACE2	46	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	REN	97	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	BACE1	81	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	CTRB_BOVIN	38	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	PLM1_PLAFA	23	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	PLM2_PLAFA	47	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320564	GE	On-Demand	Anodyne	Q82323_9DELA	58	30
NS(=O)(=O)c1ccc(Br)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320566	GC	On-Demand	Anodyne	CA2	21	40
NS(=O)(=O)c1ccc(Br)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320566	GC	On-Demand	Anodyne	CA4	18	40
CCCCC[C@@H](C)NC(=O)CN1C[C@H]2COC[C@H]2C1	ZINC000872320578	CD	On-Demand	Anodyne	NOD1	66	35
O=C(c1cc(-c2cccnc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320580	EG	On-Demand	Anodyne	PRS	25	41
O=C(c1cc(-c2cccnc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320580	EG	On-Demand	Anodyne	TACR3	15	41
O=C(c1cc(-c2cccnc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320580	EG	On-Demand	Anodyne	MT-CO2	45	38
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320581	EC	On-Demand	Anodyne	CA2	28	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320581	EC	On-Demand	Anodyne	CA1	27	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320581	EC	On-Demand	Anodyne	CA4	24	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320581	EC	On-Demand	Anodyne	CA9	20	42
CC(=O)c1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@H]4C3)CC2)c(F)c1	ZINC000872320582	GD	On-Demand	Anodyne	NPY2R	45	36
CC(=O)c1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@H]4C3)CC2)c(F)c1	ZINC000872320582	GD	On-Demand	Anodyne	MAPK1	19	46
CC(=O)c1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@H]4C3)CC2)c(F)c1	ZINC000872320582	GD	On-Demand	Anodyne	SLC6A9	25	51
O=C(CN1C[C@H]2COC[C@H]2C1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872320586	FC	On-Demand	Bother	SSTR1	57	48
O=C(CN1C[C@H]2COC[C@H]2C1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872320586	FC	On-Demand	Bother	KCNJ1	24	40
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1C[C@H]2COC[C@H]2C1	ZINC000872320590	FD	On-Demand	Anodyne	RBP4	73	39
Fc1cccc(OCCN2C[C@H]3COC[C@H]3C2)c1	ZINC000872320591	CD	On-Demand	Anodyne	ESR1	41	38
Fc1cccc(OCCN2C[C@H]3COC[C@H]3C2)c1	ZINC000872320591	CD	On-Demand	Anodyne	LTA4H	30	41
Fc1cccc(OCCN2C[C@H]3COC[C@H]3C2)c1	ZINC000872320591	CD	On-Demand	Anodyne	CHRNA10	45	45
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320593	DD	On-Demand	Anodyne	PREP	45	69
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320593	DD	On-Demand	Anodyne	SFRP1	22	41
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872320593	DD	On-Demand	Anodyne	WNT3	33	41
O=C(CCN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872320595	ED	On-Demand	Anodyne	PIK3CA	37	41
O=C(CCN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872320595	ED	On-Demand	Anodyne	MTOR	77	41
O=C(CCN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872320595	ED	On-Demand	Anodyne	EPHX2	24	45
O=C(CCN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872320595	ED	On-Demand	Anodyne	PIK3CG	33	41
O=C(CCN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872320595	ED	On-Demand	Anodyne	STAT6	53	33
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320613	GC	On-Demand	Anodyne	CNR2	16	57
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872320614	GD	On-Demand	Anodyne	AKR1C3	17	42
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872320614	GD	On-Demand	Anodyne	L3MBTL3	21	40
O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872320619	ED	On-Demand	Bother	SLC6A9	20	55
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320622	DF	On-Demand	Anodyne	CPT1A	122	40
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320622	DF	On-Demand	Anodyne	CPT2	48	37
CC[C@@H](C)c1ccc(NC(=O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320625	DF	On-Demand	Anodyne	SCN2A	19	47
COc1ccc2c(CN3C[C@H]4COC[C@H]4C3)cc(=O)oc2c1	ZINC000872320627	DD	On-Demand	Anodyne	CYP19A1	17	55
COc1ccc2c(CN3C[C@H]4COC[C@H]4C3)cc(=O)oc2c1	ZINC000872320627	DD	On-Demand	Anodyne	CYP11B1	18	46
COc1ccc2c(CN3C[C@H]4COC[C@H]4C3)cc(=O)oc2c1	ZINC000872320627	DD	On-Demand	Anodyne	MAOA	40	35
COc1ccc2c(CN3C[C@H]4COC[C@H]4C3)cc(=O)oc2c1	ZINC000872320627	DD	On-Demand	Anodyne	MAOB	39	41
COc1ccc2c(CN3C[C@H]4COC[C@H]4C3)cc(=O)oc2c1	ZINC000872320627	DD	On-Demand	Anodyne	HSD17B3	19	40
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320628	EG	On-Demand	Anodyne	METAP1	51	43
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000872320629	FE	On-Demand	Anodyne	NR2E3	62	33
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA2	47	49
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA1	37	49
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA7	42	49
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA4	23	44
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA14	40	35
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA12	40	49
NS(=O)(=O)c1ccc(OCCC(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320630	EC	On-Demand	Anodyne	CA9	40	49
C[C@H](C(=O)Nc1cccnc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872320632	CD	On-Demand	Anodyne	G2YM83_BOTF4	74	40
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872320638	FE	On-Demand	Anodyne	ITGAL	62	39
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872320639	FE	On-Demand	Anodyne	ITGAL	62	39
O=C(c1cc(=O)c2ccccc2o1)N1C[C@H]2COC[C@H]2C1	ZINC000872320644	CD	On-Demand	Anodyne	TNKS	27	43
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1C[C@H]2COC[C@H]2C1	ZINC000872320648	FD	On-Demand	Anodyne	CCR8	59	33
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1C[C@H]2COC[C@H]2C1	ZINC000872320648	FD	On-Demand	Anodyne	SFRP1	60	34
O=C(COc1ccc2c(c1)CCC2)N1C[C@H]2COC[C@H]2C1	ZINC000872320649	CD	On-Demand	Anodyne	CPT1A	30	40
O=C(COc1ccc2c(c1)CCC2)N1C[C@H]2COC[C@H]2C1	ZINC000872320649	CD	On-Demand	Anodyne	CPT2	45	40
Fc1cccc(-c2nnc(CN3C[C@H]4COC[C@H]4C3)o2)c1	ZINC000872320653	CD	On-Demand	Anodyne	CYP73A16	15	46
O[C@H](CN1C[C@H]2COC[C@H]2C1)c1ccc(F)cc1	ZINC000872320661	CD	On-Demand	Anodyne	SLC6A3	26	45
O[C@@H](CN1C[C@H]2COC[C@H]2C1)c1ccc(F)cc1	ZINC000872320662	CD	On-Demand	Anodyne	SLC6A3	26	45
O=C(c1ccc(C2SCCS2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320663	DF	On-Demand	Anodyne	L3MBTL3	34	42
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCCCCC2)cc1	ZINC000872320669	EF	On-Demand	Anodyne	SLC27A1	33	40
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1cccnc1Cl	ZINC000872320678	CD	On-Demand	Anodyne	G2YM83_BOTF4	73	37
NC(=O)c1ccc(C(=O)N2C[C@H]3COC[C@H]3C2)cc1	ZINC000872320681	CC	On-Demand	Anodyne	L3MBTL3	51	48
CCCCCCCN1C[C@H]2COC[C@H]2C1	ZINC000872320688	BF	On-Demand	Mild	GBA2	43	41
CCCCCCCN1C[C@H]2COC[C@H]2C1	ZINC000872320688	BF	On-Demand	Mild	Q2TU57_MAIZE	15	58
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(-c2ccccc2)cc1	ZINC000872320695	DF	On-Demand	Anodyne	LTA4H	26	41
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(-c2ccccc2)cc1	ZINC000872320695	DF	On-Demand	Anodyne	CHRNA7	23	49
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(-c2ccccc2)cc1	ZINC000872320695	DF	On-Demand	Anodyne	PRNP	39	40
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(-c2ccccc2)cc1	ZINC000872320695	DF	On-Demand	Anodyne	SLC1A1	19	46
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(-c2ccccc2)cc1	ZINC000872320695	DF	On-Demand	Anodyne	SLC1A2	26	46
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320724	GD	On-Demand	Anodyne	CNR2	15	55
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872320724	GD	On-Demand	Anodyne	L3MBTL3	56	40
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320735	EG	On-Demand	Anodyne	PRS	37	45
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320735	EG	On-Demand	Anodyne	TACR3	16	42
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872320735	EG	On-Demand	Anodyne	MT-CO2	49	42
O=C(c1ccc(C2SCCCS2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320741	EG	On-Demand	Anodyne	L3MBTL3	41	43
O=C(c1ccc(N2CCOCC2)nc1)N1C[C@H]2COC[C@H]2C1	ZINC000872320796	DC	On-Demand	Anodyne	HPGDS	15	47
O=c1cc(CN2C[C@H]3COC[C@H]3C2)c2ccc(O)cc2o1	ZINC000872320798	CD	On-Demand	Anodyne	HSD17B3	42	57
CS(=O)(=O)Nc1cccc(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872320815	DC	On-Demand	Anodyne	NR3C2	19	45
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872320818	FF	On-Demand	Bother	SLC6A9	20	50
COc1cccc([C@H](CNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)c1OC	ZINC000872320821	JJ	On-Demand	Anodyne	GRPR	46	32
COc1cccc([C@H](CNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2c[nH]c3ccccc23)c1OC	ZINC000872320825	JJ	On-Demand	Anodyne	GRPR	46	32
O=C(CCn1c(S)nnc1-c1cccs1)N1C[C@H]2COC[C@H]2C1	ZINC000872320828	FD	On-Demand	Anodyne	ETHR	43	39
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872320835	FD	On-Demand	Anodyne	CNR1	16	46
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000872320835	FD	On-Demand	Anodyne	CNR2	29	43
O=C(/C=C/c1ccccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872320850	CE	On-Demand	Anodyne	ITGAL	60	39
O=C(/C=C\c1ccccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872320852	CE	On-Demand	Anodyne	ITGAL	60	39
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872320859	ED	On-Demand	Bother	SLC6A9	20	65
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872320859	ED	On-Demand	Bother	AKR1C3	15	50
O=C(CCSc1nc2ccccc2s1)N1C[C@H]2COC[C@H]2C1	ZINC000872320871	EF	On-Demand	Anodyne	HMOX2	32	43
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1C[C@H]2COC[C@H]2C1	ZINC000872320873	GC	On-Demand	Anodyne	SLC6A9	29	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1C[C@H]2COC[C@H]2C1	ZINC000872320873	GC	On-Demand	Anodyne	PKM	47	39
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCCC2)cc1	ZINC000872320877	DD	On-Demand	Anodyne	MTOR	43	38
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCCC2)cc1	ZINC000872320877	DD	On-Demand	Anodyne	SLC27A1	33	40
COc1cccc([C@H](CNC(=O)c2cc(C)n(-c3cc(C)on3)c2C)c2c[nH]c3ccccc23)c1OC	ZINC000872320890	JK	On-Demand	Anodyne	EDNRB	42	32
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000872321017	DD	On-Demand	Anodyne	GPR119	41	44
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	ZINC000872321021	IE	On-Demand	Anodyne	CA2	20	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	ZINC000872321021	IE	On-Demand	Anodyne	CA1	19	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	ZINC000872321021	IE	On-Demand	Anodyne	CA4	23	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	ZINC000872321021	IE	On-Demand	Anodyne	STAT6	41	33
COc1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872321040	EC	On-Demand	Clean	MMP3	15	40
COc1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000872321040	EC	On-Demand	Clean	SSTR1	53	36
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321053	DD	On-Demand	Anodyne	PREP	54	71
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321053	DD	On-Demand	Anodyne	SFRP1	23	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321053	DD	On-Demand	Anodyne	WNT3	33	41
O=C1C[C@@H](C(=O)N2C[C@H]3COC[C@H]3C2)CN1Cc1ccccc1Cl	ZINC000872321056	ED	On-Demand	Anodyne	P2RX7	19	45
O=C1C[C@H](C(=O)N2C[C@H]3COC[C@H]3C2)CN1Cc1ccccc1Cl	ZINC000872321058	ED	On-Demand	Anodyne	P2RX7	19	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	ACE	50	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	GHRHR	52	32
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CELA1	25	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	ELANE	39	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	MME	34	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTRA_BOVIN	64	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CASP3	17	50
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	BMP1	24	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	KLK3	81	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTSB	76	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	PAPA1_CARPA	83	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CYSP_TRYCR	61	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTSG	43	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTSK	63	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTSL	55	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CCR1	15	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	PGA	22	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CAPNS1	68	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CELA2A	50	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTSS	31	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CAPN1	92	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CASP1	27	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CTRC	15	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CAPN2	149	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	ACE2	43	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CASP6	15	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CASP9	33	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	TGM2	38	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	NPR	73	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	GAG-PRO	49	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	CASP10	37	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	PSMB5	53	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	F2RL1	19	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321060	FE	On-Demand	Anodyne	Q6PRC7_IXORI	29	40
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872321080	GE	On-Demand	Anodyne	PREP	45	51
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000872321080	GE	On-Demand	Anodyne	CFTR	69	42
O=C(c1ccc(S(=O)(=O)C(F)F)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000872321089	ED	On-Demand	Anodyne	L3MBTL3	26	40
Cc1cc(C)c2cc(C(=O)N3C[C@H]4COC[C@H]4C3)[nH]c2c1	ZINC000872321099	CF	On-Demand	Anodyne	HRH4	24	41
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000872321104	GF	On-Demand	Anodyne	NR2E3	64	35
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872321107	GE	On-Demand	Anodyne	CNR2	16	71
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000872321107	GE	On-Demand	Anodyne	L3MBTL3	62	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1	ZINC000872321112	ED	On-Demand	Anodyne	PAPA1_CARPA	26	51
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1	ZINC000872321225	EC	On-Demand	Anodyne	SLC6A9	17	42
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1C[C@H]2COC[C@H]2C1	ZINC000872321250	CC	On-Demand	Anodyne	INHA	21	44
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1C[C@H]2COC[C@H]2C1	ZINC000872321251	CC	On-Demand	Anodyne	INHA	21	44
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	CTSB	20	42
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	CTSK	18	42
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	CTSL	28	42
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	NPR	47	32
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	NAAA	16	43
O=C(CN1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321252	CD	On-Demand	Anodyne	SLC12A5	59	34
CC(=O)c1ccc(OC[C@H](O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872321297	DD	On-Demand	Anodyne	ACOX1	72	32
CC(=O)c1ccc(OC[C@H](O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872321297	DD	On-Demand	Anodyne	ABCB1	61	46
CC(=O)c1ccc(OC[C@@H](O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872321299	DD	On-Demand	Anodyne	ACOX1	72	32
CC(=O)c1ccc(OC[C@@H](O)CN2C[C@H]3COC[C@H]3C2)cc1	ZINC000872321299	DD	On-Demand	Anodyne	ABCB1	61	46
O=C(CN1C[C@H]2COC[C@H]2C1)NNC(=O)c1cccc(Cl)c1	ZINC000872321304	DC	On-Demand	Reactive	CACNA1I	36	42
O=C(/C=C/c1ccccc1F)N1C[C@H]2COC[C@H]2C1	ZINC000872321317	CD	On-Demand	Anodyne	ITGAL	73	35
O=C(/C=C\c1ccccc1F)N1C[C@H]2COC[C@H]2C1	ZINC000872321318	CD	On-Demand	Anodyne	ITGAL	73	35
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1C[C@H]2COC[C@H]2C1	ZINC000872321335	GE	On-Demand	Anodyne	AKR1C3	15	41
O=C(c1cc(Cl)c(Cl)[nH]1)N1C[C@H]2COC[C@H]2C1	ZINC000872321337	CE	On-Demand	Anodyne	HRH4	20	43
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@H]1c1ccccc1	ZINC000872321339	FD	On-Demand	Anodyne	CACNA1C	32	40
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@H]1c1ccccc1	ZINC000872321339	FD	On-Demand	Anodyne	CACNA1D	30	40
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@H]1c1ccccc1	ZINC000872321339	FD	On-Demand	Anodyne	SLC27A4	77	36
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@@H]1c1ccccc1	ZINC000872321340	FD	On-Demand	Anodyne	CACNA1C	32	40
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@@H]1c1ccccc1	ZINC000872321340	FD	On-Demand	Anodyne	CACNA1D	30	40
CCOC(=O)C1=C(CN2C[C@H]3COC[C@H]3C2)NC(=O)N[C@@H]1c1ccccc1	ZINC000872321340	FD	On-Demand	Anodyne	SLC27A4	77	36
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1C[C@H]2COC[C@H]2C1	ZINC000872321341	EE	On-Demand	Bother	SLC6A9	19	57
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872321348	ED	On-Demand	Anodyne	PIK3CA	50	42
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872321348	ED	On-Demand	Anodyne	MTOR	109	42
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872321348	ED	On-Demand	Anodyne	EPHX2	22	47
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872321348	ED	On-Demand	Anodyne	PIK3CG	38	42
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000872321348	ED	On-Demand	Anodyne	STAT6	59	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	F2	28	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	PLG	25	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	ACE	98	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TYR	35	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	OPRM1	45	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	OPRD1	41	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	GHRHR	59	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	P2RY12	48	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CELA1	30	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	MME	104	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	ANPEP	42	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TACR1	19	58
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	MC4R	48	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CMA1	29	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTRA_BOVIN	76	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	FCER2	46	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CASP3	16	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	BMP1	18	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	KLK3	85	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTSB	88	55
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TRY2_BOVIN	48	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	PAPA1_CARPA	91	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TRY1_BOVIN	38	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CYSP_TRYCR	79	57
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CCKAR	17	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTSG	51	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTSK	60	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTSL	64	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	NPFFR2	61	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TIMP3	43	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	PREP	20	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CAPNS1	81	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	MMP3	16	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	ECE1	20	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	HLA-DRB1	40	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CELA2A	69	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	REN	53	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	MMP11	72	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTSS	37	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CAPN1	129	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CASP1	27	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CAPN2	155	55
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	ACE2	77	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TGM2	42	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	KLK5	43	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	TPSAB1	44	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	FPR1	54	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	CTRB_BOVIN	45	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	NPR	76	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	PSMB5	42	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	BLA1_STEMA	48	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	KDM1A	15	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321418	GF	On-Demand	Anodyne	NPFFR1	57	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	F2	28	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	PLG	25	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	ACE	98	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TYR	35	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	OPRM1	45	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	OPRD1	41	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	GHRHR	59	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	P2RY12	48	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CELA1	30	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	MME	104	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	ANPEP	42	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TACR1	19	58
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	MC4R	48	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CMA1	29	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTRA_BOVIN	76	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	FCER2	46	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CASP3	16	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	BMP1	18	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	KLK3	85	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTSB	88	55
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TRY2_BOVIN	48	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	PAPA1_CARPA	91	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TRY1_BOVIN	38	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CYSP_TRYCR	79	57
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CCKAR	17	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTSG	51	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTSK	60	52
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTSL	64	52
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	NPFFR2	61	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TIMP3	43	32
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	PREP	20	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CAPNS1	81	46
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	MMP3	16	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	ECE1	20	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	HLA-DRB1	40	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CELA2A	69	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	REN	53	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	MMP11	72	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTSS	37	52
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CAPN1	129	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CASP1	27	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CAPN2	155	55
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	ACE2	77	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TGM2	42	50
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	KLK5	43	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	TPSAB1	44	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	FPR1	54	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	CTRB_BOVIN	45	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	NPR	76	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	PSMB5	42	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	BLA1_STEMA	48	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	KDM1A	15	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2COC[C@H]2C1)OCc1ccccc1	ZINC000872321420	GF	On-Demand	Anodyne	NPFFR1	57	33
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc2ccccc2c1	ZINC000872321422	CE	On-Demand	Anodyne	IMDH_CRYPV	40	44
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872321431	EH	On-Demand	Anodyne	PRS	40	49
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872321431	EH	On-Demand	Anodyne	TACR3	20	48
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1C[C@H]2COC[C@H]2C1	ZINC000872321431	EH	On-Demand	Anodyne	MT-CO2	52	45
O=C(CN1C[C@H]2COC[C@H]2C1)Nc1ccc2nc(O)[nH]c2c1	ZINC000872321440	DC	On-Demand	Anodyne	NR2E3	51	32
C=CCOc1ccc(/C=C/C(=O)N2C[C@H]3COC[C@H]3C2)cc1OC	ZINC000872321443	EE	On-Demand	Mild	ITGAL	15	41
C=CCOc1ccc(/C=C/C(=O)N2C[C@H]3COC[C@H]3C2)cc1OC	ZINC000872321443	EE	On-Demand	Mild	APP	18	40
C=CCOc1ccc(/C=C\C(=O)N2C[C@H]3COC[C@H]3C2)cc1OC	ZINC000872321444	EE	On-Demand	Mild	ITGAL	15	41
C=CCOc1ccc(/C=C\C(=O)N2C[C@H]3COC[C@H]3C2)cc1OC	ZINC000872321444	EE	On-Demand	Mild	APP	18	40
Cn1ncc2c(N3CCN(C(=O)c4cc(Cl)ccc4[N+](=O)[O-])CC3)ncnc21	ZINC000872321468	HD	On-Demand	Bother	AKT3	40	33
Cn1ncc2c(N3CCN(C(=O)c4cc(S(=O)(=O)N5CCOCC5)ccc4F)CC3)ncnc21	ZINC000872321625	JC	On-Demand	Anodyne	SLC6A9	41	40
Cc1cc([C@@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)c(O)cc1Cl	ZINC000872321653	EH	On-Demand	Anodyne	HTR1F	44	37
Cc1cc([C@@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)c(O)cc1Cl	ZINC000872321653	EH	On-Demand	Anodyne	PRCP	49	34
Cc1cc([C@@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)c(O)cc1Cl	ZINC000872321653	EH	On-Demand	Anodyne	TYK2	44	33
O=C(Nc1cc(F)ccn1)N1CC[C@@H]1C(F)(F)F	ZINC000872321672	CE	On-Demand	Anodyne	MAPK10	16	41
O=C(Nc1cc(F)ccn1)N1CC[C@H]1C(F)(F)F	ZINC000872321673	CE	On-Demand	Anodyne	MAPK10	16	41
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	GRIN2B	31	45
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	CTSK	17	48
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	CTSL	21	48
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	CCR3	37	41
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	EPHX2	42	41
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	TGM2	29	44
O=C(NC1CCN(C(=O)Nc2cc(F)ccn2)CC1)OCc1ccccc1	ZINC000872321705	FG	On-Demand	Anodyne	F13A1	26	44
C[C@@H]1CN(C(=O)Nc2cc(F)ccn2)[C@@H]1C	ZINC000872321733	BE	On-Demand	Anodyne	TYK2	41	34
C[C@H]1CN(C(=O)Nc2cc(F)ccn2)[C@@H]1C	ZINC000872321734	BE	On-Demand	Anodyne	TYK2	41	34
C[C@H]1[C@H](C)CN1C(=O)Nc1cc(F)ccn1	ZINC000872321735	BE	On-Demand	Anodyne	TYK2	41	34
C[C@H]1CN(C(=O)Nc2cc(F)ccn2)[C@H]1C	ZINC000872321736	BE	On-Demand	Anodyne	TYK2	41	34
O=C(NCc1ccnc(N2CCCC2)c1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872321754	JJ	On-Demand	Anodyne	TACR3	17	50
O=C(NCc1ccnc(N2CCCC2)c1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872321754	JJ	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccnc(N2CCCC2)c1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872321754	JJ	On-Demand	Anodyne	CLK2	28	42
O=C(NCc1ccnc(N2CCCC2)c1)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000872321754	JJ	On-Demand	Anodyne	CLK4	25	42
Cn1ncc2c(N3CCN(C(=O)CNC(=O)OCC4c5ccccc5-c5ccccc54)CC3)ncnc21	ZINC000872321789	JF	On-Demand	Anodyne	AKT3	40	35
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCc1ccnc(N2CCCC2)c1	ZINC000872321796	IK	On-Demand	Anodyne	CCR2	40	38
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCc1ccnc(N2CCCC2)c1	ZINC000872321797	IK	On-Demand	Anodyne	CCR2	40	38
Cn1ncc2c(N3CCN(C(=O)c4ccc(Cl)c([N+](=O)[O-])c4)CC3)ncnc21	ZINC000872321840	HD	On-Demand	Bother	PDGFRB	23	48
O=C(NCc1ccnc(N2CCCC2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872321843	JE	On-Demand	Anodyne	CNR2	17	55
O=C(NCc1ccnc(N2CCCC2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872321843	JE	On-Demand	Anodyne	SCN10A	23	40
O=C(NCc1ccnc(N2CCCC2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872321843	JE	On-Demand	Anodyne	NAMPT	55	45
O=C(NCc1ccnc(N2CCCC2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000872321843	JE	On-Demand	Anodyne	RPA1	46	35
O=C(Nc1cc(F)ccn1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000872321856	CE	On-Demand	Anodyne	TYK2	41	32
O=C(Nc1cc(F)ccn1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000872321857	CE	On-Demand	Anodyne	TYK2	41	32
O=C(Nc1cc(F)ccn1)N1CC[C@H]2CSC[C@H]2C1	ZINC000872321858	CE	On-Demand	Anodyne	TYK2	41	32
O=C(Nc1cc(F)ccn1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000872321859	CE	On-Demand	Anodyne	TYK2	41	32
O=C(Nc1cc(F)ccn1)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000872321881	EI	On-Demand	Anodyne	CACNA1H	42	35
O=C(Nc1cc(F)ccn1)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000872321882	EI	On-Demand	Anodyne	CACNA1H	42	35
O=C(Nc1cc(F)ccn1)N1CC[C@@H](O)[C@@H](O)C1	ZINC000872321898	CC	On-Demand	Anodyne	MAPK10	18	41
O=C(Nc1cc(F)ccn1)N1CC[C@@H](O)[C@@H](O)C1	ZINC000872321898	CC	On-Demand	Anodyne	TYK2	46	33
CC(C)(C)OC(=O)CN1CCC(NC(=O)Nc2cc(F)ccn2)CC1	ZINC000872321922	FE	On-Demand	Anodyne	SSTR5	49	38
CC(C)(C)OC(=O)CN1CCC(NC(=O)Nc2cc(F)ccn2)CC1	ZINC000872321922	FE	On-Demand	Anodyne	CCR3	23	40
CC(C)(C)OC(=O)CN1CCC(NC(=O)Nc2cc(F)ccn2)CC1	ZINC000872321922	FE	On-Demand	Anodyne	EPHX2	44	38
C=CCOc1ccc(/C=C/C(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1OC	ZINC000872322009	IE	On-Demand	Mild	PDGFRB	70	45
C=CCOc1ccc(/C=C\C(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1OC	ZINC000872322010	IE	On-Demand	Mild	PDGFRB	70	45
C=C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322052	BE	On-Demand	Mild	FAAH	22	43
CC1=Nc2ccccc2C12CCN(C(=O)Nc1cc(F)ccn1)CC2	ZINC000872322059	EH	On-Demand	Anodyne	CACNA1H	56	35
CC1=Nc2ccccc2C12CCN(C(=O)Nc1cc(F)ccn1)CC2	ZINC000872322059	EH	On-Demand	Anodyne	NPY5R	36	40
O=C(Nc1cc(F)ccn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000872322107	EF	On-Demand	Anodyne	FAAH	30	47
CC[C@@H](NC(=O)Nc1cc(F)ccn1)c1cccc(OC)c1OC	ZINC000872322142	EH	On-Demand	Anodyne	PDGFRA	43	39
O=C(Nc1cc(F)ccn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872322220	EG	On-Demand	Anodyne	SMO	38	40
O=C(Nc1cc(F)ccn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000872322220	EG	On-Demand	Anodyne	ETHR	65	47
O=C(NCCO)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322229	DC	On-Demand	Anodyne	PRKD1	19	42
O=C(NCCO)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322229	DC	On-Demand	Anodyne	MAPK10	15	41
O=C(NCCO)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322229	DC	On-Demand	Anodyne	TYK2	57	36
CN1CCN(C(=O)Nc2cc(F)ccn2)CCC1(C)C	ZINC000872322295	CE	On-Demand	Anodyne	FAAH	21	41
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	HTR1A	21	44
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	ADRA1A	15	42
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	PDGFRB	73	49
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	KDR	40	38
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	FAAH	21	40
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	PDGFRA	44	42
COc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)c(OC)c1	ZINC000872322296	FF	On-Demand	Clean	RBP4	20	41
CN1CCN(C2CCN(C(=O)Nc3cc(F)ccn3)CC2)CC1	ZINC000872322329	DD	On-Demand	Anodyne	HTR1F	84	39
CN1CCN(C2CCN(C(=O)Nc3cc(F)ccn3)CC2)CC1	ZINC000872322329	DD	On-Demand	Anodyne	MAPK14	16	40
CN1CCN(C2CCN(C(=O)Nc3cc(F)ccn3)CC2)CC1	ZINC000872322329	DD	On-Demand	Anodyne	L3MBTL3	75	44
CN1C[C@@H](CNC(=O)Nc2cc(F)ccn2)[C@H](c2ccccc2)C1	ZINC000872322392	EF	On-Demand	Anodyne	CCR5	47	31
O=C(Nc1cc(F)ccn1)N1CCCCC1	ZINC000872322412	BE	On-Demand	Anodyne	MAPK14	17	47
O=C(Nc1cc(F)ccn1)N1CCCCC1	ZINC000872322412	BE	On-Demand	Anodyne	FAAH	22	43
O=C(Nc1cc(F)ccn1)N1CCCCC1	ZINC000872322412	BE	On-Demand	Anodyne	MAPK10	18	47
O=C(Nc1cc(F)ccn1)N1CCCCC1	ZINC000872322412	BE	On-Demand	Anodyne	TYK2	47	33
O=C(Nc1cc(F)ccn1)N1CCC=C(Cl)C1	ZINC000872322423	CF	On-Demand	Anodyne	TYK2	45	31
O=C(Nc1cc(F)ccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000872322441	DG	On-Demand	Anodyne	MAPK10	15	42
O=C(Nc1cc(F)ccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000872322442	DG	On-Demand	Anodyne	MAPK10	15	42
O=C(Nc1cc(F)ccn1)N[C@H]1CCCC[C@H]1F	ZINC000872322525	CF	On-Demand	Anodyne	TYK2	45	34
Cn1cnc(-c2nnc3n2CCN(C(=O)Nc2cc(F)ccn2)C3)c1	ZINC000872322534	ED	On-Demand	Anodyne	P2RX7	25	46
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	SLC6A3	21	41
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	SIGMAR1	29	44
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	MLNR	71	41
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	S1PR1	29	43
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322564	DG	On-Demand	Anodyne	S1PR5	39	43
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)OCCO3)C[C@H]1c1ccc(F)cc1	ZINC000872322566	FF	On-Demand	Anodyne	MLNR	43	34
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)OCCO3)C[C@H]1c1ccc(F)cc1	ZINC000872322566	FF	On-Demand	Anodyne	MCHR1	22	44
O=C(O)[C@@H]1CN(Cc2c(F)cccc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872322573	FH	On-Demand	Anodyne	MC4R	22	45
O=C(Nc1cc(F)ccn1)NC1CC(Nc2ccccc2)C1	ZINC000872322577	DF	On-Demand	Anodyne	TYK2	43	34
O=C(O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322586	EG	On-Demand	Bother	SIGMAR1	18	50
O=C(O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322586	EG	On-Demand	Bother	MLNR	45	38
O=C(O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322586	EG	On-Demand	Bother	KCNJ1	27	42
O=C(Nc1cc(F)ccn1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000872322596	DG	On-Demand	Anodyne	NPY5R	41	45
O=C(Nc1cc(F)ccn1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000872322597	DG	On-Demand	Anodyne	NPY5R	41	45
C[S@](=N)(=O)N1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322619	DC	On-Demand	Anodyne	FAAH	22	42
O=C(O)[C@@H]1CN(Cc2cccc(Br)c2)C[C@H]1c1ccc(F)cc1	ZINC000872322624	GH	On-Demand	Anodyne	SIGMAR1	19	49
O=C(O)[C@@H]1CN(Cc2cccc(Br)c2)C[C@H]1c1ccc(F)cc1	ZINC000872322624	GH	On-Demand	Anodyne	MLNR	43	34
CC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322634	CE	On-Demand	Anodyne	MAPK14	19	44
CC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322634	CE	On-Demand	Anodyne	MAPK10	19	48
CC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322634	CE	On-Demand	Anodyne	TYK2	49	36
O=C(Nc1cc(F)ccn1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000872322656	DH	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1cc(F)ccn1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000872322657	DH	On-Demand	Anodyne	EPHX2	19	43
COCCN(CC1CCN(C)CC1)C(=O)Nc1cc(F)ccn1	ZINC000872322662	DE	On-Demand	Anodyne	ACKR3	59	35
O=CN1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872322695	CC	On-Demand	Anodyne	FAAH	21	40
C#CC(C)(C)NC(=O)Nc1cc(F)ccn1	ZINC000872322712	BD	On-Demand	Mild	TYK2	62	35
O=C(Nc1cc(F)ccn1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000872322731	DF	On-Demand	Anodyne	MAPK10	16	40
O=C(Nc1cc(F)ccn1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000872322732	DF	On-Demand	Anodyne	MAPK10	16	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)Nc1cc(F)ccn1)C2	ZINC000872322764	FF	On-Demand	Anodyne	GPR119	35	40
O=C(Nc1cc(F)ccn1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000872322765	EH	On-Demand	Anodyne	C3AR1	40	40
O=C(Nc1cc(F)ccn1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000872322766	EH	On-Demand	Anodyne	C3AR1	40	40
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2C(=O)Nc1cc(F)ccn1	ZINC000872322772	FG	On-Demand	Anodyne	GPR119	33	41
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@H]21	ZINC000872322785	CD	On-Demand	Anodyne	MAPK14	16	41
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@H]21	ZINC000872322785	CD	On-Demand	Anodyne	MAPK10	17	41
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@H]21	ZINC000872322785	CD	On-Demand	Anodyne	TYK2	55	33
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@@H]21	ZINC000872322786	CD	On-Demand	Anodyne	MAPK14	16	41
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@@H]21	ZINC000872322786	CD	On-Demand	Anodyne	MAPK10	17	41
CN1CC[C@H]2CN(C(=O)Nc3cc(F)ccn3)CC[C@@H]21	ZINC000872322786	CD	On-Demand	Anodyne	TYK2	55	33
O=C(Nc1cc(F)ccn1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000872322795	EF	On-Demand	Anodyne	NPY2R	56	39
O=C(Nc1cc(F)ccn1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000872322795	EF	On-Demand	Anodyne	FAAH	25	49
N#Cc1ccc(N2CCN(C(=O)Nc3cc(F)ccn3)CC2)cn1	ZINC000872322796	ED	On-Demand	Mild	FAAH	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)Nc1cc(F)ccn1	ZINC000872322897	CD	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)Nc1cc(F)ccn1	ZINC000872322898	CD	On-Demand	Anodyne	SLC6A3	45	41
O=C(O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322991	GF	On-Demand	Clean	DRD4	19	41
O=C(O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322991	GF	On-Demand	Clean	PRCP	17	42
O=C(O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322991	GF	On-Demand	Clean	MLNR	52	37
O=C(O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872322991	GF	On-Demand	Clean	STAT6	44	35
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	MAPK14	23	43
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	CCR3	31	43
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	MLNR	26	42
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	FAAH	26	42
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	MAPK10	24	43
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	EPHX2	31	46
O=C(Nc1cc(F)ccn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000872323016	DG	On-Demand	Anodyne	LIPG	19	43
O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323018	GH	On-Demand	Anodyne	SIGMAR1	20	40
O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323018	GH	On-Demand	Anodyne	PRCP	19	43
O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323018	GH	On-Demand	Anodyne	MLNR	54	38
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	TACR1	41	41
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	SIGMAR1	19	50
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	MLNR	53	40
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	MCHR1	19	40
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	CACNA1G	40	40
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	LIPG	39	42
O=C(O)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323030	FI	On-Demand	Anodyne	TRPM8	42	42
O=C(O)[C@@H]1CN(Cc2cc(F)cc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323085	FH	On-Demand	Anodyne	MLNR	47	35
CC(=O)N[C@@H](C)CCCCC(=O)O	ZINC000872323089	AD	On-Demand	Anodyne	FOLH1	24	43
CC(=O)N[C@@H](C)CCCCC(=O)O	ZINC000872323089	AD	On-Demand	Anodyne	WDR5	37	40
CC(=O)N[C@@H](C)CCCCC(=O)O	ZINC000872323089	AD	On-Demand	Anodyne	KDM2A	41	35
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCC3)nc2)C[C@H]1c1ccc(F)cc1	ZINC000872323107	FG	On-Demand	Anodyne	MLNR	49	40
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCC3)nc2)C[C@H]1c1ccc(F)cc1	ZINC000872323107	FG	On-Demand	Anodyne	SLC27A1	48	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323115	FH	On-Demand	Anodyne	MC4R	25	41
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323115	FH	On-Demand	Anodyne	CCR1	23	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323115	FH	On-Demand	Anodyne	PTGDR2	15	42
COc1ccc(OC(F)F)c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323121	GH	On-Demand	Anodyne	EDNRB	42	35
Cc1nn(-c2ccccc2)c(C)c1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323130	GH	On-Demand	Anodyne	P2RX7	20	46
C[C@@H]1CCCC[C@H]1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323134	DH	On-Demand	Anodyne	CCR5	46	43
C[C@@H]1CCCC[C@@H]1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323135	DH	On-Demand	Anodyne	CCR5	46	43
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	SLC6A3	19	40
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	MC4R	27	43
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	SIGMAR1	19	41
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	PRCP	21	46
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	MLNR	60	36
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323136	FH	On-Demand	Anodyne	CACNA1G	24	40
O=C(O)[C@@H]1CN(Cc2ccccc2OCC2CC2)C[C@H]1c1ccc(F)cc1	ZINC000872323142	FH	On-Demand	Anodyne	SLC6A3	19	40
O=C(O)[C@@H]1CN(Cc2ccccc2OCC2CC2)C[C@H]1c1ccc(F)cc1	ZINC000872323142	FH	On-Demand	Anodyne	SIGMAR1	16	42
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	DRD4	16	41
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	HRH3	15	41
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	SIGMAR1	23	42
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	SLC18A3	20	40
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	MLNR	55	38
O=C(O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323146	GI	On-Demand	Clean	S1PR1	24	46
COc1ccccc1-n1nccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323148	GG	On-Demand	Anodyne	HTR1A	50	39
COc1ccccc1-n1nccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323148	GG	On-Demand	Anodyne	DRD2	38	41
COc1ccccc1-n1nccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323148	GG	On-Demand	Anodyne	DRD3	40	41
Cc1cc(F)ccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323149	EH	On-Demand	Anodyne	MLNR	40	38
O=C(O)[C@@H]1CN(Cc2cc(F)cc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323150	EG	On-Demand	Anodyne	MLNR	48	35
O=C(O)[C@@H]1CN(Cc2ccccc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323155	EH	On-Demand	Anodyne	MC4R	15	41
O=C(O)[C@@H]1CN(Cc2ccccc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323155	EH	On-Demand	Anodyne	SIGMAR1	17	42
CSc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323177	EH	On-Demand	Anodyne	SIGMAR1	17	41
CSc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323177	EH	On-Demand	Anodyne	MLNR	63	39
CSc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323177	EH	On-Demand	Anodyne	S1PR1	19	40
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323187	FH	On-Demand	Anodyne	MC4R	34	42
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323187	FH	On-Demand	Anodyne	PRCP	17	45
Cc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323189	DG	On-Demand	Anodyne	SLC6A3	17	40
Cc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323189	DG	On-Demand	Anodyne	CHRM3	15	43
Cc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323189	DG	On-Demand	Anodyne	SIGMAR1	20	40
Cc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323189	DG	On-Demand	Anodyne	MLNR	59	36
Cc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323189	DG	On-Demand	Anodyne	S1PR1	24	44
O=C(Nc1cc(F)ccn1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872323194	DD	On-Demand	Anodyne	MAPK10	15	42
O=C(Nc1cc(F)ccn1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872323195	DD	On-Demand	Anodyne	MAPK10	15	42
O=C(Nc1cc(F)ccn1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000872323196	DD	On-Demand	Anodyne	MAPK10	15	42
O=C(Nc1cc(F)ccn1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000872323197	DD	On-Demand	Anodyne	MAPK10	15	42
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc2ccccc12	ZINC000872323199	GI	On-Demand	Anodyne	KCNH2	16	40
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc2ccccc12	ZINC000872323199	GI	On-Demand	Anodyne	CCR3	27	42
CC(C)c1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323205	EI	On-Demand	Anodyne	MC4R	18	45
CC(C)c1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323205	EI	On-Demand	Anodyne	MLNR	51	36
O=C(O)[C@@H]1CN(Cc2cccc(OC3CC3)c2F)C[C@H]1c1ccc(F)cc1	ZINC000872323213	FH	On-Demand	Anodyne	SLC6A3	29	41
O=C(O)[C@@H]1CN(Cc2nc3c(s2)CCCC3)C[C@H]1c1ccc(F)cc1	ZINC000872323219	FG	On-Demand	Anodyne	SLC27A1	51	43
O=C(O)[C@@H]1CN(Cc2ccc(OC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323221	FH	On-Demand	Anodyne	MLNR	50	38
O=C(O)[C@@H]1CN(Cc2c(F)ccc(F)c2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323222	FI	On-Demand	Anodyne	MC4R	16	41
CCCn1c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)nc2ccccc21	ZINC000872323226	GH	On-Demand	Anodyne	HRH1	36	42
CCCn1c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)nc2ccccc21	ZINC000872323226	GH	On-Demand	Anodyne	GRM2	21	49
C#C[C@@H]1CC[C@@H](NC(=O)Nc2cc(F)ccn2)CC1	ZINC000872323256	CF	On-Demand	Mild	TYK2	55	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)Nc1cc(F)ccn1)CC2	ZINC000872323259	EG	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)Nc1cc(F)ccn1)CC2	ZINC000872323260	EG	On-Demand	Anodyne	SLC18A2	45	32
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	DRD4	34	43
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	SLC6A4	17	42
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	SLC6A3	36	45
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	MC4R	35	49
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	SIGMAR1	27	42
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	PRCP	18	52
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	CCR1	36	48
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	MLNR	63	38
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323265	EH	On-Demand	Anodyne	S1PR1	25	40
CCOCc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323282	GH	On-Demand	Anodyne	TSHR	44	34
CCOCc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323282	GH	On-Demand	Anodyne	MLNR	40	35
COC[C@@H](C)Oc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323283	GH	On-Demand	Anodyne	MLNR	46	37
COC[C@@H](C)Oc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323283	GH	On-Demand	Anodyne	S1PR1	21	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323285	FH	On-Demand	Anodyne	SIGMAR1	30	58
O=C(O)[C@@H]1CN(Cc2ccc(OCC3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323285	FH	On-Demand	Anodyne	MLNR	61	39
O=C(O)[C@@H]1CN(Cc2ccc(OCC3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323285	FH	On-Demand	Anodyne	S1PR1	18	46
O=C(O)[C@@H]1CN(Cc2ccc(Br)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323286	GI	On-Demand	Anodyne	MLNR	45	34
O=C(O)[C@@H]1CN(Cc2ccc(Br)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323286	GI	On-Demand	Anodyne	S1PR1	26	41
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Br)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323287	GI	On-Demand	Anodyne	MLNR	45	34
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Br)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323287	GI	On-Demand	Anodyne	S1PR1	28	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1	ZINC000872323293	FG	On-Demand	Anodyne	SLC6A3	19	40
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1	ZINC000872323293	FG	On-Demand	Anodyne	EDNRA	24	42
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1	ZINC000872323293	FG	On-Demand	Anodyne	SIGMAR1	17	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1	ZINC000872323293	FG	On-Demand	Anodyne	MLNR	52	36
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1	ZINC000872323293	FG	On-Demand	Anodyne	MCHR1	15	45
CC(=O)N[C@@H](CCC(=O)O)c1ccc(Cl)c(Cl)c1	ZINC000872323300	CG	On-Demand	Anodyne	FOLH1	53	33
CC(=O)N[C@@H](CCC(=O)O)c1ccc(Cl)c(Cl)c1	ZINC000872323300	CG	On-Demand	Anodyne	NAALAD2	49	37
CC(=O)N[C@@H](CCC(=O)O)c1ccc(Cl)c(Cl)c1	ZINC000872323300	CG	On-Demand	Anodyne	UTS2	61	33
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	SLC6A3	20	40
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	S1PR4	16	42
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	SLC18A3	23	46
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	MLNR	62	40
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	S1PR1	21	46
O=C(O)[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323308	EI	On-Demand	Anodyne	S1PR5	36	42
O=C(O)[C@@H]1CN(Cc2nc3c(s2)CCC3)C[C@H]1c1ccc(F)cc1	ZINC000872323309	EG	On-Demand	Anodyne	SLC27A1	49	41
O=C(O)[C@@H]1CN(Cc2cc(F)cc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323312	GI	On-Demand	Anodyne	TACR1	74	46
O=C(O)[C@@H]1CN(Cc2cc(F)cc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323312	GI	On-Demand	Anodyne	CCR2	29	41
O=C(O)[C@@H]1CN(Cc2cc3cc(F)ccc3o2)C[C@H]1c1ccc(F)cc1	ZINC000872323324	FI	On-Demand	Anodyne	HRH3	15	45
O=C(O)[C@@H]1CN(Cc2cnn(Cc3ccccc3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323326	GG	On-Demand	Anodyne	MC4R	17	43
O=C(O)[C@@H]1CN(Cc2cnn(Cc3ccccc3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323326	GG	On-Demand	Anodyne	SIGMAR1	23	40
O=C(O)[C@@H]1CN(Cc2cnn(Cc3ccccc3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323326	GG	On-Demand	Anodyne	MLNR	51	35
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	HRH2	36	43
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	PPARG	40	40
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	SIGMAR1	16	42
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	CCR5	40	37
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	MLNR	66	37
CCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323337	FH	On-Demand	Anodyne	S1PR1	26	43
O=C(O)[C@@H]1CN(Cc2ncc(C(F)(F)F)s2)C[C@H]1c1ccc(F)cc1	ZINC000872323341	FH	On-Demand	Anodyne	MLYCD	55	42
O=C(O)[C@@H]1CN(Cc2cccc(OC3CCCC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323343	GI	On-Demand	Anodyne	HRH1	18	42
O=C(O)[C@@H]1CN(Cc2cccc(OC3CCCC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323343	GI	On-Demand	Anodyne	CCR3	54	42
O=C(O)[C@@H]1CN(Cc2cccc(OC3CCCC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323343	GI	On-Demand	Anodyne	CCR5	62	37
O=C(O)[C@@H]1CN(Cc2cccc(OC3CCCC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323343	GI	On-Demand	Anodyne	MLNR	45	43
O=C(O)[C@@H]1CN(Cc2ccc(F)c(Cl)c2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323345	GJ	On-Demand	Anodyne	MC4R	17	40
O=C(O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccc(F)cc1	ZINC000872323349	EG	On-Demand	Bother	CACNA1C	58	38
O=C(O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccc(F)cc1	ZINC000872323349	EG	On-Demand	Bother	SIGMAR1	15	47
O=C(O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccc(F)cc1	ZINC000872323349	EG	On-Demand	Bother	CACNA1D	88	38
N#Cc1ccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)cc1F	ZINC000872323350	EG	On-Demand	Mild	MLNR	44	35
CONC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323356	CD	On-Demand	Anodyne	MAPK14	15	47
CONC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323356	CD	On-Demand	Anodyne	MAPK10	18	47
CONC(=O)C1CCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323356	CD	On-Demand	Anodyne	TYK2	59	38
O=C(O)[C@@H]1CN(Cc2cn(-c3ccc(F)cc3)nn2)C[C@H]1c1ccc(F)cc1	ZINC000872323371	GF	On-Demand	Anodyne	FIMH	24	40
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC(F)F	ZINC000872323377	GH	On-Demand	Anodyne	MLNR	40	33
CCOc1cc(F)cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323383	FH	On-Demand	Anodyne	MLNR	52	37
CCOc1cc(F)cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323383	FH	On-Demand	Anodyne	S1PR1	25	43
CCOc1cc(F)cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323383	FH	On-Demand	Anodyne	S1PR5	32	43
O=C(O)[C@@H]1CN(Cc2ccccc2OC2CCCC2)C[C@H]1c1ccc(F)cc1	ZINC000872323387	GI	On-Demand	Anodyne	MLNR	34	40
C=CCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1OC	ZINC000872323389	GH	On-Demand	Mild	CCR3	18	40
C=CCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1OC	ZINC000872323389	GH	On-Demand	Mild	MLNR	47	35
Cn1cnc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc21	ZINC000872323391	FG	On-Demand	Anodyne	MLNR	51	35
N#CCCCOc1cccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)c1	ZINC000872323395	GH	On-Demand	Mild	HRH2	35	40
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323398	EG	On-Demand	Anodyne	HTR2A	22	41
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323398	EG	On-Demand	Anodyne	MC4R	18	40
CC(=O)[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323407	CE	On-Demand	Anodyne	MAPK14	17	57
CC(=O)[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323407	CE	On-Demand	Anodyne	MAPK10	18	57
CC(=O)[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323407	CE	On-Demand	Anodyne	TYK2	45	34
CC(=O)[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323408	CE	On-Demand	Anodyne	MAPK14	17	57
CC(=O)[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323408	CE	On-Demand	Anodyne	MAPK10	18	57
CC(=O)[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)C1	ZINC000872323408	CE	On-Demand	Anodyne	TYK2	45	34
Cc1csc([C@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)n1	ZINC000872323409	DG	On-Demand	Anodyne	MAPK14	24	41
Cc1csc([C@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)n1	ZINC000872323409	DG	On-Demand	Anodyne	MAPK10	19	41
Cc1csc([C@H]2CCN(C(=O)Nc3cc(F)ccn3)C2)n1	ZINC000872323409	DG	On-Demand	Anodyne	MAP3K12	46	36
O=C(Nc1cc(F)ccn1)N1CCC(CO)(CO)CC1	ZINC000872323416	CC	On-Demand	Anodyne	CACNA1H	43	35
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	DRD2	17	46
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	DRD4	26	46
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	SLC6A3	19	40
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	MC4R	20	47
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	MLNR	59	39
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323418	EH	On-Demand	Anodyne	S1PR1	23	44
CCCNC(=O)c1ccc(NC[C@@H]2CCO[C@H]2c2nccn2CC)cc1Cl	ZINC000872323421	GH	On-Demand	Anodyne	SLC6A9	57	36
O=C(O)[C@@H]1CN(Cc2ccc(CC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323425	GI	On-Demand	Anodyne	MLNR	52	38
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	SLC6A3	25	40
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	EDNRA	31	42
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	SIGMAR1	24	42
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	CCR3	52	45
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	MLNR	58	37
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	S1PR1	31	40
COc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2c1	ZINC000872323427	GI	On-Demand	Anodyne	MCHR1	25	47
O=C(O)[C@@H]1CN(Cc2cc(F)c(F)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323428	FH	On-Demand	Anodyne	S1PR1	20	41
Cc1cc(C(F)(F)F)ccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323436	GI	On-Demand	Anodyne	TACR1	59	40
Cc1cc(C(F)(F)F)ccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323436	GI	On-Demand	Anodyne	LIPG	55	41
O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323456	GI	On-Demand	Anodyne	AKR1B1	21	40
O=C(O)[C@@H]1CN(Cc2ccc(Cl)nc2)C[C@H]1c1ccc(F)cc1	ZINC000872323466	EG	On-Demand	Anodyne	MLNR	55	38
O=C(O)[C@@H]1CN(Cc2ccc(Cl)nc2)C[C@H]1c1ccc(F)cc1	ZINC000872323466	EG	On-Demand	Anodyne	Q8WSF8_APLCA	44	37
O=C(O)[C@@H]1CN(Cc2ccc(Cl)nc2)C[C@H]1c1ccc(F)cc1	ZINC000872323466	EG	On-Demand	Anodyne	NACHRBETA2	47	37
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1SC	ZINC000872323469	GH	On-Demand	Anodyne	MLNR	48	36
O=C(O)[C@@H]1CN(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323476	GI	On-Demand	Anodyne	CACNA1G	33	40
CC(C)c1cc([C@@H]2CCCN(C(=O)Nc3cc(F)ccn3)C2)n[nH]1	ZINC000872323494	EG	On-Demand	Anodyne	MAPK10	15	44
CC(C)c1cc([C@@H]2CCCN(C(=O)Nc3cc(F)ccn3)C2)n[nH]1	ZINC000872323494	EG	On-Demand	Anodyne	MAP3K12	45	42
O=C(Nc1cc(F)ccn1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872323499	EE	On-Demand	Anodyne	ETHR	58	36
O=C(Nc1cc(F)ccn1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872323500	EE	On-Demand	Anodyne	ETHR	58	36
O=C(Nc1cc(F)ccn1)N1CCC2(CCNC2=O)CC1	ZINC000872323502	CD	On-Demand	Anodyne	CACNA1H	65	40
O=C(Nc1cc(F)ccn1)N1CCC2(CCNC2=O)CC1	ZINC000872323502	CD	On-Demand	Anodyne	MAPKAPK2	42	32
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	HTR1D	17	44
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	HTR1B	16	44
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	HTR1F	55	38
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	MAPK14	18	42
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	MAPK10	20	42
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	RBP4	63	46
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	SCD1	16	40
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	MAP3K12	41	39
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323506	EI	On-Demand	Anodyne	ACKR3	57	32
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	HTR1D	17	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	HTR1B	16	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	HTR1F	55	38
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	MAPK14	18	42
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	MAPK10	20	42
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	RBP4	63	46
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	SCD1	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	MAP3K12	41	39
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cc(F)ccn2)CC1	ZINC000872323507	EI	On-Demand	Anodyne	ACKR3	57	32
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323528	FI	On-Demand	Anodyne	MC4R	31	40
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323528	FI	On-Demand	Anodyne	PRCP	15	44
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323528	FI	On-Demand	Anodyne	P2RX7	79	42
O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323528	FI	On-Demand	Anodyne	EPHX2	15	46
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(OC)c1OC	ZINC000872323541	GG	On-Demand	Anodyne	DRD2	30	45
O=C(O)[C@@H]1CN(Cc2c(Cl)cccc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323554	FI	On-Demand	Anodyne	MC4R	15	43
CC(=O)NC[C@@H](Cc1ccccn1)C(=O)O	ZINC000872323555	BC	On-Demand	Anodyne	MME	36	41
CC(=O)NC[C@@H](Cc1ccccn1)C(=O)O	ZINC000872323555	BC	On-Demand	Anodyne	CPA1	51	35
CCCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323557	GH	On-Demand	Anodyne	SIGMAR1	15	44
CCCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323557	GH	On-Demand	Anodyne	MLNR	55	37
CCCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323557	GH	On-Demand	Anodyne	S1PR1	21	43
CCCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323557	GH	On-Demand	Anodyne	S1PR5	19	40
O=C(O)[C@@H]1CN(Cc2cc3ccccc3o2)C[C@H]1c1ccc(F)cc1	ZINC000872323568	EH	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)[C@@H]1CN(Cc2cc3ccccc3o2)C[C@H]1c1ccc(F)cc1	ZINC000872323568	EH	On-Demand	Anodyne	S1PR1	16	40
CC(C)c1nn(C)c(Cl)c1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323571	GH	On-Demand	Anodyne	MC4R	18	40
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	FOLH1	20	43
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	MME	67	45
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	ANPEP	48	34
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	CTSL	19	46
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	CPA1	81	46
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	CTSV	40	46
CC(=O)NC[C@@H](Cc1cccc(Cl)c1)C(=O)O	ZINC000872323574	CD	On-Demand	Anodyne	PDS	49	39
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	SLC6A3	15	41
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	SIGMAR1	29	48
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	PRCP	19	43
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	CCR3	46	38
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	MLNR	64	37
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	SSTR3	15	42
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323580	FI	On-Demand	Anodyne	CACNA1G	26	45
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	DRD2	16	40
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	HRH1	16	40
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	SIGMAR1	20	40
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	SSTR5	72	40
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	CCR3	34	41
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	MLNR	54	35
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	GYS1	45	38
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	S1PR1	24	41
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	S1PR5	21	41
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	MCHR1	15	49
CCOc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323584	FH	On-Demand	Anodyne	CACNA1G	26	43
O=C(O)[C@@H]1CN(Cc2cccc(F)c2F)C[C@H]1c1ccc(F)cc1	ZINC000872323591	EG	On-Demand	Anodyne	MC4R	15	41
O=C(O)[C@@H]1CN(Cc2cc(C(F)(F)F)ccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323594	GI	On-Demand	Anodyne	MC4R	17	44
O=C(O)[C@@H]1CN(Cc2cc(C(F)(F)F)ccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323594	GI	On-Demand	Anodyne	LIPG	53	39
O=C(O)[C@@H]1CN(Cc2ccc(OC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323596	GI	On-Demand	Anodyne	PRCP	15	40
O=C(O)[C@@H]1CN(Cc2ccc(OC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323596	GI	On-Demand	Anodyne	MLNR	50	38
CC(C)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323599	EI	On-Demand	Anodyne	SLC6A4	17	41
CC(C)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323599	EI	On-Demand	Anodyne	SLC6A3	39	40
CC(C)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323599	EI	On-Demand	Anodyne	MC4R	26	46
CC(C)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323599	EI	On-Demand	Anodyne	PRCP	18	43
CC(C)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323599	EI	On-Demand	Anodyne	MLNR	66	43
O=C(O)[C@@H]1CN(Cc2ccc(SC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323604	GI	On-Demand	Anodyne	MLNR	54	35
C=C(C)COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC	ZINC000872323606	GI	On-Demand	Mild	MLNR	40	34
O=C(O)[C@@H]1CN(Cc2cccc(OC(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323610	FH	On-Demand	Anodyne	MLNR	42	35
O=C(O)[C@@H]1CN(Cc2ccc(O[C@H]3CCOC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323611	GG	On-Demand	Anodyne	MLNR	48	44
O=C(O)[C@@H]1CN(Cc2ccc(O[C@@H]3CCOC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323612	GG	On-Demand	Anodyne	MLNR	48	44
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1C	ZINC000872323613	EG	On-Demand	Anodyne	DRD2	20	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1C	ZINC000872323613	EG	On-Demand	Anodyne	CCR3	33	42
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1C	ZINC000872323613	EG	On-Demand	Anodyne	MLNR	52	35
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1C	ZINC000872323613	EG	On-Demand	Anodyne	MCHR1	15	47
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323615	FI	On-Demand	Anodyne	PRCP	15	42
Cc1ncsc1-c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323618	GJ	On-Demand	Anodyne	MLNR	55	39
Cc1ncsc1-c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323618	GJ	On-Demand	Anodyne	VHL	68	38
O=C(O)[C@@H]1CN(Cc2ccc(F)cc2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323621	FH	On-Demand	Anodyne	P2RX7	80	46
CCSc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323623	FI	On-Demand	Anodyne	MLNR	44	33
Cc1ccc(F)c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323631	EH	On-Demand	Anodyne	MC4R	23	43
O=C(O)[C@@H]1CN(Cc2cnn(Cc3ccc(F)cc3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323632	GH	On-Demand	Anodyne	MLNR	55	38
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(Cl)c1OC	ZINC000872323637	GH	On-Demand	Anodyne	DRD2	28	44
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1Cl	ZINC000872323642	FH	On-Demand	Anodyne	DRD2	23	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1Cl	ZINC000872323642	FH	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1Cl	ZINC000872323642	FH	On-Demand	Anodyne	CCR1	43	44
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1Cl	ZINC000872323642	FH	On-Demand	Anodyne	CCR3	31	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1Cl	ZINC000872323642	FH	On-Demand	Anodyne	MLNR	61	36
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323646	FH	On-Demand	Anodyne	SIGMAR1	18	41
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323646	FH	On-Demand	Anodyne	PRCP	17	44
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323646	FH	On-Demand	Anodyne	MLNR	60	36
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323646	FH	On-Demand	Anodyne	S1PR1	27	41
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323646	FH	On-Demand	Anodyne	CXCR3	15	41
O=C(O)[C@@H]1CN(Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323647	GI	On-Demand	Anodyne	MLNR	43	33
O=C(O)[C@@H]1CN(Cc2ccc(F)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323648	EG	On-Demand	Anodyne	SIGMAR1	16	44
O=C(O)[C@@H]1CN(Cc2ccc(F)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323648	EG	On-Demand	Anodyne	MLNR	59	37
O=C(O)[C@@H]1CN(Cc2ccc(F)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323648	EG	On-Demand	Anodyne	S1PR1	27	43
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323649	GH	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323649	GH	On-Demand	Anodyne	MLNR	61	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323649	GH	On-Demand	Anodyne	S1PR1	15	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323649	GH	On-Demand	Anodyne	CACNA1G	17	41
CC[C@@H]1CCC[C@H](CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)C1	ZINC000872323652	EI	On-Demand	Anodyne	SLC6A3	24	40
CC[C@@H]1CCC[C@@H](CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)C1	ZINC000872323653	EI	On-Demand	Anodyne	SLC6A3	24	40
CC[C@H]1CCC[C@H](CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)C1	ZINC000872323654	EI	On-Demand	Anodyne	SLC6A3	24	40
CC[C@H]1CCC[C@@H](CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)C1	ZINC000872323655	EI	On-Demand	Anodyne	SLC6A3	24	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323656	FI	On-Demand	Anodyne	MC4R	18	43
O=C(O)[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323656	FI	On-Demand	Anodyne	SIGMAR1	18	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323656	FI	On-Demand	Anodyne	MLNR	50	35
C=CCOc1ccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)cc1	ZINC000872323665	FH	On-Demand	Mild	SIGMAR1	15	41
C=CCOc1ccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)cc1	ZINC000872323665	FH	On-Demand	Mild	MLNR	54	39
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC(C)C	ZINC000872323666	GH	On-Demand	Anodyne	DRD2	16	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC(C)C	ZINC000872323666	GH	On-Demand	Anodyne	MLNR	41	33
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC(C)C	ZINC000872323666	GH	On-Demand	Anodyne	S1PR1	22	40
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1OC(C)C	ZINC000872323666	GH	On-Demand	Anodyne	S1PR5	19	40
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	FOLH1	15	40
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	MME	61	45
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	ANPEP	54	45
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	TBXAS1	53	49
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	PTAFR	31	40
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	CPA1	78	40
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	LAP3	41	45
CC(=O)NC[C@@H](Cc1cccnc1)C(=O)O	ZINC000872323669	BC	On-Demand	Anodyne	NAMPT	43	40
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	DRD2	17	40
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	HRH2	43	42
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	SLC6A3	16	41
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	MLNR	53	36
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	S1PR1	19	44
COCCCOc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1	ZINC000872323670	GH	On-Demand	Anodyne	MCHR1	15	40
CC(C)(C#N)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323673	FH	On-Demand	Mild	MLNR	68	42
O=C(O)[C@@H]1CN(Cc2cccc(OCC(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323674	GI	On-Demand	Anodyne	S1PR1	23	40
Cc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2n1	ZINC000872323675	FH	On-Demand	Anodyne	CCR3	30	40
Cc1ccc2cc(CN3C[C@H](c4ccc(F)cc4)[C@@H](C(=O)O)C3)ccc2n1	ZINC000872323675	FH	On-Demand	Anodyne	MLNR	52	37
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323676	GH	On-Demand	Anodyne	MLNR	55	37
O=C(O)[C@@H]1CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323677	GH	On-Demand	Anodyne	MLNR	55	37
O=C(O)[C@@H]1CN(Cc2ccc3c[nH]nc3c2)C[C@H]1c1ccc(F)cc1	ZINC000872323678	EG	On-Demand	Anodyne	MLNR	43	36
O=C(O)[C@@H]1CN(Cc2ccc3c[nH]nc3c2)C[C@H]1c1ccc(F)cc1	ZINC000872323678	EG	On-Demand	Anodyne	S1PR1	27	44
C=CCOc1cccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)c1	ZINC000872323684	FH	On-Demand	Mild	MLNR	47	33
COc1cccc(OC)c1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323689	FG	On-Demand	Anodyne	SLC6A3	19	41
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)ccc1C#N	ZINC000872323691	FG	On-Demand	Mild	MLNR	46	33
C[C@@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323695	FI	On-Demand	Anodyne	SLC6A4	15	46
C[C@@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323695	FI	On-Demand	Anodyne	SLC6A3	35	46
C[C@@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323695	FI	On-Demand	Anodyne	MC4R	22	41
C[C@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323696	FI	On-Demand	Anodyne	SLC6A4	15	46
C[C@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323696	FI	On-Demand	Anodyne	SLC6A3	35	46
C[C@H](CCc1ccccc1)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323696	FI	On-Demand	Anodyne	MC4R	22	41
O=C(O)[C@@H]1CN(Cc2cnc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323697	FG	On-Demand	Anodyne	MC4R	16	42
O=C(O)[C@@H]1CN(Cc2cnc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323697	FG	On-Demand	Anodyne	PRCP	18	42
O=C(O)[C@@H]1CN(Cc2cnc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323697	FG	On-Demand	Anodyne	MLNR	53	37
O=C(O)[C@@H]1CN(Cc2cnc(Cl)c(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323697	FG	On-Demand	Anodyne	PDE1C	45	35
CC(C)c1ccccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323699	EI	On-Demand	Anodyne	MC4R	24	45
CC(C)c1ccccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1	ZINC000872323699	EI	On-Demand	Anodyne	CCR5	15	42
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc2c1OCO2	ZINC000872323705	FF	On-Demand	Anodyne	EDNRB	68	42
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc2c1OCO2	ZINC000872323705	FF	On-Demand	Anodyne	EDNRA	66	42
O=C(O)[C@@H]1CN(Cc2ccc(C(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323707	EI	On-Demand	Anodyne	MLNR	53	40
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	DRD4	15	41
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	SLC6A3	17	40
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	CHRM3	16	40
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	SIGMAR1	26	47
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	CCR3	34	41
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	MLNR	60	41
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	S1PR1	26	43
O=C(O)[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323710	DG	On-Demand	Anodyne	CACNA1G	28	42
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	SIGMAR1	24	41
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	CCR5	15	41
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	S1PR4	15	48
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	SLC18A3	20	45
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	MLNR	57	39
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	S1PR1	20	48
O=C(O)[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323715	FI	On-Demand	Anodyne	S1PR5	40	45
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)CCCC3)C[C@H]1c1ccc(F)cc1	ZINC000872323719	FI	On-Demand	Anodyne	MLNR	49	36
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)CCCC3)C[C@H]1c1ccc(F)cc1	ZINC000872323719	FI	On-Demand	Anodyne	S1PR1	23	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2OC(F)F)C[C@H]1c1ccc(F)cc1	ZINC000872323730	GI	On-Demand	Anodyne	MC4R	21	40
O=C(O)[C@@H]1CN(Cc2cc(Cl)ccc2OC(F)F)C[C@H]1c1ccc(F)cc1	ZINC000872323730	GI	On-Demand	Anodyne	CCR1	23	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323731	GI	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323731	GI	On-Demand	Anodyne	CCR1	15	43
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323731	GI	On-Demand	Anodyne	MLNR	53	39
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323731	GI	On-Demand	Anodyne	S1PR1	23	43
O=C(O)[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323731	GI	On-Demand	Anodyne	S1PR5	36	43
O=C(O)[C@@H]1CN(CC2CCCCC2)C[C@H]1c1ccc(F)cc1	ZINC000872323733	DH	On-Demand	Anodyne	CCR5	31	43
CCn1c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)nc2ccccc21	ZINC000872323735	FG	On-Demand	Anodyne	HRH1	32	41
CCn1c(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)nc2ccccc21	ZINC000872323735	FG	On-Demand	Anodyne	GRM2	19	48
O=C(O)[C@@H]1CN(Cc2ccccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323736	DG	On-Demand	Anodyne	MC4R	15	42
O=C(O)[C@@H]1CN(Cc2ccccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323736	DG	On-Demand	Anodyne	CACNA1G	21	41
C=CCOc1ccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)cc1Cl	ZINC000872323743	GI	On-Demand	Mild	MLNR	51	35
CC(=O)NC[C@@H](Cc1ccccc1Cl)C(=O)O	ZINC000872323745	CD	On-Demand	Anodyne	MME	65	44
CC(=O)NC[C@@H](Cc1ccccc1Cl)C(=O)O	ZINC000872323745	CD	On-Demand	Anodyne	ANPEP	24	44
CC(=O)NC[C@@H](Cc1ccccc1Cl)C(=O)O	ZINC000872323745	CD	On-Demand	Anodyne	CXCL8	49	39
CC(=O)NC[C@@H](Cc1ccccc1Cl)C(=O)O	ZINC000872323745	CD	On-Demand	Anodyne	CPA1	59	43
COc1cc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc(C(F)(F)F)c1	ZINC000872323747	GI	On-Demand	Anodyne	TACR1	82	43
CCc1cnc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)s1	ZINC000872323753	EG	On-Demand	Anodyne	MLNR	47	34
C=C(Cl)C[C@@H](NC(=O)Nc1cc(C)ccc1C)C(=O)O	ZINC000872323756	CG	On-Demand	Mild	ANPEP	20	40
C=C(Cl)C[C@@H](NC(=O)Nc1cc(C)ccc1C)C(=O)O	ZINC000872323756	CG	On-Demand	Mild	FPR1	27	40
C=C(Cl)C[C@H](NC(=O)Nc1cc(C)ccc1C)C(=O)O	ZINC000872323757	CG	On-Demand	Mild	ANPEP	20	40
C=C(Cl)C[C@H](NC(=O)Nc1cc(C)ccc1C)C(=O)O	ZINC000872323757	CG	On-Demand	Mild	FPR1	27	40
O=C(O)[C@@H]1CN(Cc2ccc(SC(F)(F)F)cc2)C[C@H]1c1ccc(F)cc1	ZINC000872323760	GJ	On-Demand	Anodyne	MLNR	47	35
CN(CCC#N)c1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323762	GG	On-Demand	Mild	MLNR	59	39
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2F)C[C@H]1c1ccc(F)cc1	ZINC000872323772	FH	On-Demand	Anodyne	P2RX7	19	40
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	SLC6A3	19	41
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	HRH3	18	40
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	SIGMAR1	21	42
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	MLNR	70	41
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	REN	40	37
COCCOc1ccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)cc1	ZINC000872323777	FG	On-Demand	Anodyne	S1PR1	22	44
O=C(O)[C@@H]1CN(Cc2ccc3c(c2)OCCCCO3)C[C@H]1c1ccc(F)cc1	ZINC000872323783	GH	On-Demand	Anodyne	MCHR1	20	41
O=C(O)[C@@H]1CN(Cc2c(F)cccc2F)C[C@H]1c1ccc(F)cc1	ZINC000872323790	EG	On-Demand	Anodyne	MC4R	15	42
N#CC1(c2ccc(CN3C[C@@H](C(=O)O)[C@H](c4ccc(F)cc4)C3)cc2)CC1	ZINC000872323799	FH	On-Demand	Mild	SIGMAR1	15	41
O=C(O)[C@@H]1CN(CC2CCCCCC2)C[C@H]1c1ccc(F)cc1	ZINC000872323800	DH	On-Demand	Anodyne	CCR5	31	43
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	TACR1	53	42
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	GRM3	15	47
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	SIGMAR1	15	46
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	CACNA1B	19	42
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	MLNR	44	36
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	CCR2	46	42
O=C(O)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323801	FI	On-Demand	Anodyne	LIPG	52	39
O=C(O)[C@@H]1CN(Cc2cccc(C3CC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323803	EI	On-Demand	Anodyne	SIGMAR1	25	40
O=C(O)[C@@H]1CN(Cc2cccc(C3CC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323803	EI	On-Demand	Anodyne	CCR5	42	34
O=C(O)[C@@H]1CN(Cc2cccc(C3CC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323803	EI	On-Demand	Anodyne	SLC18A3	25	40
O=C(O)[C@@H]1CN(Cc2cccc(C3CC3)c2)C[C@H]1c1ccc(F)cc1	ZINC000872323803	EI	On-Demand	Anodyne	MLNR	46	35
O=C(O)[C@@H]1CN(Cc2cccc(Cl)c2Cl)C[C@H]1c1ccc(F)cc1	ZINC000872323805	FI	On-Demand	Anodyne	P2RX7	30	42
N#Cc1cccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)c1	ZINC000872323813	DF	On-Demand	Mild	CCR3	30	41
N#Cc1cccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc(F)cc3)C2)c1	ZINC000872323813	DF	On-Demand	Mild	MLNR	59	42
O=C(NN=CCCOCC(F)F)c1ccccn1	ZINC000872323816	CD	On-Demand	Reactive	GRM4	56	42
C=CCC1(C=NNC(=O)c2ccccn2)CCCC1	ZINC000872323830	CF	On-Demand	Reactive	GRM4	53	38
C[C@H]1CC(=NNC(=O)c2ccccn2)CC(C)(C)C1	ZINC000872323837	CG	On-Demand	Reactive	GRM4	48	40
C/C=C/C=C\C(=O)N1c2ccccc2C[C@H]1C	ZINC000872323881	BG	On-Demand	Anodyne	DRD4	24	43
C/C=C/C=C\C(=O)N1c2ccccc2C[C@H]1C	ZINC000872323881	BG	On-Demand	Anodyne	TPP2	57	34
C/C=C/C=C\C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872323882	BG	On-Demand	Anodyne	DRD4	24	43
C/C=C/C=C\C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872323882	BG	On-Demand	Anodyne	TPP2	57	34
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872323895	DD	On-Demand	Mild	CA2	47	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872323895	DD	On-Demand	Mild	CA1	44	40
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872323895	DD	On-Demand	Mild	CA12	35	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872323895	DD	On-Demand	Mild	CA9	36	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCCOC1	ZINC000872323895	DD	On-Demand	Mild	P96878_MYCTU	40	37
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872323896	DD	On-Demand	Mild	CA2	47	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872323896	DD	On-Demand	Mild	CA1	44	40
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872323896	DD	On-Demand	Mild	CA12	35	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872323896	DD	On-Demand	Mild	CA9	36	42
CCC(=NNc1ccc(S(N)(=O)=O)cc1)[C@H]1CCCOC1	ZINC000872323896	DD	On-Demand	Mild	P96878_MYCTU	40	37
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@@H]2CCCO2)cc1	ZINC000872323905	DE	On-Demand	Mild	CA2	40	40
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@@H]2CCCO2)cc1	ZINC000872323905	DE	On-Demand	Mild	CA1	36	40
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@@H]2CCCO2)cc1	ZINC000872323905	DE	On-Demand	Mild	P96878_MYCTU	44	39
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@H]2CCCO2)cc1	ZINC000872323906	DE	On-Demand	Mild	CA2	40	40
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@H]2CCCO2)cc1	ZINC000872323906	DE	On-Demand	Mild	CA1	36	40
NS(=O)(=O)c1ccc(NN=C(C2CCC2)[C@H]2CCCO2)cc1	ZINC000872323906	DE	On-Demand	Mild	P96878_MYCTU	44	39
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA2	73	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA1	66	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA7	44	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA4	48	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA12	53	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CA9	54	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CAH_METTE	23	40
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	CYNT	47	37
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	MTCA1	47	38
NS(=O)(=O)c1ccc(NN=CCCCC2CC2)cc1	ZINC000872323909	CE	On-Demand	Mild	P96878_MYCTU	56	38
CC(C)(C)[C@@H]1CC(=NNC(=O)c2ccccn2)CCO1	ZINC000872323911	CE	On-Demand	Reactive	GRM4	40	35
CCC(CC1CCCCC1)=NNC(=O)c1ccccn1	ZINC000872323937	CH	On-Demand	Reactive	GRM4	49	40
C(=Nn1cnnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872323949	DC	On-Demand	Mild	ESR1	42	36
C(=Nn1cnnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872323949	DC	On-Demand	Mild	LTA4H	47	50
C(=Nn1cnnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872323949	DC	On-Demand	Mild	HRH3	22	46
C(=Nn1cnnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872323949	DC	On-Demand	Mild	PSMB1	42	38
O=C(NN=C1CC[C@@H]2C[C@H]12)c1ccccn1	ZINC000872323950	BD	On-Demand	Reactive	GRM4	51	38
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CA2	48	43
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CA1	45	38
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CA7	37	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CA12	40	43
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CA9	37	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	CAH_METTE	22	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	MTCA1	44	38
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872323977	CD	On-Demand	Mild	P96878_MYCTU	55	38
CN1CCC(C=NNC(=O)c2ccc3ccccc3n2)CC1	ZINC000872323993	CE	On-Demand	Reactive	HTR1F	52	34
O=C(NN=CCCCC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000872324021	CF	On-Demand	Reactive	CACNA1D	40	36
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	CA2	56	45
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	CA1	55	45
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	CA7	47	39
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	CA12	47	45
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	CA9	47	44
CN1CCC(C=NNc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000872324023	CD	On-Demand	Mild	P96878_MYCTU	49	37
CN1CCC(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872324028	CD	On-Demand	Reactive	HTR1F	36	45
CC(CCc1cccnc1)=Nn1cnnc1	ZINC000872324044	BD	On-Demand	Mild	TBXAS1	20	41
c1ccc(CN2C[C@H]3C(=Nn4cnnc4)CC[C@H]3C2)cc1	ZINC000872324045	CE	On-Demand	Mild	SIGMAR1	18	46
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccccn2)c1	ZINC000872324063	FF	On-Demand	Reactive	GRM4	46	38
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccccn2)c1	ZINC000872324063	FF	On-Demand	Reactive	ADCYAP1R1	60	39
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccccn2)c1	ZINC000872324063	FF	On-Demand	Reactive	PDS	56	33
CC(=O)NCCc1nc2ccc(C(=O)O)cc2[nH]1	ZINC000872324084	BC	On-Demand	Anodyne	NQO2	43	36
CC(=O)NCCc1nc2ccc(C(=O)O)cc2[nH]1	ZINC000872324084	BC	On-Demand	Anodyne	MTNR1A	72	42
CC(=O)NCCc1nc2ccc(C(=O)O)cc2[nH]1	ZINC000872324084	BC	On-Demand	Anodyne	MTNR1B	67	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccccn1	ZINC000872324087	EF	On-Demand	Reactive	DRD4	16	40
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccncc2)c1	ZINC000872324088	FF	On-Demand	Reactive	ADCYAP1R1	71	43
CCn1c(=C(C#N)C#N)sc(=Cc2ccc(OC)c(C(C)(C)C)c2)c1=O	ZINC000872324099	FE	On-Demand	Mild	MAPT	43	30
C=CCC1(C=NNc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000872324132	DF	On-Demand	Mild	CA2	43	38
C=CCC1(C=NNc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000872324132	DF	On-Demand	Mild	CA1	40	38
N#CC(C#N)=c1sc(=Cc2ccc(C(=O)N3CCCC3)cc2)c(=O)n1C1CC1	ZINC000872324133	GD	On-Demand	Mild	L3MBTL3	71	39
O=C(NN=CC1CC2(C1)OCCO2)c1ccccn1	ZINC000872324138	CC	On-Demand	Reactive	GRM4	60	39
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	ACE	58	45
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	MME	155	50
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	ANPEP	92	43
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	PGC	22	42
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	FCER2	55	33
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	RNPEP	36	43
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CTSB	44	39
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	PAPA1_CARPA	54	44
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CYSP_TRYCR	41	34
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CPA1	92	46
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CTRB1	32	41
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	NAALAD2	30	43
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CAPNS1	75	33
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	MMP2	17	47
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	ECE1	21	40
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CAPN1	73	44
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	MMP9	19	40
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CAPN2	56	34
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	ACE2	97	41
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	LAP3	50	43
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	CTSC	26	40
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	FPR1	65	40
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	NPR	24	40
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	AMP1_PLAFQ	44	43
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	BLA1_STEMA	54	35
CC(=O)N[C@@H](C(=O)O)[C@H](O)Cc1ccccc1	ZINC000872324152	BC	On-Demand	Anodyne	NPFFR1	45	32
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	ACE	58	45
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	MME	155	50
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	ANPEP	92	43
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	PGC	22	42
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	FCER2	55	33
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	RNPEP	36	43
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CTSB	44	39
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	PAPA1_CARPA	54	44
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CYSP_TRYCR	41	34
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CPA1	92	46
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CTRB1	32	41
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	NAALAD2	30	43
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CAPNS1	75	33
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	MMP2	17	47
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	ECE1	21	40
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CAPN1	73	44
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	MMP9	19	40
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CAPN2	56	34
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	ACE2	97	41
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	LAP3	50	43
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	CTSC	26	40
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	FPR1	65	40
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	NPR	24	40
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	AMP1_PLAFQ	44	43
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	BLA1_STEMA	54	35
CC(=O)N[C@@H](C(=O)O)[C@@H](O)Cc1ccccc1	ZINC000872324155	BC	On-Demand	Anodyne	NPFFR1	45	32
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)c1ccccn1	ZINC000872324192	ED	On-Demand	Reactive	GRM4	56	37
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CTSB	18	48
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CTSK	24	40
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CTSL	20	43
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CTSS	15	40
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CAPN1	44	54
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	CAPN2	42	33
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	LAP3	17	40
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	NPR	46	35
CC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324212	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	26	43
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccccn1	ZINC000872324220	CE	On-Demand	Reactive	GRM4	52	38
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccccn1	ZINC000872324222	CE	On-Demand	Reactive	GRM4	52	38
O=C(NN=C1CCC[C@H]1F)c1ccccn1	ZINC000872324239	BD	On-Demand	Reactive	GRM4	57	38
O=C(NN=C1CCC[C@@H]1F)c1ccccn1	ZINC000872324240	BD	On-Demand	Reactive	GRM4	57	38
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA2	35	46
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA1	34	46
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA7	23	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA5B	36	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA5A	41	40
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA12	27	41
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	CA9	28	46
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	MTCA1	23	41
NS(=O)(=O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324251	GF	On-Demand	Mild	P96878_MYCTU	30	41
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA2	66	42
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA1	60	42
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA7	42	37
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA4	50	35
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA12	42	42
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	CA9	42	42
NS(=O)(=O)c1ccc(NN=CCCOCC(F)F)cc1	ZINC000872324261	DD	On-Demand	Mild	P96878_MYCTU	42	34
CN1CCC(C=NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000872324275	CD	On-Demand	Reactive	HTR1F	28	49
CCC(CCC(F)(F)F)=NNC(=O)c1ccccn1	ZINC000872324277	CF	On-Demand	Reactive	GRM4	45	39
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1ccccn1)C2	ZINC000872324287	FF	On-Demand	Reactive	GRM4	42	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1ccccn1)C2	ZINC000872324287	FF	On-Demand	Reactive	GPR119	17	43
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ccccc1)C2	ZINC000872324301	EI	On-Demand	Mild	GPR119	22	42
CC(=O)NC[C@@H](Oc1ccccc1)C(=O)O	ZINC000872324351	BC	On-Demand	Anodyne	PPARA	27	50
CC(=O)NC[C@@H](Oc1ccccc1)C(=O)O	ZINC000872324351	BC	On-Demand	Anodyne	MME	27	45
CC(=O)NC[C@@H](Oc1ccccc1)C(=O)O	ZINC000872324351	BC	On-Demand	Anodyne	MTNR1A	39	50
CC(=O)NC[C@@H](Oc1ccccc1)C(=O)O	ZINC000872324351	BC	On-Demand	Anodyne	MTNR1B	37	50
C=CCC1(C=NNC(=O)c2ccccn2)CCOCC1	ZINC000872324360	CE	On-Demand	Reactive	GRM4	44	37
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1ccccn1	ZINC000872324399	CE	On-Demand	Reactive	GRM4	43	40
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1ccccn1	ZINC000872324401	CE	On-Demand	Reactive	GRM4	43	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccn1	ZINC000872324427	FD	On-Demand	Reactive	LTA4H	51	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccn1	ZINC000872324427	FD	On-Demand	Reactive	HRH3	15	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccn1	ZINC000872324427	FD	On-Demand	Reactive	EPHX2	19	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccn1	ZINC000872324427	FD	On-Demand	Reactive	FLT3	19	42
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324434	EH	On-Demand	Mild	DRD4	26	41
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324434	EH	On-Demand	Mild	ACHE	32	44
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324434	EH	On-Demand	Mild	LTA4H	26	43
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324434	EH	On-Demand	Mild	SIGMAR1	36	43
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872324434	EH	On-Demand	Mild	NOD2	42	35
O=C(NN=CCCCC1CC1)c1ccccn1	ZINC000872324453	BE	On-Demand	Reactive	GRM4	60	40
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	FOLH1	41	31
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	PTGER3	22	41
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	ACACA	24	40
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	ACACB	26	40
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	MTNR1A	40	41
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	MTNR1B	35	41
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	MMP1	20	43
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	DXR	27	46
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	FFAR1	22	43
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	AKR1C3	16	40
COc1ccc([C@@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324474	CD	On-Demand	Anodyne	UTS2	65	45
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	FOLH1	41	31
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	PTGER3	22	41
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	ACACA	24	40
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	ACACB	26	40
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	MTNR1A	40	41
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	MTNR1B	35	41
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	MMP1	20	43
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	DXR	27	46
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	FFAR1	22	43
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	AKR1C3	16	40
COc1ccc([C@H](CCC(=O)O)NC(C)=O)cc1	ZINC000872324476	CD	On-Demand	Anodyne	UTS2	65	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	LTA4H	38	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	HRH3	15	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	EPHX2	25	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	FLT3	18	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	EPHA2	19	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccncc1	ZINC000872324479	FD	On-Demand	Reactive	PSMB1	40	35
CCC(CCC(F)(F)F)=NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000872324490	DG	On-Demand	Reactive	CACNA1D	45	36
CC(=O)NC[C@@H](Cc1cc(F)c(F)c(F)c1)C(=O)O	ZINC000872324517	CD	On-Demand	Anodyne	CPA1	51	61
COc1ccc(C=c2sc(=C(C#N)C#N)n(C)c2=O)cc1C(C)(C)C	ZINC000872324519	FD	On-Demand	Mild	MAPT	53	32
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	ACE	45	42
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	MME	98	43
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	ANPEP	57	38
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	PAPA1_CARPA	44	36
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	CPA1	68	42
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	ACE2	58	38
CC(=O)N(CC(=O)O)[C@@H](C)Cc1ccccc1	ZINC000872324558	BD	On-Demand	Anodyne	LAP3	46	38
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	ACE	45	42
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	MME	98	43
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	ANPEP	57	38
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	PAPA1_CARPA	44	36
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	CPA1	68	42
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	ACE2	58	38
CC(=O)N(CC(=O)O)[C@H](C)Cc1ccccc1	ZINC000872324559	BD	On-Demand	Anodyne	LAP3	46	38
CCC(=NNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCOC1	ZINC000872324567	CG	On-Demand	Mild	SLC27A4	48	31
CCC(=NNc1ccc([N+](=O)[O-])cc1)[C@H]1CCCOC1	ZINC000872324568	CG	On-Demand	Mild	SLC27A4	48	31
CC(=O)N(CCOc1ccccc1)[C@@H](C)C(=O)O	ZINC000872324575	CD	On-Demand	Anodyne	ALOX5	23	53
CC(=O)N(CCOc1ccccc1)[C@@H](C)C(=O)O	ZINC000872324575	CD	On-Demand	Anodyne	FDPS	23	44
CC(=O)N(CCOc1ccccc1)[C@@H](C)C(=O)O	ZINC000872324575	CD	On-Demand	Anodyne	PPARG	25	41
CC(=O)N(CCOc1ccccc1)[C@@H](C)C(=O)O	ZINC000872324575	CD	On-Demand	Anodyne	LTA4H	35	46
CC(=O)N(CCOc1ccccc1)[C@@H](C)C(=O)O	ZINC000872324575	CD	On-Demand	Anodyne	ESRRG	48	38
CC(=O)N(CCOc1ccccc1)[C@H](C)C(=O)O	ZINC000872324576	CD	On-Demand	Anodyne	ALOX5	23	53
CC(=O)N(CCOc1ccccc1)[C@H](C)C(=O)O	ZINC000872324576	CD	On-Demand	Anodyne	FDPS	23	44
CC(=O)N(CCOc1ccccc1)[C@H](C)C(=O)O	ZINC000872324576	CD	On-Demand	Anodyne	PPARG	25	41
CC(=O)N(CCOc1ccccc1)[C@H](C)C(=O)O	ZINC000872324576	CD	On-Demand	Anodyne	LTA4H	35	46
CC(=O)N(CCOc1ccccc1)[C@H](C)C(=O)O	ZINC000872324576	CD	On-Demand	Anodyne	ESRRG	48	38
CC(CCc1c[nH]c2ccccc12)=NNc1nc(C)cc(C)n1	ZINC000872324586	DH	On-Demand	Mild	HTR1D	21	42
CC(CCc1c[nH]c2ccccc12)=NNc1nc(C)cc(C)n1	ZINC000872324586	DH	On-Demand	Mild	MPO	42	42
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA2	48	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA1	43	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA7	31	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA4	33	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA12	37	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CA9	37	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CAH_METTE	26	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	CYNT	29	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	MTCA1	44	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@@H]2F)cc1	ZINC000872324595	CD	On-Demand	Mild	P96878_MYCTU	54	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA2	48	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA1	43	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA7	31	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA4	33	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA12	37	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CA9	37	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CAH_METTE	26	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	CYNT	29	40
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	MTCA1	44	41
NS(=O)(=O)c1ccc(NN=C2CCC[C@H]2F)cc1	ZINC000872324596	CD	On-Demand	Mild	P96878_MYCTU	54	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1ccncc1)C2	ZINC000872324611	FF	On-Demand	Reactive	GPR119	18	41
CCC[C@@H](CCCCNC(C)=O)C(=O)O	ZINC000872324615	BD	On-Demand	Anodyne	FOLH1	33	49
CCC[C@H](CCCCNC(C)=O)C(=O)O	ZINC000872324616	BD	On-Demand	Anodyne	FOLH1	33	49
CN1CCC(C=NNC(=O)c2ccncc2)CC1	ZINC000872324619	BD	On-Demand	Reactive	HTR1F	63	43
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	ESR1	40	35
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	LTA4H	60	47
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	HRH3	25	47
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	EPHX2	28	52
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	FLT3	18	43
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	PSMB2	42	42
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872324626	FF	On-Demand	Mild	PSMB1	45	42
O=C(NN=C1CCCC2(C1)OCCO2)c1ccccn1	ZINC000872324647	CD	On-Demand	Reactive	GRM4	47	37
O=C(NN=Cc1cc2c([nH]1)CCCC2)c1ccccn1	ZINC000872324660	CE	On-Demand	Reactive	GRM4	57	38
O=C(NN=CC1([C@@H]2CCCCO2)CCC1)c1ccccn1	ZINC000872324662	CF	On-Demand	Reactive	GRM4	45	37
O=C(NN=CC1([C@H]2CCCCO2)CCC1)c1ccccn1	ZINC000872324664	CF	On-Demand	Reactive	GRM4	45	37
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	F2	36	41
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	ACE	30	43
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	CELA1	46	44
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	ELANE	42	37
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	HLA-DRB3	54	35
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	NTSR1	45	32
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	HLA-A	53	33
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	LGMN	55	38
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	SLC5A1	20	47
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	TPP2	34	50
CC(=O)N1CCC[C@H]1C(=O)NC[C@H](CC(=O)O)CC(C)C	ZINC000872324666	CD	On-Demand	Anodyne	XIAP	42	42
O=C(NN=CCCCCCO)c1ccccn1	ZINC000872324699	BD	On-Demand	Reactive	GRM4	59	38
Cn1nc2c(c1C=NNC(=O)c1ccccn1)CCCC2	ZINC000872324704	CD	On-Demand	Reactive	GRM4	54	38
CC(C)(C)OC(=O)NC1CC(C=NNC(=O)c2ccccn2)C1	ZINC000872324716	DE	On-Demand	Reactive	GRM4	45	35
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA2	97	46
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA1	84	43
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA7	46	40
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA4	72	43
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA14	37	40
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA12	63	46
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CA9	64	46
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	CYNT	44	38
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	MTCA1	47	43
CCC(CCC(F)(F)F)=NNc1ccc(S(N)(=O)=O)cc1	ZINC000872324720	DF	On-Demand	Mild	P96878_MYCTU	57	43
CN1CCC(C=NNC(=O)c2ccccn2)CC1	ZINC000872324721	BD	On-Demand	Reactive	HTR1F	52	47
CN1CCC(C=NNC(=O)c2ccccn2)CC1	ZINC000872324721	BD	On-Demand	Reactive	GRM4	63	44
Cc1cc(O)nc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1	ZINC000872324725	EE	On-Demand	Mild	L3MBTL3	66	36
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	ALOX5	18	47
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	FDPS	23	40
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	CYSLTR1	18	42
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	LTA4H	37	55
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	CYSLTR2	75	35
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	PLA2G4B	80	39
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	ESRRG	48	35
CC(=O)N(CCCC(=O)O)CCOc1ccccc1	ZINC000872324739	CD	On-Demand	Anodyne	FFAR1	30	41
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	ACE	44	47
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	OPRM1	19	44
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	OPRD1	18	44
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	FOLH1	55	50
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MME	155	60
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	ANPEP	114	44
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	RNPEP	52	54
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	PAPA1_CARPA	49	40
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	CPA1	109	50
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	NPFFR2	54	40
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	C3AR1	81	40
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	TPH1	54	33
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	NAALAD2	26	47
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MTNR1A	48	43
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MTNR1B	46	43
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MMP2	31	40
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MMP3	46	42
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MMP8	22	46
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	FURIN	54	35
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MMP9	18	42
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	ACE2	69	41
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	LAP3	72	42
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	MMP1	22	42
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	FPR1	54	40
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	NPR	34	44
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	AMP1_PLAFQ	53	46
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	BLA1_STEMA	40	35
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	POLG_WNV	47	31
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	CHIA	36	43
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	QRFPR	42	36
CC(=O)NCCC[C@H](Cc1ccccc1)C(=O)O	ZINC000872324757	BD	On-Demand	Anodyne	NPFFR1	76	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	ACE	44	47
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	OPRM1	19	44
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	OPRD1	18	44
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	FOLH1	55	50
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MME	155	60
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	ANPEP	114	44
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	RNPEP	52	54
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	PAPA1_CARPA	49	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	CPA1	109	50
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	NPFFR2	54	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	C3AR1	81	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	TPH1	54	33
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	NAALAD2	26	47
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MTNR1A	48	43
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MTNR1B	46	43
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MMP2	31	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MMP3	46	42
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MMP8	22	46
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	FURIN	54	35
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MMP9	18	42
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	ACE2	69	41
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	LAP3	72	42
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	MMP1	22	42
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	FPR1	54	40
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	NPR	34	44
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	AMP1_PLAFQ	53	46
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	BLA1_STEMA	40	35
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	POLG_WNV	47	31
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	CHIA	36	43
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	QRFPR	42	36
CC(=O)NCCC[C@@H](Cc1ccccc1)C(=O)O	ZINC000872324758	BD	On-Demand	Anodyne	NPFFR1	76	40
Cn1c(=C(C#N)C#N)sc(=Cc2ccc(C(=O)N3CCCC3)cc2)c1=O	ZINC000872324771	FC	On-Demand	Mild	L3MBTL3	41	35
O=C(NN=Cc1ccnn1CC1CCC1)c1ccccn1	ZINC000872324783	CD	On-Demand	Reactive	GRM4	55	38
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccncc1	ZINC000872324787	EF	On-Demand	Reactive	ACHE	17	48
COc1ccc(Cn2cc(C=NN[C@@H]3CCS(=O)(=O)C3)nn2)cc1	ZINC000872324849	EC	On-Demand	Mild	PROKR1	52	31
COc1ccc(Cn2cc(C=NN[C@H]3CCS(=O)(=O)C3)nn2)cc1	ZINC000872324850	EC	On-Demand	Mild	PROKR1	52	31
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	OPRM1	20	40
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	OPRD1	15	40
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	FOLH1	22	58
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	MME	79	46
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	ANPEP	60	34
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	CPA1	84	47
CC(=O)NC[C@@H](Cc1cccc(O)c1)C(=O)O	ZINC000872324857	BC	On-Demand	Anodyne	LAP3	38	44
O=S1(=O)CC[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872324859	FC	On-Demand	Mild	LTA4H	29	42
O=S1(=O)CC[C@@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872324860	FC	On-Demand	Mild	LTA4H	29	42
COc1ccc([C@@H]2CC[C@@H](C(=O)O)N2C(C)=O)cc1	ZINC000872324892	CD	On-Demand	Anodyne	ACE	26	46
COc1ccc([C@@H]2CC[C@@H](C(=O)O)N2C(C)=O)cc1	ZINC000872324892	CD	On-Demand	Anodyne	MME	15	44
COc1ccc([C@@H]2CC[C@@H](C(=O)O)N2C(C)=O)cc1	ZINC000872324892	CD	On-Demand	Anodyne	EDNRA	28	45
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	ACE	27	49
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MME	47	46
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	EDNRB	25	46
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	EDNRA	29	46
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MC4R	26	40
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MC3R	40	38
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MC5R	57	40
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MMP2	20	40
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	GRPR	63	38
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	ECE1	63	46
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	GHSR	27	41
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MMP9	18	40
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	ACE2	66	33
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	MC1R	59	40
CC(=O)N[C@@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324894	BC	On-Demand	Anodyne	NPR	27	46
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	ACE	27	49
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MME	47	46
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	EDNRB	25	46
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	EDNRA	29	46
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MC4R	26	40
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MC3R	40	38
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MC5R	57	40
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MMP2	20	40
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	GRPR	63	38
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	ECE1	63	46
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	GHSR	27	41
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MMP9	18	40
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	ACE2	66	33
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	MC1R	59	40
CC(=O)N[C@H](Cc1c[nH]c2cccnc12)C(=O)O	ZINC000872324895	BC	On-Demand	Anodyne	NPR	27	46
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	TBXA2R	49	37
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	THRB	15	40
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	MTNR1A	53	44
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	MTNR1B	50	44
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	FFAR1	92	49
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	FFAR4	53	40
CC(=O)NCc1cccc(CCC(=O)O)c1	ZINC000872324970	BD	On-Demand	Anodyne	PDS	51	33
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	ACE	56	50
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	MME	64	44
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	LTA4H	16	50
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	NAALAD2	52	35
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	MMP2	19	52
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	MMP3	34	52
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	ACE2	66	45
CC(=O)N[C@@H](CCc1ccc(C(F)(F)F)cc1)C(=O)O	ZINC000872324982	CE	On-Demand	Anodyne	PSMB5	18	41
O=C(c1ccc(C=NN[C@H]2CCS(=O)(=O)C2)cc1)N1CCCC1	ZINC000872324993	ED	On-Demand	Mild	L3MBTL3	76	40
O=C(c1ccc(C=NN[C@@H]2CCS(=O)(=O)C2)cc1)N1CCCC1	ZINC000872324994	ED	On-Demand	Mild	L3MBTL3	76	40
CC(=O)N1CCc2ccc(F)c(C(=O)O)c2C1	ZINC000872325014	BD	On-Demand	Anodyne	GABRA3	23	40
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	PPARG	21	41
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	PPARA	27	48
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	FOLH1	17	41
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	MME	58	43
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	CPA1	74	44
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	PPARD	15	41
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	MTNR1A	106	58
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	MTNR1B	105	58
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	ROCK2	40	42
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	ACE2	42	39
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	HSD17B2	17	40
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	AKR1C3	16	40
COc1cccc(C[C@H](CNC(C)=O)C(=O)O)c1	ZINC000872325030	CD	On-Demand	Anodyne	PDS	62	42
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	PPARG	21	41
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	PPARA	27	48
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	FOLH1	17	41
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	MME	58	43
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	CPA1	74	44
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	PPARD	15	41
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	MTNR1A	106	58
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	MTNR1B	105	58
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	ROCK2	40	42
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	ACE2	42	39
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	HSD17B2	17	40
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	AKR1C3	16	40
COc1cccc(C[C@@H](CNC(C)=O)C(=O)O)c1	ZINC000872325032	CD	On-Demand	Anodyne	PDS	62	42
CC(CCc1cccnc1)=NNc1ccc(C)cc1	ZINC000872325046	CH	On-Demand	Mild	TBXAS1	23	40
CC(CCc1cccnc1)=NNc1ccc(C)cc1	ZINC000872325046	CH	On-Demand	Mild	NAMPT	29	44
CC(CCc1cccnc1)=NNC(N)=O	ZINC000872325077	BD	On-Demand	Reactive	TBXAS1	50	47
CC(CCc1cccnc1)=NNC(N)=O	ZINC000872325077	BD	On-Demand	Reactive	PPO2	50	44
CC(CCc1cccnc1)=NNC(N)=O	ZINC000872325077	BD	On-Demand	Reactive	NAMPT	30	44
CC(CCc1cccnc1)=NN1CCN(C)CC1	ZINC000872325087	BD	On-Demand	Mild	TBXAS1	15	40
CC(CCc1cccnc1)=NN1CCN(C)CC1	ZINC000872325087	BD	On-Demand	Mild	CHRNA7	43	34
c1ccc2sc(NN=C3CC[C@H]4C[C@@H]34)nc2c1	ZINC000872325089	BG	On-Demand	Mild	BCL2L1	18	41
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872325118	FD	On-Demand	Reactive	AKR1C3	60	43
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872325119	FD	On-Demand	Reactive	AKR1C3	60	43
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccnc1	ZINC000872325139	BD	On-Demand	Reactive	GLRA1	15	41
CN1CCC(C=NNC(=O)c2cccnc2)CC1	ZINC000872325141	BD	On-Demand	Reactive	GLRA1	15	40
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872325144	FD	On-Demand	Reactive	AKR1C3	63	43
NC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872325161	CD	On-Demand	Reactive	SIGMAR1	34	44
NC(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872325164	BE	On-Demand	Reactive	AOC1	19	42
NC(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872325164	BE	On-Demand	Reactive	AMD1	23	42
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2cccnc2)c1	ZINC000872325187	FF	On-Demand	Reactive	ADCYAP1R1	64	39
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2cccnc2)c1	ZINC000872325187	FF	On-Demand	Reactive	NAMPT	35	42
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	ZINC000872325188	GC	On-Demand	Reactive	AKR1C3	61	43
CC(CCc1cccnc1)=NNc1cccc(C)c1	ZINC000872325194	CH	On-Demand	Mild	PTAFR	18	42
CC(CCc1cccnc1)=NNc1cccc(C)c1	ZINC000872325194	CH	On-Demand	Mild	C3AR1	29	42
O=C(O)c1cccc(NN=C2CCCN3CCSC[C@@H]23)c1	ZINC000872325212	DE	On-Demand	Mild	AKR1C3	22	40
O=C(O)c1cccc(NN=C2CCCN3CCSC[C@H]23)c1	ZINC000872325213	DE	On-Demand	Mild	AKR1C3	22	40
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccccc1	ZINC000872325225	EG	On-Demand	Reactive	DRD4	28	44
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccccc1	ZINC000872325225	EG	On-Demand	Reactive	ACHE	22	44
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccccc1	ZINC000872325225	EG	On-Demand	Reactive	SIGMAR1	31	43
O=C(O)c1cccc(NN=C(C2CCC2)[C@@H]2CCCO2)c1	ZINC000872325248	CG	On-Demand	Mild	AKR1C3	23	40
O=C(O)c1cccc(NN=C(C2CCC2)[C@H]2CCCO2)c1	ZINC000872325249	CG	On-Demand	Mild	AKR1C3	23	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccnc1	ZINC000872325262	FD	On-Demand	Reactive	LTA4H	39	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccnc1	ZINC000872325262	FD	On-Demand	Reactive	CHRNA7	18	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccnc1	ZINC000872325262	FD	On-Demand	Reactive	EPHX2	21	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccnc1	ZINC000872325262	FD	On-Demand	Reactive	FLT3	19	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccnc1	ZINC000872325262	FD	On-Demand	Reactive	TBK1	15	41
NC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872325265	CC	On-Demand	Reactive	MLYCD	18	41
NC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872325265	CC	On-Demand	Reactive	L3MBTL3	73	41
CN1CCC(C=NN(Cc2ccccc2)c2ccccc2)CC1	ZINC000872325337	DI	On-Demand	Mild	G6PC	50	33
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(Cl)cc1	ZINC000872325361	DI	On-Demand	Reactive	UTS2	41	33
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	ESR1	59	37
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	LTA4H	49	47
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	HRH3	24	46
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	EPHX2	23	49
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	FLT3	17	45
NC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325376	CC	On-Demand	Reactive	PSMB1	42	37
CCC(CCC(F)(F)F)=NNc1cccc(C(=O)O)c1	ZINC000872325381	CH	On-Demand	Mild	AKR1C3	35	46
O=C(O)c1cccc(NN=C2CCC[C@@H]2F)c1	ZINC000872325397	BF	On-Demand	Mild	AKR1C3	36	43
O=C(O)c1cccc(NN=C2CCC[C@H]2F)c1	ZINC000872325398	BF	On-Demand	Mild	AKR1C3	36	43
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1cccnc1)C2	ZINC000872325405	FF	On-Demand	Reactive	GPR119	16	42
O=C(COc1ccc(Cl)cc1Cl)NN=CCCCCCO	ZINC000872325441	EG	On-Demand	Reactive	PTGDR2	21	58
CC(CCOCc1ccccc1)=NNC(N)=O	ZINC000872325448	BD	On-Demand	Reactive	PPO2	52	48
O=C(NN=CCCOCC(F)F)c1cccnc1	ZINC000872325451	CD	On-Demand	Reactive	TBXAS1	41	38
COc1cc(C=NN2CCN(C)CC2)c(Cl)cc1O	ZINC000872325469	CD	On-Demand	Mild	DRD1	28	41
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2)CC1	ZINC000872325475	CE	On-Demand	Reactive	SLC6A3	19	41
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2)CC1	ZINC000872325475	CE	On-Demand	Reactive	HTR1F	65	38
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2)CC1	ZINC000872325475	CE	On-Demand	Reactive	SLC6A5	15	41
O=C(O)c1cccc(NN=C2CC[C@@H]3C[C@H]23)c1	ZINC000872325479	BF	On-Demand	Mild	AKR1C3	53	43
O=C(NN=CCCCC1CC1)c1cccnc1	ZINC000872325480	BE	On-Demand	Reactive	TBXA2R	32	40
O=C(NN=CCCCC1CC1)c1cccnc1	ZINC000872325480	BE	On-Demand	Reactive	TBXAS1	65	40
O=C(NN=CCCCC1CC1)c1cccnc1	ZINC000872325480	BE	On-Demand	Reactive	NAMPT	17	40
O=C(O)c1cccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872325493	EH	On-Demand	Mild	DRD4	28	43
O=C(O)c1cccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872325493	EH	On-Demand	Mild	ACHE	32	40
O=C(O)c1cccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872325493	EH	On-Demand	Mild	SIGMAR1	33	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1cccnc1	ZINC000872325494	EF	On-Demand	Reactive	ACHE	15	51
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1cccnc1	ZINC000872325494	EF	On-Demand	Reactive	CHRNA7	41	40
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1cccnc1	ZINC000872325494	EF	On-Demand	Reactive	ACHP_LYMST	20	40
CN1CCC(C=NNC(=O)c2ccccc2)CC1	ZINC000872325514	BD	On-Demand	Reactive	HTR1F	55	40
CN1CCC(C=NNC(=O)c2ccccc2)CC1	ZINC000872325514	BD	On-Demand	Reactive	PRNP	30	40
O=C(O)c1cc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)ccc1Cl	ZINC000872325530	GI	On-Demand	Mild	SIGMAR1	27	40
O=C(NN=CCCCC1CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872325532	GE	On-Demand	Reactive	ST14	42	32
O=C(NN=CCCCC1CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872325532	GE	On-Demand	Reactive	AKR1C3	58	40
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	ESR1	57	38
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	LTA4H	46	46
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	MAPK14	17	42
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	HRH3	18	45
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	EPHX2	35	52
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	FLT3	18	43
O=C(O)c1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872325555	FF	On-Demand	Mild	PSMB1	42	39
CN1CCC(C=NNc2nc3ccccc3s2)CC1	ZINC000872325582	CG	On-Demand	Mild	BCL2L1	20	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	ESR1	57	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	ACHE	15	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	GCGR	17	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	LTA4H	59	52
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	CYSLTR2	62	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	MAPK14	18	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	HRH3	28	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	EPHX2	25	53
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	FLT3	19	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	PSMB2	43	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	PSMB1	46	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872325586	FE	On-Demand	Reactive	ADCYAP1R1	34	45
O=C(NN=CCCCCCO)c1cccnc1	ZINC000872325599	BD	On-Demand	Reactive	TBXAS1	72	43
CN1CCC(C=NNC(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000872325608	EF	On-Demand	Reactive	MCHR2	20	41
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)c1ccc(Cl)cc1	ZINC000872325624	FF	On-Demand	Reactive	ADCYAP1R1	52	31
CC(CCc1cccnc1)=NNC(=O)OC(C)(C)C	ZINC000872325639	CF	On-Demand	Reactive	TBXAS1	33	41
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	ZINC000872325649	GD	On-Demand	Reactive	EPHX2	17	47
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	ZINC000872325649	GD	On-Demand	Reactive	AKR1C3	64	44
CCC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@H]1CCCOC1	ZINC000872325654	GE	On-Demand	Reactive	AKR1C3	55	39
CCC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@@H]1CCCOC1	ZINC000872325655	GE	On-Demand	Reactive	AKR1C3	55	39
CNC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872325677	CE	On-Demand	Mild	PPO2	43	47
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325688	ED	On-Demand	Reactive	PPARD	15	42
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325688	ED	On-Demand	Reactive	AKR1C3	66	44
CCC(=NNC(=O)c1ccc(O)cc1)[C@@H]1CCCOC1	ZINC000872325723	CE	On-Demand	Reactive	ESRRG	19	42
CCC(=NNC(=O)c1ccc(O)cc1)[C@H]1CCCOC1	ZINC000872325724	CE	On-Demand	Reactive	ESRRG	19	42
O=C(NN=CCCCCCO)c1ccc(O)cc1	ZINC000872325726	CD	On-Demand	Reactive	ESRRG	20	44
CC(C)(C)OC(=O)NN=Cc1nncn1Cc1ccccc1	ZINC000872325727	DE	On-Demand	Reactive	PAPA1_CARPA	22	40
CC(C)(C)OC(=O)NN=Cc1nncn1Cc1ccccc1	ZINC000872325727	DE	On-Demand	Reactive	FPR1	41	34
O=C(NN=Cc1cc2c([nH]1)CCCC2)c1ccc(O)cc1	ZINC000872325732	CE	On-Demand	Reactive	ESRRG	18	41
O=C(NN=CC1CC2(C1)OCCO2)c1ccc(O)cc1	ZINC000872325736	CD	On-Demand	Reactive	ESRRG	19	41
O=C(NN=CCCOCC(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325742	GD	On-Demand	Reactive	AKR1C3	55	38
CC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872325743	CE	On-Demand	Reactive	SIGMAR1	35	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	ESR1	102	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	ESR2	68	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	LTA4H	39	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	HRH3	15	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	ESRRG	20	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	EPHX2	23	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	FLT3	17	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	PSMB1	43	38
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(O)cc1	ZINC000872325753	FD	On-Demand	Reactive	ADCYAP1R1	66	45
O=C(NN=C[C@H]1CCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325777	GG	On-Demand	Reactive	AKR1C3	54	37
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325778	GG	On-Demand	Reactive	AKR1C3	54	37
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325784	FE	On-Demand	Reactive	EPHX2	15	48
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325784	FE	On-Demand	Reactive	AKR1C3	65	43
O=C(NN=CC1CC2(C1)OCCO2)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325793	GD	On-Demand	Reactive	AKR1C3	57	38
Cn1ncc(C(=O)OC(C)(C)C)c1C=NNc1ccccc1Cl	ZINC000872325794	EG	On-Demand	Mild	EPHB3	47	35
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325798	FE	On-Demand	Reactive	AKR1C3	65	44
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325798	FE	On-Demand	Reactive	SFRP1	18	40
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325799	FE	On-Demand	Reactive	AKR1C3	65	44
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325799	FE	On-Demand	Reactive	SFRP1	18	40
COC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872325806	CF	On-Demand	Reactive	UREA_CANEN	18	51
COC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872325806	CF	On-Demand	Reactive	ADCYAP1R1	40	36
O=C(NN=CCCCCCO)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325812	GE	On-Demand	Reactive	AKR1C3	58	39
CC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872325814	BE	On-Demand	Reactive	UREA_CANEN	18	49
CC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872325815	CD	On-Demand	Reactive	MLYCD	18	41
CC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872325815	CD	On-Demand	Reactive	L3MBTL3	78	41
CC(CCc1cccnc1)=NNS(=O)(=O)c1ccc(C)cc1	ZINC000872325816	DF	On-Demand	Mild	TBXA2R	25	43
CC(CCc1cccnc1)=NNS(=O)(=O)c1ccc(C)cc1	ZINC000872325816	DF	On-Demand	Mild	TBXAS1	72	55
CC(CCc1cccnc1)=NNS(=O)(=O)c1ccc(C)cc1	ZINC000872325816	DF	On-Demand	Mild	NAMPT	40	47
CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325825	DC	On-Demand	Mild	ESR1	47	36
CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325825	DC	On-Demand	Mild	LTA4H	39	48
CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325825	DC	On-Demand	Mild	HRH3	16	42
CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325825	DC	On-Demand	Mild	PSMB1	42	37
CC(C)(C)OC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872325826	DF	On-Demand	Reactive	L3MBTL3	56	37
O=C(NN=Cc1cnsc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325833	GE	On-Demand	Reactive	AKR1C3	61	40
O=C(NN=Cc1cnsc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872325833	GE	On-Demand	Reactive	ADCYAP1R1	52	32
CN1CCC(C=NNC(=O)c2ccc(O)cc2)CC1	ZINC000872325837	CD	On-Demand	Reactive	HTR1F	42	38
CN1CCC(C=NNC(=O)c2ccc(O)cc2)CC1	ZINC000872325837	CD	On-Demand	Reactive	ESRRG	22	47
CCC(=NNC(C)=O)c1cccc(OC)c1OC	ZINC000872325866	CD	On-Demand	Reactive	KCNK3	46	40
CCC(=NNC(C)=O)c1cccc(OC)c1OC	ZINC000872325866	CD	On-Demand	Reactive	KCNK9	35	40
CNC(=S)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872325873	CE	On-Demand	Mild	UREA_CANEN	23	53
COc1ccc(Cn2cc(C=NNC(=O)OC(C)(C)C)nn2)cc1	ZINC000872325876	EE	On-Demand	Reactive	PROKR1	67	37
O=C(NN=Cc1cn(C2CC2)cn1)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325883	GD	On-Demand	Reactive	AKR1C3	59	39
CNC(=S)NN=C(C)Cc1cccc(C)c1	ZINC000872325889	BE	On-Demand	Mild	PPO2	19	40
CNC(=S)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872325895	DD	On-Demand	Mild	SIGMAR1	21	42
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cn(C)cn1	ZINC000872325905	GD	On-Demand	Reactive	AKR1C3	57	40
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cn(C)cn1	ZINC000872325928	GD	On-Demand	Reactive	AKR1C3	55	40
CC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872325954	CE	On-Demand	Reactive	ADCYAP1R1	41	36
CC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872325954	CE	On-Demand	Reactive	PDS	49	33
CC(C)(C)OC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325955	EE	On-Demand	Reactive	LTA4H	35	43
CC(C)(C)OC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325955	EE	On-Demand	Reactive	HRH3	18	41
CC(C)(C)OC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325955	EE	On-Demand	Reactive	EPHX2	22	45
CC(C)(C)OC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872325955	EE	On-Demand	Reactive	PSMB1	40	38
O=C(NN=Cc1ccnn1CC1CCC1)c1ccc(O)cc1	ZINC000872325963	CE	On-Demand	Reactive	ESRRG	18	40
O=C(NN=CCCOCC(F)F)c1ccc(O)cc1	ZINC000872325969	CD	On-Demand	Reactive	ESRRG	19	41
O=C(NN=CCCOCC(F)F)c1ccc(O)cc1	ZINC000872325969	CD	On-Demand	Reactive	ADCYAP1R1	47	31
Cc1scc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	ZINC000872325972	GF	On-Demand	Reactive	AKR1C3	62	43
COc1cc(C=NNC(=O)OC(C)(C)C)c(Cl)cc1O	ZINC000872325975	DF	On-Demand	Reactive	GCGR	21	44
COc1cc(C=NNC(=O)OC(C)(C)C)c(Cl)cc1O	ZINC000872325975	DF	On-Demand	Reactive	ADCYAP1R1	42	35
CC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872325981	BE	On-Demand	Reactive	CAPN2	47	34
CC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872325981	BE	On-Demand	Reactive	PPO2	40	44
COC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872325983	CE	On-Demand	Reactive	PPO2	39	43
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	ZINC000872325988	GD	On-Demand	Reactive	EPHX2	16	45
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	ZINC000872325988	GD	On-Demand	Reactive	AKR1C3	65	44
O=C(NN=CCCCCCO)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872325994	FD	On-Demand	Reactive	AKR1C3	59	40
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(O)cc1	ZINC000872326003	CF	On-Demand	Reactive	ESRRG	18	40
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(O)cc1	ZINC000872326004	CF	On-Demand	Reactive	ESRRG	18	40
O=C(NN=C1CCCc2ncccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872326018	GE	On-Demand	Reactive	AKR1C3	61	40
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(O)cc1	ZINC000872326019	CG	On-Demand	Reactive	ESRRG	26	47
CNC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872326024	CD	On-Demand	Mild	L3MBTL3	67	38
CN1CCC(C=NNC(=O)c2ccc(N)cc2)CC1	ZINC000872326029	CD	On-Demand	Reactive	ESRRG	20	48
CC(=O)NN=C(C)CCc1cccnc1	ZINC000872326064	BD	On-Demand	Reactive	TBXAS1	50	48
CC(=O)NN=C(C)CCc1cccnc1	ZINC000872326064	BD	On-Demand	Reactive	PPO2	36	41
CC(=O)NN=C(C)CCc1cccnc1	ZINC000872326064	BD	On-Demand	Reactive	NAMPT	32	46
CNC(=S)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326066	CF	On-Demand	Mild	MPO	31	47
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(N)cc1	ZINC000872326075	CG	On-Demand	Reactive	ESRRG	18	40
Nc1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872326090	EF	On-Demand	Reactive	DRD4	26	46
Nc1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872326090	EF	On-Demand	Reactive	SIGMAR1	21	42
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	ESR1	59	39
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	ESR2	42	40
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	LTA4H	53	52
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	HRH3	27	50
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	EPHA2	17	41
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	PSMB1	42	38
O=C1c2ccccc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326102	GE	On-Demand	Mild	MKNK1	21	41
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872326103	FE	On-Demand	Reactive	AKR1C3	64	43
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872326103	FE	On-Demand	Reactive	SFRP1	17	40
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872326104	FE	On-Demand	Reactive	AKR1C3	64	43
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000872326104	FE	On-Demand	Reactive	SFRP1	17	40
COC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872326111	BD	On-Demand	Reactive	NQO2	21	40
O=C(NN=Cc1cnsc1)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872326123	FD	On-Demand	Reactive	AKR1C3	62	41
O=C(NN=Cc1cnsc1)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872326123	FD	On-Demand	Reactive	ADCYAP1R1	57	32
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	ESR1	63	36
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	ESR2	43	36
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	LTA4H	45	46
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	HRH3	30	44
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	EPHX2	22	48
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	FLT3	15	45
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	PSMB1	42	36
COC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326133	DD	On-Demand	Reactive	TBK1	15	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnsc1	ZINC000872326135	ED	On-Demand	Reactive	HTR1A	40	45
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnsc1	ZINC000872326135	ED	On-Demand	Reactive	DRD2	22	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnsc1	ZINC000872326135	ED	On-Demand	Reactive	HTR2A	24	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnsc1	ZINC000872326135	ED	On-Demand	Reactive	DRD3	26	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnsc1	ZINC000872326135	ED	On-Demand	Reactive	HTR7	58	45
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	HTR1D	17	44
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	TACR1	26	43
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	CCKAR	68	42
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MPO	34	44
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	NMBR	26	44
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MC5R	51	38
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MMP2	17	40
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MMP11	60	33
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	CCKBR	70	36
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	GHSR	57	45
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MMP9	17	44
CCOC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326140	CG	On-Demand	Reactive	MC1R	49	38
CCOC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872326149	CF	On-Demand	Reactive	CAPN2	53	33
CCOC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872326149	CF	On-Demand	Reactive	PPO2	42	43
CCOC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872326165	BD	On-Demand	Reactive	AMD1	20	40
CCOC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872326165	BD	On-Demand	Reactive	UREA_CANEN	17	40
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	HTR1D	15	43
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	TACR1	28	43
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	CCKAR	65	42
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	NMBR	58	44
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	MC3R	21	42
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	MC5R	52	42
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	ECE1	40	38
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	MMP11	53	33
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	CCKBR	75	39
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	GHSR	59	37
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	MMP9	19	46
COC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326167	CF	On-Demand	Reactive	MC1R	37	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccccc1O	ZINC000872326170	EG	On-Demand	Reactive	SIGMAR1	21	41
O=C(NN=CC1CC2(C1)OCCO2)c1cc(-c2ccncc2)nc2ccccc12	ZINC000872326183	GG	On-Demand	Reactive	TACR3	16	43
CC(CCOCc1ccccc1)=NNC(=O)C(N)=O	ZINC000872326184	CC	On-Demand	Reactive	PPO2	47	46
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cc2c(O)nccc2o1	ZINC000872326189	GE	On-Demand	Reactive	HTR1A	28	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cc2c(O)nccc2o1	ZINC000872326189	GE	On-Demand	Reactive	DRD2	18	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cc2c(O)nccc2o1	ZINC000872326189	GE	On-Demand	Reactive	HTR7	45	44
O=S(=O)(NN=CCCCCCO)c1ccc(Br)cc1	ZINC000872326193	EE	On-Demand	Mild	IDO1	18	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc(C(F)F)nc1	ZINC000872326196	GF	On-Demand	Reactive	HTR1A	38	45
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc(C(F)F)nc1	ZINC000872326196	GF	On-Demand	Reactive	DRD2	23	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc(C(F)F)nc1	ZINC000872326196	GF	On-Demand	Reactive	HTR2A	25	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc(C(F)F)nc1	ZINC000872326196	GF	On-Demand	Reactive	DRD3	28	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc(C(F)F)nc1	ZINC000872326196	GF	On-Demand	Reactive	HTR7	61	46
O=C(CCN1CCN(c2ccccc2)CC1)NN=CC1CC2(C1)OCCO2	ZINC000872326219	FD	On-Demand	Reactive	HTR1A	34	45
O=C(CCN1CCN(c2ccccc2)CC1)NN=CC1CC2(C1)OCCO2	ZINC000872326219	FD	On-Demand	Reactive	DRD2	17	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=CC1CC2(C1)OCCO2	ZINC000872326219	FD	On-Demand	Reactive	HTR2A	21	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=CC1CC2(C1)OCCO2	ZINC000872326219	FD	On-Demand	Reactive	DRD3	21	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=CC1CC2(C1)OCCO2	ZINC000872326219	FD	On-Demand	Reactive	HTR7	54	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	HTR1A	43	45
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	DRD2	26	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	DRD4	25	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	HTR2A	28	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	DRD3	31	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cn(C2CC2)cn1	ZINC000872326240	FD	On-Demand	Reactive	HTR7	64	44
CCOC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872326244	DE	On-Demand	Reactive	PDE10A	22	44
CC(C)(C)OC(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872326245	CF	On-Demand	Reactive	ADCYAP1R1	42	30
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872326249	GF	On-Demand	Reactive	AKR1C3	55	38
O=C(NN=C[C@H]1CCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000872326250	GF	On-Demand	Reactive	AKR1C3	55	38
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	HTR1A	50	48
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	DRD2	32	45
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	DRD4	44	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	HTR2A	32	48
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	DRD3	41	48
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1ccc2nccnc2c1	ZINC000872326255	GE	On-Demand	Reactive	HTR7	70	46
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccc(O)cc1	ZINC000872326256	EG	On-Demand	Reactive	DRD4	21	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccc(O)cc1	ZINC000872326256	EG	On-Demand	Reactive	ACHE	19	40
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccc(O)cc1	ZINC000872326256	EG	On-Demand	Reactive	SIGMAR1	23	44
CCOC(=O)NN=C(C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872326270	CF	On-Demand	Reactive	CACNA1C	38	44
CCOC(=O)NN=C(C)c1cc([N+](=O)[O-])ccc1SC	ZINC000872326270	CF	On-Demand	Reactive	CACNA1D	54	33
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	LTA4H	32	42
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	HRH3	15	45
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	ESRRG	15	48
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	EPHX2	22	44
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	FLT3	18	43
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	PSMB1	42	38
Nc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872326274	FD	On-Demand	Reactive	ADCYAP1R1	46	40
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	ACE	15	44
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	HTR1D	18	47
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	HTR1B	15	47
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MME	22	41
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	EDNRB	21	40
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	TACR1	31	47
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	CCKAR	46	42
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MPO	50	47
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	BRS3	27	41
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	NMBR	42	44
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MC3R	42	39
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MC5R	66	39
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	GRPR	51	32
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	ECE1	47	42
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MMP11	45	36
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	CCKBR	70	39
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	GHSR	66	43
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	MC1R	57	39
CC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872326282	BF	On-Demand	Reactive	NPR	27	41
Cn1nc2c(c1C=NNC(=O)c1ccc(O)cc1)CCCC2	ZINC000872326295	CD	On-Demand	Reactive	ESRRG	21	45
CC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872326310	BE	On-Demand	Reactive	ADCYAP1R1	40	33
CNC(=S)NN=C(C)CCc1cccnc1	ZINC000872326312	BD	On-Demand	Mild	PPO2	40	43
CNC(=S)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872326319	CD	On-Demand	Mild	UREA_CANEN	21	40
CCOC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872326325	DF	On-Demand	Reactive	ADCYAP1R1	40	34
CCOC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872326325	DF	On-Demand	Reactive	PDS	54	34
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	ESR1	68	37
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	ESR2	46	37
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	LTA4H	48	47
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	HRH3	31	45
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	EPHX2	23	49
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	FLT3	15	45
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	PSMB2	40	37
CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326338	CC	On-Demand	Reactive	PSMB1	43	37
COc1nscc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872326348	FD	On-Demand	Reactive	HTR1A	61	44
COc1nscc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872326348	FD	On-Demand	Reactive	DRD2	42	40
COc1nscc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872326348	FD	On-Demand	Reactive	DRD4	43	35
COc1nscc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872326348	FD	On-Demand	Reactive	DRD3	50	41
COc1nscc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000872326348	FD	On-Demand	Reactive	HTR7	69	42
COc1cc2c(cc1OC)C(=NN1CCOCC1)CCCC2	ZINC000872326381	DE	On-Demand	Mild	PDE3A	20	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872326396	EE	On-Demand	Reactive	HTR1A	54	47
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872326396	EE	On-Demand	Reactive	DRD2	31	43
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872326396	EE	On-Demand	Reactive	HTR2A	32	43
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872326396	EE	On-Demand	Reactive	DRD3	37	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872326396	EE	On-Demand	Reactive	HTR7	63	44
CCOC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872326398	CE	On-Demand	Reactive	GCGR	16	42
CCC(=NNC(=O)OC)c1cccc(OC)c1OC	ZINC000872326408	CE	On-Demand	Reactive	KCNK3	46	40
CCC(=NNC(=O)OC)c1cccc(OC)c1OC	ZINC000872326408	CE	On-Demand	Reactive	KCNK9	35	40
COC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872326412	CD	On-Demand	Reactive	MLYCD	17	40
COC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872326412	CD	On-Demand	Reactive	L3MBTL3	89	43
CCC(CCC(F)(F)F)=NNC(=O)c1cc2ccccc2cc1O	ZINC000872326416	EI	On-Demand	Reactive	PYK	105	43
CN1CCC(C=NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)CC1	ZINC000872326443	FG	On-Demand	Reactive	PRS	31	41
CN1CCC(C=NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)CC1	ZINC000872326443	FG	On-Demand	Reactive	TACR3	19	45
CN1CCC(C=NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)CC1	ZINC000872326443	FG	On-Demand	Reactive	MT-CO2	50	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc2[nH]cncc1-2	ZINC000872326447	GD	On-Demand	Reactive	HTR1A	29	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc2[nH]cncc1-2	ZINC000872326447	GD	On-Demand	Reactive	DRD2	17	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc2[nH]cncc1-2	ZINC000872326447	GD	On-Demand	Reactive	HTR2A	16	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc2[nH]cncc1-2	ZINC000872326447	GD	On-Demand	Reactive	DRD3	20	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc2[nH]cncc1-2	ZINC000872326447	GD	On-Demand	Reactive	HTR7	47	42
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	ESR1	40	40
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	ESR2	28	40
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	LTA4H	42	44
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	HRH3	20	42
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	EPHX2	20	46
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	FLT3	15	43
CCOC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872326453	DD	On-Demand	Reactive	PSMB1	41	36
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	HTR1A	67	48
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	DRD2	43	46
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	DRD4	35	42
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	HTR2A	37	46
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	DRD3	52	45
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	HTR7	92	46
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	PRNP	33	40
CN1CCC(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000872326468	FD	On-Demand	Reactive	CYP2J2	43	30
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	HTR1A	57	51
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	DRD2	31	50
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	DRD4	29	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	HTR2A	32	50
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	DRD3	33	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872326477	EE	On-Demand	Reactive	HTR7	72	50
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	HTR1A	57	51
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	DRD2	31	50
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	DRD4	29	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	HTR2A	32	50
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	DRD3	33	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872326478	EE	On-Demand	Reactive	HTR7	72	50
COC(=O)NN=C(C)CCc1cccnc1	ZINC000872326482	BD	On-Demand	Reactive	TBXAS1	41	45
COC(=O)NN=C(C)CCc1cccnc1	ZINC000872326482	BD	On-Demand	Reactive	CHRNA7	41	38
COC(=O)NN=C(C)CCc1cccnc1	ZINC000872326482	BD	On-Demand	Reactive	PPO2	39	41
COC(=O)NN=C(C)CCc1cccnc1	ZINC000872326482	BD	On-Demand	Reactive	NAMPT	24	44
NC(=O)C(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872326489	DC	On-Demand	Reactive	SIGMAR1	26	42
CC(CCOCc1ccccc1)=NN1CCOCC1	ZINC000872326496	CE	On-Demand	Mild	SLC12A5	45	33
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCCC2(C1)OCCO2	ZINC000872326503	GD	On-Demand	Reactive	HTR1A	28	43
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCCC2(C1)OCCO2	ZINC000872326503	GD	On-Demand	Reactive	HTR7	38	41
NC(=O)C(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872326516	CC	On-Demand	Reactive	AOC1	20	43
NC(=O)C(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872326516	CC	On-Demand	Reactive	AMD1	29	43
CCOC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872326519	CE	On-Demand	Reactive	GCGR	26	44
CCOC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872326519	CE	On-Demand	Reactive	ADCYAP1R1	49	37
NC(=O)C(=O)NN=C1CCCCc2ccccc2C1	ZINC000872326531	CC	On-Demand	Reactive	ABAT	17	53
CN1CCC(C=NNc2ccnc3cc(Cl)ccc23)CC1	ZINC000872326534	DH	On-Demand	Mild	HRP1_PLAFA	137	47
CN1CCC(C=NNc2ccnc3cc(Cl)ccc23)CC1	ZINC000872326534	DH	On-Demand	Mild	HNMT	45	45
CN1CCC(C=NNc2ccnc3cc(Cl)ccc23)CC1	ZINC000872326534	DH	On-Demand	Mild	BOTA	16	41
c1ccc(CN2C[C@H]3C(=NN4CCOCC4)CC[C@H]3C2)cc1	ZINC000872326551	CE	On-Demand	Mild	SIGMAR1	41	47
CCOC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872326595	CE	On-Demand	Reactive	L3MBTL3	63	37
COC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872326600	CE	On-Demand	Reactive	GCGR	17	45
COC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872326600	CE	On-Demand	Reactive	ADCYAP1R1	42	35
Cn1ncc2cc(C=NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21	ZINC000872326603	GD	On-Demand	Reactive	HTR1A	39	42
Cn1ncc2cc(C=NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21	ZINC000872326603	GD	On-Demand	Reactive	HTR2A	29	42
Cn1ncc2cc(C=NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21	ZINC000872326603	GD	On-Demand	Reactive	DRD3	32	42
Cn1ncc2cc(C=NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21	ZINC000872326603	GD	On-Demand	Reactive	HTR7	59	43
CCOC(=O)NN=C(C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872326604	CE	On-Demand	Reactive	CACNA1D	44	34
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	HTR1A	92	46
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	DRD2	59	40
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	DRD4	56	43
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	ADRA1D	40	41
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	HTR2A	41	42
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	HTR2C	20	40
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	ADRA1A	37	41
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	ADRA1B	30	41
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	DRD3	72	45
COc1cncc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	ZINC000872326644	GE	On-Demand	Reactive	HTR7	88	44
CC(CCc1cccnc1)=NNC(=O)C(N)=O	ZINC000872326648	BB	On-Demand	Reactive	TBXAS1	40	44
CC(CCc1cccnc1)=NNC(=O)C(N)=O	ZINC000872326648	BB	On-Demand	Reactive	PPO2	46	43
CC(CCc1cccnc1)=NNC(=O)C(N)=O	ZINC000872326648	BB	On-Demand	Reactive	NAMPT	21	43
COC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872326650	DE	On-Demand	Reactive	ADCYAP1R1	47	36
COC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872326650	DE	On-Demand	Reactive	PDS	55	33
CCOC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872326654	CF	On-Demand	Reactive	AMD1	17	40
CCOC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872326654	CF	On-Demand	Reactive	UREA_CANEN	18	48
CCC(=NNC(=O)c1cc2ccccc2cc1O)[C@H]1CCCOC1	ZINC000872326661	EG	On-Demand	Reactive	PYK	66	41
CCC(=NNC(=O)c1cc2ccccc2cc1O)[C@@H]1CCCOC1	ZINC000872326662	EG	On-Demand	Reactive	PYK	66	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCOCC(F)F	ZINC000872326668	FD	On-Demand	Reactive	HTR1A	36	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCOCC(F)F	ZINC000872326668	FD	On-Demand	Reactive	HTR7	61	43
CCOC(=O)NN=C(CC)c1cccc(OC)c1OC	ZINC000872326673	CF	On-Demand	Reactive	KCNK3	46	41
CCOC(=O)NN=C(CC)c1cccc(OC)c1OC	ZINC000872326673	CF	On-Demand	Reactive	KCNK9	35	41
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	HTR1A	44	45
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	DRD2	25	42
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	DRD4	27	42
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	HTR2A	24	40
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	HTR7	59	42
Cn1nc2c(c1C=NNC(=O)CCN1CCN(c3ccccc3)CC1)CCCC2	ZINC000872326680	GD	On-Demand	Reactive	SLC27A1	25	41
C=CCC1(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CCOCC1	ZINC000872326682	GF	On-Demand	Reactive	HTR1A	22	43
C=CCC1(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)CCOCC1	ZINC000872326682	GF	On-Demand	Reactive	HTR7	37	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872326694	FF	On-Demand	Reactive	HTR1A	37	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872326694	FF	On-Demand	Reactive	DRD2	20	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872326694	FF	On-Demand	Reactive	HTR2A	22	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872326694	FF	On-Demand	Reactive	DRD3	22	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872326694	FF	On-Demand	Reactive	HTR7	57	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872326695	FF	On-Demand	Reactive	HTR1A	37	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872326695	FF	On-Demand	Reactive	DRD2	20	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872326695	FF	On-Demand	Reactive	HTR2A	22	41
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872326695	FF	On-Demand	Reactive	DRD3	22	40
O=C(CCN1CCN(c2ccccc2)CC1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872326695	FF	On-Demand	Reactive	HTR7	57	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNS(=O)(=O)c1ccccc1)C2	ZINC000872326713	GG	On-Demand	Mild	SFRP1	45	36
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1cc2ccccc2cc1O	ZINC000872326742	EH	On-Demand	Reactive	PYK	40	33
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1cc2ccccc2cc1O	ZINC000872326743	EH	On-Demand	Reactive	PYK	40	33
CCOC(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872326772	DD	On-Demand	Reactive	PROKR1	73	37
COC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872326810	CF	On-Demand	Reactive	PDE10A	25	46
COC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872326810	CF	On-Demand	Reactive	UREA_CANEN	21	40
CCOC(=O)NN=C(C)CCc1cccnc1	ZINC000872326811	BE	On-Demand	Reactive	TBXAS1	39	42
CCOC(=O)NN=C(C)CCc1cccnc1	ZINC000872326811	BE	On-Demand	Reactive	PPO2	41	44
CCOC(=O)NN=C(C)CCc1cccnc1	ZINC000872326811	BE	On-Demand	Reactive	NAMPT	16	41
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	MME	51	38
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	PGC	56	37
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	PAPA1_CARPA	72	52
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CCKAR	45	37
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CTSK	42	57
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CTSL	37	52
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	TACR3	18	44
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CAPNS1	53	33
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	REN	74	43
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CTSS	17	52
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CAPN1	62	42
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	CAPN2	55	33
COC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326817	EF	On-Demand	Reactive	FPR1	61	45
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	MME	51	38
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	PGC	56	37
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	PAPA1_CARPA	72	52
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CCKAR	45	37
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CTSK	42	57
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CTSL	37	52
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	TACR3	18	44
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CAPNS1	53	33
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	REN	74	43
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CTSS	17	52
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CAPN1	62	42
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	CAPN2	55	33
COC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872326818	EF	On-Demand	Reactive	FPR1	61	45
CCC(CCC(F)(F)F)=NNC(=O)c1ccccc1O	ZINC000872326831	CG	On-Demand	Reactive	PYK	90	39
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	HTR1A	69	49
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	DRD2	43	49
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	DRD4	32	42
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	HTR2A	38	49
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	DRD3	48	44
O=C(CCN1CCN(c2ccccc2)CC1)NN=CCCCCCO	ZINC000872326832	ED	On-Demand	Reactive	HTR7	101	48
COC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872326833	CE	On-Demand	Reactive	PTPRB	44	34
COC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872326833	CE	On-Demand	Reactive	ADCYAP1R1	56	35
O=C(Cn1nnc(-c2ccccc2)n1)NN=C1CCC[C@H]1F	ZINC000872326854	DD	On-Demand	Reactive	SCARB1	36	46
O=C(Cn1nnc(-c2ccccc2)n1)NN=C1CCC[C@@H]1F	ZINC000872326855	DD	On-Demand	Reactive	SCARB1	36	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	ESR1	40	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	LTA4H	45	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	MAPK14	17	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	MET	21	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	EPHX2	22	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1F	ZINC000872326919	FE	On-Demand	Reactive	STAT6	53	35
Cc1cc(C)nc(SCC(=O)NN=Cc2ccc(C(F)F)nc2)n1	ZINC000872326954	FF	On-Demand	Reactive	PDE10A	15	51
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cc(C)oc1C	ZINC000872326983	DI	On-Demand	Reactive	TACR1	18	41
CCC(CCC(F)(F)F)=NNC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000872327019	FH	On-Demand	Reactive	SMO	15	41
COc1cncc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	ZINC000872327024	FE	On-Demand	Reactive	GCGR	22	42
COc1cncc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	ZINC000872327024	FE	On-Demand	Reactive	PDE10A	15	41
COc1cncc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	ZINC000872327024	FE	On-Demand	Reactive	ADCYAP1R1	47	44
COc1cc(C(=O)NN=CC2CCN(C)CC2)cc(OC)c1OC	ZINC000872327027	ED	On-Demand	Reactive	ACKR3	67	37
O=C(Cn1nnc(-c2ccccc2)n1)NN=CCCCC1CC1	ZINC000872327041	DE	On-Demand	Reactive	SCARB1	34	43
COc1cc(C(=O)NN=Cc2cc(C#N)ccc2N(C)C)cc(OC)c1OC	ZINC000872327047	GE	On-Demand	Reactive	GCGR	23	40
COc1cc(C(=O)NN=Cc2cc(C#N)ccc2N(C)C)cc(OC)c1OC	ZINC000872327047	GE	On-Demand	Reactive	ADCYAP1R1	44	38
O=C(Cn1nnc(-c2ccccc2)n1)NN=CC(F)(F)C(F)(F)F	ZINC000872327051	ED	On-Demand	Reactive	SCARB1	26	40
COc1cc(C(=O)NN=C(C)CCc2cccnc2)cc(OC)c1OC	ZINC000872327061	FF	On-Demand	Reactive	FKBP1A	18	41
COc1cc(C(=O)NN=C(C)CCc2cccnc2)cc(OC)c1OC	ZINC000872327061	FF	On-Demand	Reactive	PTAFR	37	45
COc1cc(C(=O)NN=C(C)CCc2cccnc2)cc(OC)c1OC	ZINC000872327061	FF	On-Demand	Reactive	PTK2	45	38
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	PGC	73	36
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	PAPA1_CARPA	34	44
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CYSP_TRYCR	41	40
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CTSK	27	49
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CTSL	34	44
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	REN	86	43
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CTSS	23	44
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CAPN1	47	37
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	CTSE	43	35
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	PGA5	48	32
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOCC1)Cc1ccccc1	ZINC000872327083	EF	On-Demand	Mild	FPR1	52	41
COc1cc(C(=O)NN=Cc2cc(F)ccc2N(C)C)cc(OC)c1OC	ZINC000872327088	GF	On-Demand	Reactive	GCGR	27	42
COc1cc(C(=O)NN=Cc2cc(F)ccc2N(C)C)cc(OC)c1OC	ZINC000872327088	GF	On-Demand	Reactive	TUBB1	43	39
COc1cc(C(=O)NN=Cc2cc(F)ccc2N(C)C)cc(OC)c1OC	ZINC000872327088	GF	On-Demand	Reactive	ADCYAP1R1	42	40
COc1cc(C(=O)NN=Cc2cc(F)ccc2N(C)C)cc(OC)c1OC	ZINC000872327088	GF	On-Demand	Reactive	ACKR3	55	38
CC(CCc1c[nH]c2ccccc12)=NN1CCOCC1	ZINC000872327089	CF	On-Demand	Mild	HTR1D	22	43
CC(CCc1c[nH]c2ccccc12)=NN1CCOCC1	ZINC000872327089	CF	On-Demand	Mild	HTR1B	18	43
CC(CCc1c[nH]c2ccccc12)=NN1CCOCC1	ZINC000872327089	CF	On-Demand	Mild	TACR1	21	40
CC(CCc1c[nH]c2ccccc12)=NN1CCOCC1	ZINC000872327089	CF	On-Demand	Mild	MPO	27	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872327101	GD	On-Demand	Reactive	ESR1	47	39
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872327101	GD	On-Demand	Reactive	GCGR	18	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872327101	GD	On-Demand	Reactive	EPHX2	19	51
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872327101	GD	On-Demand	Reactive	FLT3	15	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872327101	GD	On-Demand	Reactive	ADCYAP1R1	56	41
CCOc1cc(F)cc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	ZINC000872327102	GG	On-Demand	Reactive	GCGR	15	45
CCOc1cc(F)cc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	ZINC000872327102	GG	On-Demand	Reactive	TUBB1	46	38
CCOc1cc(F)cc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	ZINC000872327102	GG	On-Demand	Reactive	PDE10A	20	46
CCOc1cc(F)cc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	ZINC000872327102	GG	On-Demand	Reactive	ADCYAP1R1	73	45
CC(CCOCc1ccccc1)=NNC(=O)C1CC1	ZINC000872327106	CE	On-Demand	Reactive	NAAA	31	41
CC(CCOCc1ccccc1)=NNC(=O)C1CC1	ZINC000872327106	CE	On-Demand	Reactive	PPO2	33	40
COc1cc(C(=O)NN=Cc2ncc(C)c(OC)c2C)cc(OC)c1OC	ZINC000872327115	FE	On-Demand	Reactive	ADCYAP1R1	42	46
COCCc1ncc(C=NNC(=O)c2ccc3c(c2)OCO3)s1	ZINC000872327132	ED	On-Demand	Reactive	NOS2	42	34
COCCc1ncc(C=NNC(=O)c2ccc3c(c2)OCO3)s1	ZINC000872327132	ED	On-Demand	Reactive	ADCYAP1R1	63	32
O=C(Cn1nnc(-c2ccccc2)n1)NN=CCCOCC(F)F	ZINC000872327133	ED	On-Demand	Reactive	SCARB1	30	40
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C1CC1	ZINC000872327138	CE	On-Demand	Reactive	SIGMAR1	29	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	ESR1	80	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	ESR2	54	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	LTA4H	51	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	HRH3	37	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	EPHX2	23	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	PSMB2	40	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	PSMB1	44	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CC1	ZINC000872327188	DD	On-Demand	Reactive	TBK1	15	41
CC(CCc1cccnc1)=NNC(=O)C1CC1	ZINC000872327189	BD	On-Demand	Reactive	TBXAS1	37	42
CC(CCc1cccnc1)=NNC(=O)C1CC1	ZINC000872327189	BD	On-Demand	Reactive	CHRNA7	45	36
CC(CCc1cccnc1)=NNC(=O)C1CC1	ZINC000872327189	BD	On-Demand	Reactive	C3AR1	40	41
CC(CCc1cccnc1)=NNC(=O)C1CC1	ZINC000872327189	BD	On-Demand	Reactive	NAMPT	41	44
CCC(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872327197	DE	On-Demand	Reactive	PDE10A	18	46
CCC(=O)NN=Cc1cccc(F)c1OC(F)(F)F	ZINC000872327217	CF	On-Demand	Reactive	GCGR	16	42
CCC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872327220	DF	On-Demand	Reactive	ADCYAP1R1	40	35
CCC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872327220	DF	On-Demand	Reactive	PDS	59	34
CN1CCC(C=NNC(=O)c2ccccc2F)CC1	ZINC000872327235	CD	On-Demand	Reactive	HTR1F	50	44
CN1CCC(C=NNC(=O)c2c[nH]c3ccccc23)CC1	ZINC000872327249	CE	On-Demand	Reactive	HTR1D	24	41
CN1CCC(C=NNC(=O)c2c[nH]c3ccccc23)CC1	ZINC000872327249	CE	On-Demand	Reactive	HTR1B	22	41
CN1CCC(C=NNC(=O)c2c[nH]c3ccccc23)CC1	ZINC000872327249	CE	On-Demand	Reactive	HTR1F	88	41
CN1CCC(C=NNC(=O)c2c[nH]c3ccccc23)CC1	ZINC000872327249	CE	On-Demand	Reactive	CFTR	34	40
CN1CCC(C=NNC(=O)c2ccc3c(c2)OCO3)CC1	ZINC000872327272	CD	On-Demand	Reactive	NOS2	51	33
O=C(Cn1nnc(-c2ccccc2)n1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872327279	ED	On-Demand	Reactive	SCARB1	35	44
O=C(Cn1nnc(-c2ccccc2)n1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872327284	ED	On-Demand	Reactive	SCARB1	35	44
C(=NNc1nc2ccccc2[nH]1)C1CC2(C1)OCCO2	ZINC000872327322	CE	On-Demand	Mild	KCNN3	37	40
CC(CCOCc1ccccc1)=NNC(=O)c1ccc2c(c1)OCO2	ZINC000872327353	EG	On-Demand	Reactive	EDNRA	25	42
CCC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872327363	CD	On-Demand	Reactive	PDE10A	24	45
COc1cc(C(=O)NN=CCCCC2CC2)cc(OC)c1OC	ZINC000872327367	DG	On-Demand	Reactive	ACKR3	56	36
c1ccc2[nH]c(NN=C3CC[C@H]4C[C@@H]34)nc2c1	ZINC000872327390	BF	On-Demand	Mild	KCNN3	44	45
COc1ccc(Cn2cc(C=NNC(=O)C3CC3)nn2)cc1	ZINC000872327398	CD	On-Demand	Reactive	PROKR1	67	37
O=C(NN=C(CCc1ccccc1)c1ccccn1)C1CC1	ZINC000872327414	CF	On-Demand	Reactive	PREP	18	41
O=C(NN=C(CCc1ccccc1)c1ccccn1)C1CC1	ZINC000872327414	CF	On-Demand	Reactive	FAAH	52	37
O=C(NN=C(CCc1ccccc1)c1ccccn1)C1CC1	ZINC000872327414	CF	On-Demand	Reactive	CES1	52	34
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(OC)c2)s1	ZINC000872327447	EE	On-Demand	Reactive	GCGR	35	42
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(OC)c2)s1	ZINC000872327447	EE	On-Demand	Reactive	SCD1	38	40
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(OC)c2)s1	ZINC000872327447	EE	On-Demand	Reactive	ADCYAP1R1	77	39
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(OC)c2)s1	ZINC000872327447	EE	On-Demand	Reactive	SCD	30	40
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(OC)c2)s1	ZINC000872327447	EE	On-Demand	Reactive	ENPP1	45	32
CCC(=NNC(=O)C1CC1)c1cccc(OC)c1OC	ZINC000872327496	CE	On-Demand	Reactive	DRD2	29	41
CCC(=NNC(=O)C1CC1)c1cccc(OC)c1OC	ZINC000872327496	CE	On-Demand	Reactive	KCNK3	43	38
O=C(Cn1nnc(-c2ccccc2)n1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872327575	CD	On-Demand	Reactive	SCARB1	34	43
Cc1ccc(NCC(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872327578	FF	On-Demand	Reactive	L3MBTL3	68	36
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	TACR1	28	43
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	CCKAR	49	40
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MPO	47	43
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	BRS3	26	41
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	NMBR	40	42
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MC3R	41	38
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MC5R	62	38
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	GRPR	47	31
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	ECE1	44	40
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MMP11	46	33
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	CCKBR	69	39
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	GHSR	60	42
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MMP9	20	41
CCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872327594	CG	On-Demand	Reactive	MC1R	59	38
CCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872327623	BD	On-Demand	Reactive	NQO2	28	51
CCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872327623	BD	On-Demand	Reactive	MTNR1A	67	40
CCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872327623	BD	On-Demand	Reactive	MTNR1B	59	40
CCC(=NNC(=O)CNc1ccccc1)c1cccc(OC)c1OC	ZINC000872327631	EG	On-Demand	Reactive	KCNK3	54	42
CCC(=NNC(=O)CNc1ccccc1)c1cccc(OC)c1OC	ZINC000872327631	EG	On-Demand	Reactive	KCNK9	46	42
COc1cc(C(=O)NN=C2CCC(CNC(C)=O)CC2)cc(OC)c1OC	ZINC000872327652	GE	On-Demand	Reactive	MTNR1A	25	42
COc1cc(C(=O)NN=C2CCC(CNC(C)=O)CC2)cc(OC)c1OC	ZINC000872327652	GE	On-Demand	Reactive	MTNR1B	22	42
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	TACR1	25	43
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	MC5R	48	35
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	GRPR	46	32
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	MMP11	46	32
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	GHSR	52	39
COc1cc(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)cc(OC)c1OC	ZINC000872327668	GH	On-Demand	Reactive	MC1R	45	35
CCC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)[C@H]1CCCOC1	ZINC000872327688	ED	On-Demand	Reactive	SCARB1	35	43
CCC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)[C@@H]1CCCOC1	ZINC000872327689	ED	On-Demand	Reactive	SCARB1	35	43
CN1CCC(C=NNC(=O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000872327696	EF	On-Demand	Reactive	SLC6A5	26	43
C=CCC1(C=NNC(=O)c2cc(C)nc3ccccc23)CCOCC1	ZINC000872327733	EH	On-Demand	Reactive	ADAM17	56	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CC1	ZINC000872327776	CD	On-Demand	Reactive	MLYCD	17	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CC1	ZINC000872327776	CD	On-Demand	Reactive	L3MBTL3	97	46
CCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872327777	CD	On-Demand	Reactive	GCGR	30	47
CCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872327777	CD	On-Demand	Reactive	ADCYAP1R1	51	38
COc1cc(C(=O)NN=CC(F)(F)C(F)(F)F)cc(OC)c1OC	ZINC000872327797	FF	On-Demand	Reactive	TUBB1	54	42
COc1cc(C(=O)NN=CC(F)(F)C(F)(F)F)cc(OC)c1OC	ZINC000872327797	FF	On-Demand	Reactive	ADCYAP1R1	42	40
CCC(CCC(F)(F)F)=NNC(=O)c1cc(C)nc2ccccc12	ZINC000872327835	EI	On-Demand	Reactive	ADAM17	63	37
O=C(CNc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872327837	FE	On-Demand	Reactive	L3MBTL3	80	38
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(NN=C2CC[C@@H]3C[C@H]23)c1	ZINC000872327854	DG	On-Demand	Reactive	KCNK3	41	33
O=C(NN=C1CCC[C@@H]1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	ZINC000872327856	GF	On-Demand	Reactive	AKR1C3	15	43
O=C(NN=C1CCC[C@H]1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	ZINC000872327857	GF	On-Demand	Reactive	AKR1C3	15	43
CCC(=O)NN=C(C)CCc1cccnc1	ZINC000872327873	BD	On-Demand	Reactive	TBXAS1	42	45
CCC(=O)NN=C(C)CCc1cccnc1	ZINC000872327873	BD	On-Demand	Reactive	PTAFR	31	40
CCC(=O)NN=C(C)CCc1cccnc1	ZINC000872327873	BD	On-Demand	Reactive	NAMPT	24	46
COc1cncc(C=NNC(=O)CSc2nc(C)cc(C)n2)c1C	ZINC000872327904	EE	On-Demand	Reactive	HSP90AB1	45	32
COc1cncc(C=NNC(=O)CSc2nc(C)cc(C)n2)c1C	ZINC000872327904	EE	On-Demand	Reactive	PDE10A	17	51
COc1cncc(C=NNC(=O)CSc2nc(C)cc(C)n2)c1C	ZINC000872327904	EE	On-Demand	Reactive	ENPP1	63	33
CC(=O)Nc1cccc(C=NNC(=O)C2CC2)c1	ZINC000872327909	BD	On-Demand	Reactive	TYK2	49	40
CC(CCc1cccnc1)=NNS(=O)(=O)c1cc(C)ccc1C	ZINC000872327922	EF	On-Demand	Mild	TBXAS1	48	47
CN1CCC(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)CC1	ZINC000872327924	EC	On-Demand	Reactive	SCARB1	36	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	HTR1D	21	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	HTR1B	19	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	CCKAR	41	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	MC3R	15	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	MC5R	38	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	ECE1	41	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	SSTR3	18	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	CCKBR	58	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	GHSR	55	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	MMP9	15	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CC1	ZINC000872327927	CG	On-Demand	Reactive	MC1R	21	42
O=C(c1ccc(C=NNc2ccc(Cl)nn2)cc1)N1CCCC1	ZINC000872327930	EF	On-Demand	Mild	L3MBTL3	53	35
CCC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872327945	BE	On-Demand	Reactive	CAPN2	45	34
CCC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872327945	BE	On-Demand	Reactive	PPO2	42	42
CCC(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872327950	CD	On-Demand	Reactive	PROKR1	67	36
CCC(=O)NN=C[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000872327961	CE	On-Demand	Reactive	CTSK	16	40
CCC(=O)NN=C(CC)c1cccc(OC)c1OC	ZINC000872327969	CE	On-Demand	Reactive	KCNK3	46	40
CCC(=O)NN=C(CC)c1cccc(OC)c1OC	ZINC000872327969	CE	On-Demand	Reactive	KCNK9	40	40
O=C(NN=CCCCCCO)c1c[nH]c2ccccc12	ZINC000872327986	CE	On-Demand	Reactive	CFTR	35	43
Cn1nc2c(c1C=NNc1nc3ccccc3[nH]1)CCCC2	ZINC000872328027	CF	On-Demand	Mild	KCNN3	37	40
CCC(=O)NN=Cc1cccc(Cl)c1C	ZINC000872328031	BF	On-Demand	Reactive	ABAT	19	40
COc1cc(C(=O)NN=CC2(C(C)C)CC2)cc(OC)c1OC	ZINC000872328040	DF	On-Demand	Reactive	ADCYAP1R1	34	40
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	GCGR	42	45
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	TUBB1	40	39
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	PDE10A	19	45
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	ADCYAP1R1	87	43
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	SMO	17	40
COc1cc(C(=O)NN=Cc2ccccc2CC(F)(F)F)cc(OC)c1OC	ZINC000872328045	GH	On-Demand	Reactive	ACKR3	51	37
COc1cc(C(=O)NN=CCCOCC(F)F)cc(OC)c1OC	ZINC000872328089	EE	On-Demand	Reactive	ADCYAP1R1	40	39
F[C@@H]1CCCC1=NNc1nc2ccccc2[nH]1	ZINC000872328171	BF	On-Demand	Mild	KCNN3	47	48
F[C@H]1CCCC1=NNc1nc2ccccc2[nH]1	ZINC000872328173	BF	On-Demand	Mild	KCNN3	47	48
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c(Cl)cc1O	ZINC000872328190	GF	On-Demand	Reactive	GCGR	15	40
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c(Cl)cc1O	ZINC000872328190	GF	On-Demand	Reactive	HSP90AB1	64	38
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c(Cl)cc1O	ZINC000872328190	GF	On-Demand	Reactive	PDE10A	15	62
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c(Cl)cc1O	ZINC000872328190	GF	On-Demand	Reactive	ADCYAP1R1	40	34
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c(Cl)cc1O	ZINC000872328190	GF	On-Demand	Reactive	ENPP1	55	32
COc1cc(C(=O)NN=Cc2csnc2OC)cc(OC)c1OC	ZINC000872328219	FD	On-Demand	Reactive	GCGR	17	41
COc1cc(C(=O)NN=Cc2csnc2OC)cc(OC)c1OC	ZINC000872328219	FD	On-Demand	Reactive	ADCYAP1R1	40	39
O=C(NN=CCCCCCO)c1ccc2c(c1)OCO2	ZINC000872328225	CD	On-Demand	Reactive	CLK1	22	41
O=C(NN=CCCCCCO)c1ccc2c(c1)OCO2	ZINC000872328225	CD	On-Demand	Reactive	DYRK2	44	38
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	ESR1	57	36
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	LTA4H	44	45
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	HRH3	26	43
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	EPHX2	22	48
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	PSMB2	40	40
CCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328246	DD	On-Demand	Reactive	PSMB1	43	40
CN1CCC(C=NNc2nc3ccccc3[nH]2)CC1	ZINC000872328272	CE	On-Demand	Mild	KCNN3	42	43
CCC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872328278	BF	On-Demand	Reactive	MTNR1B	16	40
CCC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872328302	BD	On-Demand	Reactive	ABAT	20	46
CCC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872328302	BD	On-Demand	Reactive	AMD1	20	40
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	ZINC000872328326	GF	On-Demand	Reactive	AKR1C3	24	45
CCC(=NNC(=O)c1cc(C)nc2ccccc12)[C@H]1CCCOC1	ZINC000872328336	EG	On-Demand	Reactive	ADAM17	61	42
CCC(=NNC(=O)c1cc(C)nc2ccccc12)[C@@H]1CCCOC1	ZINC000872328339	EG	On-Demand	Reactive	ADAM17	61	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1COc2ccccc2O1	ZINC000872328341	GE	On-Demand	Reactive	L3MBTL3	44	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1COc2ccccc2O1	ZINC000872328345	GE	On-Demand	Reactive	L3MBTL3	44	34
COc1cc(C(=O)NN=Cc2ccc(CC(F)(F)F)cc2)cc(OC)c1OC	ZINC000872328396	GH	On-Demand	Reactive	GCGR	26	50
COc1cc(C(=O)NN=Cc2ccc(CC(F)(F)F)cc2)cc(OC)c1OC	ZINC000872328396	GH	On-Demand	Reactive	TUBB1	56	43
COc1cc(C(=O)NN=Cc2ccc(CC(F)(F)F)cc2)cc(OC)c1OC	ZINC000872328396	GH	On-Demand	Reactive	PDE10A	24	47
COc1cc(C(=O)NN=Cc2ccc(CC(F)(F)F)cc2)cc(OC)c1OC	ZINC000872328396	GH	On-Demand	Reactive	UREA_CANEN	17	43
COc1cc(C(=O)NN=Cc2ccc(CC(F)(F)F)cc2)cc(OC)c1OC	ZINC000872328396	GH	On-Demand	Reactive	ADCYAP1R1	94	51
O=C(c1ccc(C=NN2CCOCC2)cc1)N1CCCC1	ZINC000872328414	CD	On-Demand	Mild	MLYCD	19	43
O=C(c1ccc(C=NN2CCOCC2)cc1)N1CCCC1	ZINC000872328414	CD	On-Demand	Mild	L3MBTL3	66	40
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CELA1	23	41
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	PGC	55	36
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CMA1	34	41
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CTRA_BOVIN	20	41
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	PAPA1_CARPA	51	47
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CCKAR	54	38
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CTSK	36	52
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CTSL	33	47
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	TIMP3	42	31
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CAPNS1	55	32
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	REN	78	44
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	F11	40	35
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	CAPN1	53	39
CC(C)(C)OC(=O)N[C@H](CC=NNC(=O)C1CC1)Cc1ccccc1	ZINC000872328418	EG	On-Demand	Reactive	FPR1	55	45
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872328423	GD	On-Demand	Reactive	TGM2	45	38
COCCc1ncc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	ZINC000872328433	GE	On-Demand	Reactive	GCGR	17	40
COCCc1ncc(C=NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	ZINC000872328433	GE	On-Demand	Reactive	ADCYAP1R1	42	41
COc1cc(C(=O)NN=C(C)CCOCc2ccccc2)cc(OC)c1OC	ZINC000872328437	GG	On-Demand	Reactive	ADCYAP1R1	47	46
COc1cc(C(=O)NN=C(C)CCOCc2ccccc2)cc(OC)c1OC	ZINC000872328437	GG	On-Demand	Reactive	SMO	19	43
CCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872328474	CE	On-Demand	Reactive	GCGR	21	44
CCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872328474	CE	On-Demand	Reactive	PDE10A	16	55
CCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872328474	CE	On-Demand	Reactive	ADCYAP1R1	43	36
CCC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872328486	CE	On-Demand	Reactive	SIGMAR1	32	42
COc1cc(C(=O)NN=C[C@H]2CCN(c3cnn(C)c3)C2)cc(OC)c1OC	ZINC000872328494	GD	On-Demand	Reactive	ACKR3	40	33
COc1cc(C(=O)NN=C[C@@H]2CCN(c3cnn(C)c3)C2)cc(OC)c1OC	ZINC000872328498	GD	On-Demand	Reactive	ACKR3	40	33
COc1cc(C=NNC(=O)C2CC2)c(Cl)cc1O	ZINC000872328502	CD	On-Demand	Reactive	GCGR	22	44
COc1cc(C=NNC(=O)C2CC2)c(Cl)cc1O	ZINC000872328502	CD	On-Demand	Reactive	ADCYAP1R1	41	35
COc1cc(C(=O)NN=C2CCN(C)[C@H]2C)cc(OC)c1OC	ZINC000872328512	DD	On-Demand	Reactive	ACKR3	41	33
COc1cc(C(=O)NN=C2CCN(C)[C@@H]2C)cc(OC)c1OC	ZINC000872328514	DD	On-Demand	Reactive	ACKR3	41	33
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872328534	FE	On-Demand	Reactive	DYRK2	46	32
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)OCO2	ZINC000872328534	FE	On-Demand	Reactive	L3MBTL3	47	34
CCC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872328554	CD	On-Demand	Reactive	L3MBTL3	73	39
CCC(=O)NN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872328566	DF	On-Demand	Reactive	PPO2	23	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)CNc1ccccc1)C2	ZINC000872328570	GG	On-Demand	Reactive	GPR119	19	40
c1ccc2[nH]c(NN=C(C3CCC3)[C@@H]3CCCO3)nc2c1	ZINC000872328575	CG	On-Demand	Mild	KCNN3	40	40
c1ccc2[nH]c(NN=C(C3CCC3)[C@H]3CCCO3)nc2c1	ZINC000872328576	CG	On-Demand	Mild	KCNN3	40	40
C=CCNC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872328588	CF	On-Demand	Mild	PPO2	38	42
O=C(CNc1ccccc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328603	GD	On-Demand	Reactive	ESR1	43	36
O=C(CNc1ccccc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328603	GD	On-Demand	Reactive	LTA4H	53	48
O=C(CNc1ccccc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328603	GD	On-Demand	Reactive	EPHX2	25	55
O=C(CNc1ccccc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328603	GD	On-Demand	Reactive	FLT3	15	41
O=C(CNc1ccccc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328603	GD	On-Demand	Reactive	PSMB1	40	38
CCC(=O)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872328606	DE	On-Demand	Reactive	PDE10A	20	40
CCOC(=O)/C=C/c1ccc(C=NNC(=O)c2ccc(OC)c(OC)c2)n1C	ZINC000872328616	GE	On-Demand	Reactive	ADCYAP1R1	65	38
CC(CCc1cccnc1)=NNC(=O)CNc1ccc(C)cc1	ZINC000872328640	DF	On-Demand	Reactive	C3AR1	34	41
CC(CCc1cccnc1)=NNC(=O)CNc1ccc(C)cc1	ZINC000872328640	DF	On-Demand	Reactive	NAMPT	24	45
COc1cc(C(=O)NN=Cc2ccnn2CC2CCC2)cc(OC)c1OC	ZINC000872328655	FE	On-Demand	Reactive	PDE10A	18	44
COc1cc(C(=O)NN=Cc2ccnn2CC2CCC2)cc(OC)c1OC	ZINC000872328655	FE	On-Demand	Reactive	ADCYAP1R1	43	41
COc1cc(C(=O)NN=Cc2ccnn2CC2CCC2)cc(OC)c1OC	ZINC000872328655	FE	On-Demand	Reactive	ACKR3	46	35
CCC(CCC(F)(F)F)=NNC(=O)c1c[nH]c2ccccc12	ZINC000872328657	DI	On-Demand	Reactive	CFTR	34	40
COc1cc(C(=O)NN=Cc2csc(C)c2C)cc(OC)c1OC	ZINC000872328658	EG	On-Demand	Reactive	GCGR	21	41
COc1cc(C(=O)NN=Cc2csc(C)c2C)cc(OC)c1OC	ZINC000872328658	EG	On-Demand	Reactive	ADCYAP1R1	46	43
CCC(=NNC(=O)c1ccc(OC)c(OC)c1)[C@@H]1CCCOC1	ZINC000872328661	DF	On-Demand	Reactive	PDE4D	15	46
CCC(=NNC(=O)c1ccc(OC)c(OC)c1)[C@H]1CCCOC1	ZINC000872328662	DF	On-Demand	Reactive	PDE4D	15	46
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	ESR1	66	38
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	ESR2	43	38
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	LTA4H	51	54
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	HRH3	30	46
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	PSMB2	42	42
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	PSMB1	46	42
C(=NN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872328678	DD	On-Demand	Mild	MKNK1	21	40
CC(CCc1cccnc1)=NN1CCOCC1	ZINC000872328709	BD	On-Demand	Mild	CHRNA7	41	34
COc1ccc(OCC(=O)NN=CCCCCCO)cc1	ZINC000872328742	CD	On-Demand	Reactive	PLA2G4B	45	33
CCOc1ccccc1OCC(=O)NN=C1CCC(C)(N(C)C)CC1	ZINC000872328823	EF	On-Demand	Reactive	HCN1	49	32
CCOc1ccccc1OCC(=O)NN=C1CCC(C)(N(C)C)CC1	ZINC000872328823	EF	On-Demand	Reactive	HCN4	42	32
O=C(COc1ccc(Cl)cc1)NN=CC1CC2(C1)OCCO2	ZINC000872328825	DD	On-Demand	Reactive	TRAR	29	45
CC(CCc1cccnc1)=NNC(=O)COc1ccc(C)c(C)c1	ZINC000872328853	EG	On-Demand	Reactive	PTAFR	30	42
CC(CCc1cccnc1)=NNC(=O)COc1ccc(C)c(C)c1	ZINC000872328853	EG	On-Demand	Reactive	PPO2	36	42
CCC(CCC(F)(F)F)=NNC(=O)COc1ccc(OC)cc1	ZINC000872328896	EG	On-Demand	Reactive	PLA2G4B	47	32
CCc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872328905	FD	On-Demand	Mild	LTA4H	29	42
O=C(COc1ccc(Cl)cc1)NN=C1CCCC2(C1)OCCO2	ZINC000872328906	EF	On-Demand	Reactive	TRAR	28	43
CCOc1ccccc1OCC(=O)NN=C1CCN(C)[C@@H]1C	ZINC000872328908	DD	On-Demand	Reactive	HCN1	52	36
CCOc1ccccc1OCC(=O)NN=C1CCN(C)[C@@H]1C	ZINC000872328908	DD	On-Demand	Reactive	HCN4	44	33
CCOc1ccccc1OCC(=O)NN=C1CCN(C)[C@H]1C	ZINC000872328909	DD	On-Demand	Reactive	HCN1	52	36
CCOc1ccccc1OCC(=O)NN=C1CCN(C)[C@H]1C	ZINC000872328909	DD	On-Demand	Reactive	HCN4	44	33
Fc1cccc2cc(C=NNC(=S)NCCN3CCOCC3)cnc12	ZINC000872328953	FD	On-Demand	Mild	STAT6	40	34
Fc1cc(OC(F)F)ccc1C=NNC(=S)NCCN1CCOCC1	ZINC000872328977	GD	On-Demand	Mild	EPHX2	15	40
COCCc1ncc(C=NNC(=O)COc2cccc(C(F)(F)F)c2)s1	ZINC000872329038	GF	On-Demand	Reactive	GALR3	44	31
COCCc1ncc(C=NNC(=O)COc2cccc(C(F)(F)F)c2)s1	ZINC000872329038	GF	On-Demand	Reactive	ADCYAP1R1	44	40
COCCc1ncc(C=NNC(=O)COc2cccc(C(F)(F)F)c2)s1	ZINC000872329038	GF	On-Demand	Reactive	PDS	43	38
CC(=O)Nc1cccc(C=NNC(=S)NCCN2CCOCC2)c1	ZINC000872329049	EC	On-Demand	Mild	DRD4	40	32
CC(=O)Nc1cccc(C=NNC(=S)NCCN2CCOCC2)c1	ZINC000872329049	EC	On-Demand	Mild	EPHX2	30	49
CC(=O)Nc1cccc(C=NNC(=S)NCCN2CCOCC2)c1	ZINC000872329049	EC	On-Demand	Mild	MCHR1	15	40
O=C(NN=Cc1nncn1Cc1ccccc1)NC1CCCCC1	ZINC000872329103	EE	On-Demand	Reactive	CNR2	18	45
O=C(NN=Cc1nncn1Cc1ccccc1)NC1CCCCC1	ZINC000872329103	EE	On-Demand	Reactive	EPHX2	18	44
O=C(COc1ccc(Cl)cc1)NN=Cc1ccnn1CC1CCC1	ZINC000872329109	EF	On-Demand	Reactive	TRAR	26	40
CCOc1ccccc1OCC(=O)NN=Cc1c(OC)cc(F)cc1OC	ZINC000872329126	GF	On-Demand	Reactive	PDE10A	22	42
CN1CCC(C=NNC(=O)CSc2nc3ccccc3s2)CC1	ZINC000872329134	EF	On-Demand	Reactive	HMOX2	33	42
CN1CCC(C=NNC(=O)NC2CCCCC2)CC1	ZINC000872329163	CD	On-Demand	Reactive	EPHX2	20	45
CCOc1ccccc1OCC(=O)NN=CC1(C(C)C)CC1	ZINC000872329166	DG	On-Demand	Reactive	HCN1	50	35
CCOc1ccccc1OCC(=O)NN=CC1(C(C)C)CC1	ZINC000872329166	DG	On-Demand	Reactive	HCN4	42	35
O=C(O)c1cccc2c1C(=NNC(=S)NCCN1CCOCC1)CC2	ZINC000872329176	FC	On-Demand	Mild	EPHX2	16	44
O=C(O)c1cccc2c1C(=NNC(=S)NCCN1CCOCC1)CC2	ZINC000872329176	FC	On-Demand	Mild	HPGDS	22	40
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)Nc1cccnc1	ZINC000872329230	GE	On-Demand	Mild	LTA4H	26	41
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)Nc1cccnc1	ZINC000872329230	GE	On-Demand	Mild	EPHX2	15	45
CN1CCC(C=NNC(=O)COc2ccc(Cl)cc2)CC1	ZINC000872329240	DE	On-Demand	Reactive	SLC6A5	15	41
CN1CCC(C=NNC(=O)COc2ccc(Cl)cc2)CC1	ZINC000872329240	DE	On-Demand	Reactive	CHRNA10	21	41
CN1CCC(C=NNC(=O)COc2ccc(Cl)cc2)CC1	ZINC000872329240	DE	On-Demand	Reactive	TRAR	28	43
CC(CCc1cccnc1)=NNC(=S)NC1CCCCC1	ZINC000872329282	DG	On-Demand	Mild	C3AR1	48	47
COc1ccc(OCC(=O)NN=C(C)CCc2cccnc2)cc1	ZINC000872329284	EF	On-Demand	Reactive	TBXAS1	26	41
COc1ccc(OCC(=O)NN=C(C)CCc2cccnc2)cc1	ZINC000872329284	EF	On-Demand	Reactive	PTAFR	32	42
COc1ccc(OCC(=O)NN=C(C)CCc2cccnc2)cc1	ZINC000872329284	EF	On-Demand	Reactive	C3AR1	30	42
COc1ccc(OCC(=O)NN=C(C)CCc2cccnc2)cc1	ZINC000872329284	EF	On-Demand	Reactive	PPO2	44	47
Cc1nnc(S)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329304	DD	On-Demand	Mild	L3MBTL3	50	36
O=C(NN=CC1CC2(C1)OCCO2)c1ccccc1OCc1ccc(F)cc1	ZINC000872329336	GG	On-Demand	Reactive	HCN1	42	35
Cc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872329356	ED	On-Demand	Mild	LTA4H	36	44
COc1ccc(OCC(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872329412	GE	On-Demand	Reactive	ADCYAP1R1	43	36
COc1ccc(OCC(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872329412	GE	On-Demand	Reactive	HPGD	25	42
O=C(COc1cccc(C(F)(F)F)c1)NN=C1CCC[C@H]1F	ZINC000872329416	DG	On-Demand	Reactive	PDS	43	38
O=C(COc1cccc(C(F)(F)F)c1)NN=C1CCC[C@@H]1F	ZINC000872329417	DG	On-Demand	Reactive	PDS	43	38
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)NC1CCCCC1	ZINC000872329421	EF	On-Demand	Reactive	EPHX2	45	51
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)NC1CCCCC1	ZINC000872329421	EF	On-Demand	Reactive	MLYCD	18	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)NC1CCCCC1	ZINC000872329421	EF	On-Demand	Reactive	L3MBTL3	86	43
C=CCC1(C=NNC(=O)COc2ccc(Cl)cc2)CCOCC1	ZINC000872329430	EG	On-Demand	Reactive	TRAR	26	40
CC(=O)Nc1cccc(C=NNC(=O)NC2CCCCC2)c1	ZINC000872329436	DF	On-Demand	Reactive	EPHX2	40	51
O=C(COc1ccc(Cl)cc1)NN=Cc1nc(C2OCCO2)cs1	ZINC000872329450	FE	On-Demand	Reactive	TRAR	31	46
NS(=O)(=O)c1cccc(C=NNC(=S)NC2CCCCC2)c1	ZINC000872329464	ED	On-Demand	Mild	CA7	18	42
CCOc1ccccc1OCC(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872329468	FF	On-Demand	Reactive	HCN1	43	33
CCOc1ccccc1OCC(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872329468	FF	On-Demand	Reactive	HCN4	42	33
CCOc1ccccc1OCC(=O)NN=CC1CCN(C)CC1	ZINC000872329469	DD	On-Demand	Reactive	HCN1	61	38
CCOc1ccccc1OCC(=O)NN=CC1CCN(C)CC1	ZINC000872329469	DD	On-Demand	Reactive	HCN4	43	34
C=CCNC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329478	DD	On-Demand	Mild	L3MBTL3	42	35
CCOc1ccccc1OCC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329484	GF	On-Demand	Reactive	HCN1	50	34
CCOc1ccccc1OCC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329484	GF	On-Demand	Reactive	HCN4	42	33
COc1cncc(C=NNC(=O)COc2cc(C)ccc2C)c1C	ZINC000872329505	EF	On-Demand	Reactive	PDE10A	15	40
O=C(NN=Cc1cccnc1Br)NC1CCCCC1	ZINC000872329515	EF	On-Demand	Reactive	EPHX2	16	41
CCOc1ccccc1OCC(=O)NN=C1CCCC2(C1)OCCO2	ZINC000872329534	EE	On-Demand	Reactive	HCN1	49	33
CCOc1ccccc1OCC(=O)NN=C1CCCC2(C1)OCCO2	ZINC000872329534	EE	On-Demand	Reactive	HCN4	42	32
O=C(COc1cccc(C(F)(F)F)c1)NN=CCCCCCO	ZINC000872329566	EF	On-Demand	Reactive	PDS	44	39
C=CCNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872329581	ED	On-Demand	Mild	LTA4H	26	42
CN1CCC(C=NNC(=O)COc2ccccc2-c2ccccc2)CC1	ZINC000872329587	FG	On-Demand	Reactive	PTGIR	41	35
CN1CCC(C=NNC(=O)COc2ccccc2-c2ccccc2)CC1	ZINC000872329587	FG	On-Demand	Reactive	HTR7	16	42
O=C(COc1cccc(C(F)(F)F)c1)NN=Cc1cn(C2CC2)cn1	ZINC000872329596	FF	On-Demand	Reactive	CCR2	42	36
O=C(COc1cccc(C(F)(F)F)c1)NN=Cc1cn(C2CC2)cn1	ZINC000872329596	FF	On-Demand	Reactive	PDS	40	35
O=C(COc1cccc(C(F)(F)F)c1)NN=CC1CC2(C1)OCCO2	ZINC000872329599	FE	On-Demand	Reactive	PDS	41	36
CCc1nnc(S)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329623	EE	On-Demand	Mild	L3MBTL3	42	34
O=C(COc1ccc(Cl)cc1)NN=Cc1cn(C2CC2)cn1	ZINC000872329629	DE	On-Demand	Reactive	TRAR	27	41
O=C(COc1ccc(Cl)cc1)NN=CCCCCCO	ZINC000872329634	CE	On-Demand	Reactive	TRAR	21	41
O=C(COc1ccc(Cl)cc1)NN=Cc1cn(C[C@H]2CCOC2)nn1	ZINC000872329645	FD	On-Demand	Reactive	TRAR	26	40
O=C(COc1ccc(Cl)cc1)NN=Cc1cn(C[C@@H]2CCOC2)nn1	ZINC000872329646	FD	On-Demand	Reactive	TRAR	26	40
CCOc1ccccc1OCC(=O)NN=C[C@@H]1CCN(c2cnn(C)c2)C1	ZINC000872329677	FD	On-Demand	Reactive	HCN1	43	31
CCOc1ccccc1OCC(=O)NN=C[C@@H]1CCN(c2cnn(C)c2)C1	ZINC000872329677	FD	On-Demand	Reactive	HCN4	40	31
CN1CCC(C=NNC(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000872329678	EF	On-Demand	Reactive	CACNA1B	47	34
CN1CCC(C=NNC(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000872329678	EF	On-Demand	Reactive	CCR2	56	35
CN1CCC(C=NNC(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000872329678	EF	On-Demand	Reactive	CHRNA10	33	49
CN1CCC(C=NNC(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000872329678	EF	On-Demand	Reactive	GALR3	45	32
CN1CCC(C=NNC(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000872329678	EF	On-Demand	Reactive	PDS	44	37
CCOc1ccccc1OCC(=O)NN=C[C@H]1CCN(c2cnn(C)c2)C1	ZINC000872329680	FD	On-Demand	Reactive	HCN1	43	31
CCOc1ccccc1OCC(=O)NN=C[C@H]1CCN(c2cnn(C)c2)C1	ZINC000872329680	FD	On-Demand	Reactive	HCN4	40	31
COc1ccc(OCC(=O)NN=C2CCC(CNC(C)=O)CC2)cc1	ZINC000872329699	ED	On-Demand	Reactive	MTNR1A	53	44
COc1ccc(OCC(=O)NN=C2CCC(CNC(C)=O)CC2)cc1	ZINC000872329699	ED	On-Demand	Reactive	MTNR1B	50	39
CC(CCc1cccnc1)=NNC(=O)COc1cccc(C)c1	ZINC000872329713	DF	On-Demand	Reactive	PTAFR	29	41
CC(CCc1cccnc1)=NNC(=O)COc1cccc(C)c1	ZINC000872329713	DF	On-Demand	Reactive	C3AR1	34	41
CC(CCc1cccnc1)=NNC(=O)COc1cccc(C)c1	ZINC000872329713	DF	On-Demand	Reactive	PPO2	33	41
O=C(c1ccc(C=NNC(=S)NCCN2CCOCC2)cc1)N1CCCC1	ZINC000872329730	GD	On-Demand	Mild	EPHX2	15	44
CCOc1ccccc1OCC(=O)NN=Cc1cncc(OC)c1C	ZINC000872329735	EE	On-Demand	Reactive	PDE10A	16	42
CC(CCc1cccnc1)=NNC(=S)NCCN1CCOCC1	ZINC000872329745	ED	On-Demand	Mild	CHRNA7	18	41
CC(CCc1cccnc1)=NNC(=S)NCCN1CCOCC1	ZINC000872329745	ED	On-Demand	Mild	NAMPT	15	43
O=C(COc1ccc(Cl)cc1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872329763	DG	On-Demand	Reactive	TRAR	28	42
O=C(COc1ccc(Cl)cc1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872329764	DG	On-Demand	Reactive	TRAR	28	42
CCOc1ccccc1OCC(=O)NN=C(C)c1cn(C)cn1	ZINC000872329771	DD	On-Demand	Reactive	HCN1	47	32
COc1cc(C=NNC(=S)NCCN2CCOCC2)c(Cl)cc1O	ZINC000872329773	FD	On-Demand	Mild	DRD4	41	31
CCOc1ccccc1OCC(=O)NN=C1CCC[C@H]1F	ZINC000872329827	CE	On-Demand	Reactive	HCN1	41	32
CCOc1ccccc1OCC(=O)NN=C1CCC[C@H]1F	ZINC000872329827	CE	On-Demand	Reactive	HCN4	41	32
CCOc1ccccc1OCC(=O)NN=C1CCC[C@@H]1F	ZINC000872329829	CE	On-Demand	Reactive	HCN1	41	32
CCOc1ccccc1OCC(=O)NN=C1CCC[C@@H]1F	ZINC000872329829	CE	On-Demand	Reactive	HCN4	41	32
O=C(COc1ccc(Cl)cc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872329831	GG	On-Demand	Reactive	ADCYAP1R1	31	40
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	PGC	53	34
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	PAPA1_CARPA	37	42
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	CTSK	15	47
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	CTSL	23	42
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	REN	68	38
Cc1nnc(S)n1N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329855	GG	On-Demand	Mild	FPR1	50	40
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	PGC	53	34
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	PAPA1_CARPA	37	42
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	CTSK	15	47
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	CTSL	23	42
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	REN	68	38
Cc1nnc(S)n1N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872329856	GG	On-Demand	Mild	FPR1	50	40
CN1CCC(C=NNC(=O)COc2ccc(C#N)cc2)CC1	ZINC000872329860	DD	On-Demand	Reactive	ADORA2B	18	40
O=C(CSc1nc2ccccc2s1)NN=CCCCCCO	ZINC000872329879	EG	On-Demand	Reactive	HMOX2	33	41
CCOc1ccccc1OCC(=O)NN=C1CCOC(C)(C)C1	ZINC000872329890	DF	On-Demand	Reactive	HCN1	47	32
O=C(COc1ccc(Cl)cc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872329895	CF	On-Demand	Reactive	TRAR	29	45
O=C(COc1ccc(Cl)cc1)NN=C1CCC[C@H]1F	ZINC000872329907	CF	On-Demand	Reactive	TRAR	30	45
O=C(COc1ccc(Cl)cc1)NN=C1CCC[C@@H]1F	ZINC000872329908	CF	On-Demand	Reactive	TRAR	30	45
CCOc1ccccc1OCC(=O)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872329916	EG	On-Demand	Reactive	HCN1	48	32
CCOc1ccccc1OCC(=O)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872329916	EG	On-Demand	Reactive	HCN4	42	32
CCOc1ccccc1OCC(=O)NN=C[C@H]1CCC(F)(F)C1	ZINC000872329917	EG	On-Demand	Reactive	HCN1	48	32
CCOc1ccccc1OCC(=O)NN=C[C@H]1CCC(F)(F)C1	ZINC000872329917	EG	On-Demand	Reactive	HCN4	42	32
CN1CCC(C=NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)CC1	ZINC000872329930	GG	On-Demand	Reactive	ADORA2B	39	42
S=C(NN=Cc1cn(C2CC2)cn1)NC1CCN(Cc2ccccc2)CC1	ZINC000872329936	GF	On-Demand	Mild	DRD4	30	48
S=C(NN=Cc1cn(C2CC2)cn1)NC1CCN(Cc2ccccc2)CC1	ZINC000872329936	GF	On-Demand	Mild	SIGMAR1	30	45
Fc1cccc2cc(C=NNC(=S)NC[C@H]3CCCO3)cnc12	ZINC000872329953	EE	On-Demand	Mild	TNK2	26	40
Fc1cccc2cc(C=NNC(=S)NC[C@@H]3CCCO3)cnc12	ZINC000872329954	EE	On-Demand	Mild	TNK2	26	40
CC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)c1cn(C)cn1	ZINC000872330007	FE	On-Demand	Mild	DRD4	33	42
CC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)c1cn(C)cn1	ZINC000872330007	FE	On-Demand	Mild	ACHE	26	40
CC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)c1cn(C)cn1	ZINC000872330007	FE	On-Demand	Mild	SIGMAR1	34	45
CC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)c1cn(C)cn1	ZINC000872330007	FE	On-Demand	Mild	MCHR1	16	40
COc1cncc(C=NNC(=S)NCCCN2CCOCC2)c1C	ZINC000872330053	FC	On-Demand	Mild	QPCT	42	38
S=C(NC[C@H]1CCCO1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872330095	GD	On-Demand	Mild	TNK2	35	47
S=C(NC[C@@H]1CCCO1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872330096	GD	On-Demand	Mild	TNK2	35	47
F[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330116	EF	On-Demand	Mild	DRD4	35	46
F[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330116	EF	On-Demand	Mild	ACHE	28	43
F[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330116	EF	On-Demand	Mild	CHRM3	15	44
F[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330116	EF	On-Demand	Mild	SIGMAR1	49	50
F[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330116	EF	On-Demand	Mild	MCHR1	18	41
F[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330117	EF	On-Demand	Mild	DRD4	35	46
F[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330117	EF	On-Demand	Mild	ACHE	28	43
F[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330117	EF	On-Demand	Mild	CHRM3	15	44
F[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330117	EF	On-Demand	Mild	SIGMAR1	49	50
F[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330117	EF	On-Demand	Mild	MCHR1	18	41
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)c1cccc(Cl)c1	ZINC000872330134	FF	On-Demand	Reactive	ADCYAP1R1	63	31
S=C(NN=Cc1cnsc1)NC1CCN(Cc2ccccc2)CC1	ZINC000872330166	FF	On-Demand	Mild	DRD4	29	43
S=C(NN=Cc1cnsc1)NC1CCN(Cc2ccccc2)CC1	ZINC000872330166	FF	On-Demand	Mild	ACHE	21	40
S=C(NN=Cc1cnsc1)NC1CCN(Cc2ccccc2)CC1	ZINC000872330166	FF	On-Demand	Mild	SIGMAR1	33	46
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1	ZINC000872330188	EF	On-Demand	Anodyne	SGK1	56	37
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1C(F)(F)F	ZINC000872330222	ED	On-Demand	Anodyne	DYRK2	47	35
O=C(c1ccc(C=Nn2c(S)nnc2C(F)(F)F)cc1)N1CCCC1	ZINC000872330242	FF	On-Demand	Mild	MLYCD	20	44
O=C(COc1ccc(Br)cc1)NN=Cc1cn(C2CC2)cn1	ZINC000872330245	FF	On-Demand	Reactive	TRAR	27	41
CC(CCc1cccnc1)=NNC(=S)NCCCN1CCOCC1	ZINC000872330249	ED	On-Demand	Mild	NAMPT	21	45
CC(C)c1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1	ZINC000872330260	EG	On-Demand	Anodyne	SGK1	47	35
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccn2)cc1C(C)C	ZINC000872330347	FE	On-Demand	Reactive	GRM4	52	41
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccn2)cc1C(C)C	ZINC000872330347	FE	On-Demand	Reactive	PLM1_PLAFA	47	33
CC(=O)Nc1cccc(C=NNC(=S)NCCCN2CCOCC2)c1	ZINC000872330361	FD	On-Demand	Mild	CHRNA7	15	42
CC(=O)Nc1cccc(C=NNC(=S)NCCCN2CCOCC2)c1	ZINC000872330361	FD	On-Demand	Mild	MET	17	43
CC(=O)Nc1cccc(C=NNC(=S)NCCCN2CCOCC2)c1	ZINC000872330361	FD	On-Demand	Mild	EPHX2	32	45
CC(=O)Nc1cccc(C=NNC(=S)NCCCN2CCOCC2)c1	ZINC000872330361	FD	On-Demand	Mild	MCHR1	22	46
CC(=O)Nc1cccc(C=NNC(=S)NCCCN2CCOCC2)c1	ZINC000872330361	FD	On-Demand	Mild	QPCT	46	36
S=C(NCCCN1CCOCC1)NN=Cc1ccc2nccnc2c1	ZINC000872330375	FD	On-Demand	Mild	MET	16	42
O=C(NN=CC1CC2(C1)OCCO2)c1cccc(Cl)c1	ZINC000872330391	CE	On-Demand	Reactive	ABAT	27	43
O=C(NN=C1CCCC2(C1)OCCO2)c1cccc(Cl)c1	ZINC000872330393	DF	On-Demand	Reactive	ABAT	27	44
S=C(NCCCN1CCOCC1)NN=Cc1nncn1Cc1ccccc1	ZINC000872330410	GC	On-Demand	Mild	QPCT	40	34
COC1(CS(=O)(=O)NNC(=O)c2ccccn2)CCC1	ZINC000872330413	CC	On-Demand	Reactive	GRM4	48	38
CCC(CCC(F)(F)F)=NNC(=O)Cn1cnc2ccccc21	ZINC000872330419	EG	On-Demand	Reactive	NR1I2	41	32
O=C(NN=C1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000872330421	DH	On-Demand	Reactive	ABAT	28	45
O=S(=O)(NCCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872330426	FD	On-Demand	Anodyne	HTR2A	24	46
O=S(=O)(NCCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872330426	FD	On-Demand	Anodyne	HTR7	47	49
O=S(=O)(NCCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872330426	FD	On-Demand	Anodyne	CCR1	15	47
O=S(=O)(NCCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872330426	FD	On-Demand	Anodyne	HTR6	21	46
O=S(=O)(NCCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872330426	FD	On-Demand	Anodyne	EPHX2	18	46
Cn1nc2c(c1C=NNC(=O)c1cccc(Cl)c1)CCCC2	ZINC000872330446	DF	On-Demand	Reactive	ABAT	26	42
Cn1nc2c(c1C=NNC(=O)c1cccc(Cl)c1)CCCC2	ZINC000872330446	DF	On-Demand	Reactive	ADCYAP1R1	71	35
O=C(NNS(=O)(=O)CCC1CCCCC1)c1ccccn1	ZINC000872330489	DD	On-Demand	Reactive	BMP1	56	40
O=C(NNS(=O)(=O)CCC1CCCCC1)c1ccccn1	ZINC000872330489	DD	On-Demand	Reactive	GRM4	51	43
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cccnc1OCC(F)F	ZINC000872330491	GE	On-Demand	Anodyne	STAT6	55	33
COc1ccc(Cl)cc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872330507	FF	On-Demand	Anodyne	CPT1A	37	40
COc1ccc(Cl)cc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872330507	FF	On-Demand	Anodyne	CPT2	40	33
COc1ccc(Cl)cc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872330507	FF	On-Demand	Anodyne	SGK1	40	35
Cc1cc(C)c(NS(=O)(=O)c2onc(C3CC3)c2Cl)c(C)c1	ZINC000872330520	EH	On-Demand	Anodyne	FFAR4	24	40
S=C(NN=Cc1cnc2[nH]cncc1-2)NC1CCN(Cc2ccccc2)CC1	ZINC000872330533	GE	On-Demand	Mild	DRD4	24	42
S=C(NN=Cc1cnc2[nH]cncc1-2)NC1CCN(Cc2ccccc2)CC1	ZINC000872330533	GE	On-Demand	Mild	SIGMAR1	27	42
CC(CCc1cccnc1)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000872330611	FE	On-Demand	Reactive	TBXAS1	51	41
CC(CCc1cccnc1)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000872330611	FE	On-Demand	Reactive	NAMPT	31	43
O=C(NN=CCCOCC(F)F)c1cccc(Cl)c1	ZINC000872330615	CF	On-Demand	Reactive	ABAT	26	40
O=C(NN=CCCOCC(F)F)c1cccc(Cl)c1	ZINC000872330615	CF	On-Demand	Reactive	ADCYAP1R1	59	32
CCC(=NNC(=O)c1cccc(Cl)c1)[C@@H]1CCCOC1	ZINC000872330616	CG	On-Demand	Reactive	ABAT	27	44
CCC(=NNC(=O)c1cccc(Cl)c1)[C@H]1CCCOC1	ZINC000872330618	CG	On-Demand	Reactive	ABAT	27	44
O=C(COc1ccc(Br)cc1)NN=C1CCC[C@H]1F	ZINC000872330621	EF	On-Demand	Reactive	TRAR	40	45
O=C(COc1ccc(Br)cc1)NN=C1CCC[C@@H]1F	ZINC000872330622	EF	On-Demand	Reactive	TRAR	40	45
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(Cl)cnc1Cl	ZINC000872330640	GG	On-Demand	Anodyne	JAK2	15	41
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(Cl)cnc1Cl	ZINC000872330640	GG	On-Demand	Anodyne	MAPKAPK5	41	34
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(Cl)cnc1Cl	ZINC000872330640	GG	On-Demand	Anodyne	SGK1	56	35
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(Cl)cnc1Cl	ZINC000872330640	GG	On-Demand	Anodyne	STAT6	58	38
CN1CCC(C=NNC(=O)c2cccc(Cl)c2)CC1	ZINC000872330671	CE	On-Demand	Reactive	ABAT	28	44
CN1CCC(C=NNC(=O)c2cccc(Cl)c2)CC1	ZINC000872330671	CE	On-Demand	Reactive	HTR1F	41	34
CN1CCC(C=NNC(=O)c2cccc(Cl)c2)CC1	ZINC000872330671	CE	On-Demand	Reactive	GRM5	15	44
CN1CCC(C=NNC(=O)c2cccc(Cl)c2)CC1	ZINC000872330671	CE	On-Demand	Reactive	CACNA1I	50	44
CN1CCC(C=NNC(=O)c2cccc(Cl)c2)CC1	ZINC000872330671	CE	On-Demand	Reactive	ADCYAP1R1	42	32
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000872330680	CG	On-Demand	Reactive	ABAT	26	40
O=C(NN=C[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000872330681	CG	On-Demand	Reactive	ABAT	26	40
O=C(NNS(=O)(=O)CCOCC1CCC1)c1ccccc1	ZINC000872330690	DD	On-Demand	Reactive	GRIN2B	17	44
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(F)cc(F)c1O	ZINC000872330702	FE	On-Demand	Clean	STAT6	59	41
Cc1nnc(S)n(N=Cc2ccc(C(=O)N3CCCC3)cc2)c1=O	ZINC000872330753	ED	On-Demand	Mild	L3MBTL3	41	35
COCCc1ncc(C=NNC(=O)COc2ccc(Br)cc2)s1	ZINC000872330759	GF	On-Demand	Reactive	FAS	17	43
Cc1nnc(S)n(N=Cc2ccc(OCCN3CCOCC3)cc2)c1=O	ZINC000872330770	GC	On-Demand	Mild	LTA4H	28	42
O=C(c1ccc(C=NNC(=S)NC[C@@H]2CCCO2)cc1)N1CCCC1	ZINC000872330798	FD	On-Demand	Mild	L3MBTL3	57	36
O=C(c1ccc(C=NNC(=S)NC[C@H]2CCCO2)cc1)N1CCCC1	ZINC000872330799	FD	On-Demand	Mild	L3MBTL3	57	36
O=C(NNS(=O)(=O)CCC1CCCCC1)c1ccccc1	ZINC000872330835	DE	On-Demand	Reactive	GRIN2B	17	43
O=C(NNS(=O)(=O)CCC1CCCCC1)c1ccccc1	ZINC000872330835	DE	On-Demand	Reactive	BMP1	41	36
COc1ccc(Cn2cc(C=NNC(=S)NC[C@@H]3CCCO3)nn2)cc1	ZINC000872330860	FD	On-Demand	Mild	PROKR1	54	32
COc1ccc(Cn2cc(C=NNC(=S)NC[C@H]3CCCO3)nn2)cc1	ZINC000872330862	FD	On-Demand	Mild	PROKR1	54	32
O=C(NN=CCCCCCO)c1cccc(Cl)c1	ZINC000872330865	CF	On-Demand	Reactive	ABAT	29	43
O=C(NN=CCCCCCO)c1cccc(Cl)c1	ZINC000872330865	CF	On-Demand	Reactive	ADCYAP1R1	49	33
S=C(NN=C1CC[C@@H]2C[C@H]12)NC1CCN(Cc2ccccc2)CC1	ZINC000872330871	EF	On-Demand	Mild	DRD4	32	46
S=C(NN=C1CC[C@@H]2C[C@H]12)NC1CCN(Cc2ccccc2)CC1	ZINC000872330871	EF	On-Demand	Mild	ACHE	31	43
S=C(NN=C1CC[C@@H]2C[C@H]12)NC1CCN(Cc2ccccc2)CC1	ZINC000872330871	EF	On-Demand	Mild	SIGMAR1	43	49
S=C(NN=C1CC[C@@H]2C[C@H]12)NC1CCN(Cc2ccccc2)CC1	ZINC000872330871	EF	On-Demand	Mild	MCHR1	15	43
COc1cccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c1	ZINC000872330876	EE	On-Demand	Anodyne	ALPL	24	40
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cccc(Cl)c1	ZINC000872330884	BF	On-Demand	Reactive	ABAT	28	43
CC(CCc1cccnc1)=NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000872330901	EH	On-Demand	Reactive	CYP17A1	15	54
COc1nscc1C=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330911	GF	On-Demand	Mild	DRD4	32	40
COc1nscc1C=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330911	GF	On-Demand	Mild	ACHE	24	41
COc1nscc1C=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000872330911	GF	On-Demand	Mild	SIGMAR1	36	45
C(=NNc1ccccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872330920	EE	On-Demand	Mild	LTA4H	53	50
C(=NNc1ccccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872330920	EE	On-Demand	Mild	HRH3	15	44
C(=NNc1ccccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872330920	EE	On-Demand	Mild	PSMB1	40	37
C=CCC1(C=NNC(=O)c2cccc(Cl)c2)CCOCC1	ZINC000872330935	DG	On-Demand	Reactive	ABAT	26	40
CN1CCC(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	ZINC000872330939	FC	On-Demand	Reactive	AKR1C3	45	36
O=C(NN=Cc1ccnn1CC1CCC1)c1cccc(Cl)c1	ZINC000872330942	DG	On-Demand	Reactive	ADCYAP1R1	69	33
CC(=O)Nc1cccc(C=NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	ZINC000872330969	EG	On-Demand	Reactive	EPHX2	29	43
CC(C)(C)OC(=O)NCc1cccc(C=NNc2ccccn2)c1	ZINC000872331047	EH	On-Demand	Mild	PDS	64	34
Cc1cc(C)nc(NNS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)n1	ZINC000872331055	GG	On-Demand	Anodyne	IDO1	40	41
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1[nH]cnc1Br	ZINC000872331079	GD	On-Demand	Anodyne	STAT6	41	31
O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cc(O)cc(F)c1	ZINC000872331094	FE	On-Demand	Anodyne	STAT6	57	39
Cc1nocc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872331117	DD	On-Demand	Anodyne	STAT6	53	33
C[S@](=O)(=NS(=O)(=O)Nc1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000872331140	GE	On-Demand	Anodyne	JAK2	19	45
C[S@](=O)(=NS(=O)(=O)Nc1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000872331140	GE	On-Demand	Anodyne	STAT6	52	35
Cn1ncc(C(=O)OC(C)(C)C)c1C=NNC(=O)c1cccc(Cl)c1	ZINC000872331162	FF	On-Demand	Reactive	ADCYAP1R1	58	31
CCC(CCC(F)(F)F)=NNC(=O)c1cccc(Cl)c1	ZINC000872331165	DI	On-Demand	Reactive	ABAT	30	49
CC(CCc1cccnc1)=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	ZINC000872331172	GE	On-Demand	Reactive	TBXAS1	34	45
CC(CCc1cccnc1)=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	ZINC000872331172	GE	On-Demand	Reactive	NAMPT	29	45
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ccccn1)C2	ZINC000872331178	EH	On-Demand	Mild	GPR119	20	44
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000872331190	DG	On-Demand	Reactive	ABAT	29	45
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000872331191	DG	On-Demand	Reactive	ABAT	29	45
O=C(NN=C1CCC[C@@H]1F)c1cccc(Cl)c1	ZINC000872331206	CF	On-Demand	Reactive	ABAT	28	43
O=C(NN=C1CCC[C@H]1F)c1cccc(Cl)c1	ZINC000872331207	CF	On-Demand	Reactive	ABAT	28	43
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000872331210	EG	On-Demand	Anodyne	CYNT	35	43
Cc1cc(C)c(NS(=O)(=O)c2cnn(C)c2Br)c(C)c1	ZINC000872331217	FF	On-Demand	Anodyne	FFAR4	28	45
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872331218	FD	On-Demand	Anodyne	JAK2	15	43
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872331218	FD	On-Demand	Anodyne	EPHB4	42	33
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000872331218	FD	On-Demand	Anodyne	STAT6	55	36
COCCc1ncc(C=NNC(=O)CSc2ccc(Cl)cc2)s1	ZINC000872331220	FG	On-Demand	Reactive	FAS	53	36
COC[C@H](C)NC(=S)NN=Cc1cccc(NC(C)=O)c1	ZINC000872331237	DD	On-Demand	Mild	UREA_CANEN	21	42
COC[C@@H](C)NC(=S)NN=Cc1cccc(NC(C)=O)c1	ZINC000872331238	DD	On-Demand	Mild	UREA_CANEN	21	42
COCCc1ncc(C=NNC(=O)c2cccc(N(C)C)c2)s1	ZINC000872331248	EE	On-Demand	Reactive	ADCYAP1R1	74	32
COCCCNC(=S)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872331256	FD	On-Demand	Mild	PROKR1	58	35
CC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872331280	ED	On-Demand	Reactive	CA12	17	44
CC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872331280	ED	On-Demand	Reactive	IDO1	41	52
COC[C@H](C)NC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872331287	GD	On-Demand	Mild	LTA4H	21	40
COC[C@@H](C)NC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872331288	GD	On-Demand	Mild	LTA4H	21	40
COc1ccc(CNC(=S)NN=Cc2cn(C3CC3)cn2)cc1	ZINC000872331292	EE	On-Demand	Mild	PROKR1	42	30
O=C(c1ccc(C=NNC(=S)NC2CC2)cc1)N1CCCC1	ZINC000872331314	DD	On-Demand	Mild	L3MBTL3	85	41
CC(=O)Nc1cccc(C=NNC(=S)NC2CC2)c1	ZINC000872331337	CD	On-Demand	Mild	CSNK2A1	16	40
COC[C@@H](C)NC(=S)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872331426	EF	On-Demand	Mild	GHSR	43	35
COC[C@H](C)NC(=S)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872331427	EF	On-Demand	Mild	GHSR	43	35
CC(CCOCc1ccccc1)=NNC(=S)NC1CC1	ZINC000872331490	CF	On-Demand	Mild	PPO2	38	43
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)NC1CC1	ZINC000872331492	ED	On-Demand	Mild	ESR1	60	36
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)NC1CC1	ZINC000872331492	ED	On-Demand	Mild	LTA4H	36	43
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)NC1CC1	ZINC000872331492	ED	On-Demand	Mild	EPHX2	15	48
COCCCNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872331502	GD	On-Demand	Mild	LTA4H	18	40
COCCCNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872331502	GD	On-Demand	Mild	EPHX2	17	42
COC[C@@H](C)NC(=S)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872331530	GF	On-Demand	Mild	PDS	50	33
COC[C@H](C)NC(=S)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872331531	GF	On-Demand	Mild	PDS	50	33
Cn1nc2c(c1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1)CCCC2	ZINC000872331536	FD	On-Demand	Reactive	CNR1	40	31
COC[C@@H](C)NC(=S)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872331544	FD	On-Demand	Mild	PROKR1	52	31
COC[C@H](C)NC(=S)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872331545	FD	On-Demand	Mild	PROKR1	52	31
CC(=O)NNS(=O)(=O)c1ccc(C(C)(C)C)c(F)c1	ZINC000872331558	CD	On-Demand	Reactive	CA12	15	42
CC(=O)NNS(=O)(=O)c1ccc(C(C)(C)C)c(F)c1	ZINC000872331558	CD	On-Demand	Reactive	IDO1	34	40
COC[C@H](C)NC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872331589	DE	On-Demand	Mild	PPO2	33	42
COC[C@@H](C)NC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872331590	DE	On-Demand	Mild	PPO2	33	42
CC(CCc1cccnc1)=NNC(=S)NC1CC1	ZINC000872331591	CE	On-Demand	Mild	C3AR1	41	42
NS(=O)(=O)c1cccc(C=NNC(=S)NC2CC2)c1	ZINC000872331611	CC	On-Demand	Mild	UREA_CANEN	36	40
COCCCNC(=S)NN=Cc1cccc(NC(C)=O)c1	ZINC000872331643	DD	On-Demand	Mild	UREA_CANEN	24	40
COC[C@@H](C)NC(=S)NN=C(C)CCc1cccnc1	ZINC000872331709	CD	On-Demand	Mild	PPO2	36	40
COC[C@H](C)NC(=S)NN=C(C)CCc1cccnc1	ZINC000872331710	CD	On-Demand	Mild	PPO2	36	40
COc1ccc(CNC(=S)NN=C2CCC(CNC(C)=O)CC2)cc1	ZINC000872331711	FE	On-Demand	Mild	NQO2	20	40
COc1ccc(CNC(=S)NN=C2CCC(CNC(C)=O)CC2)cc1	ZINC000872331711	FE	On-Demand	Mild	MTNR1A	40	47
COc1ccc(CNC(=S)NN=C2CCC(CNC(C)=O)CC2)cc1	ZINC000872331711	FE	On-Demand	Mild	MTNR1B	38	42
COc1ccc(CNC(=S)NN=C(C)CCc2cccnc2)cc1	ZINC000872331783	EG	On-Demand	Mild	PPO2	45	54
COCCCNC(=S)NN=C(C)CCc1cccnc1	ZINC000872331794	CD	On-Demand	Mild	PPO2	37	41
COCCCNC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872331800	DE	On-Demand	Mild	PPO2	36	42
CC(=O)NNS(=O)(=O)c1ccc(OC(C)C)nc1	ZINC000872331856	CC	On-Demand	Reactive	ACACA	17	43
CC(=O)NNS(=O)(=O)c1ccc(OC(C)C)nc1	ZINC000872331856	CC	On-Demand	Reactive	ACACB	24	43
COc1ccc(CNC(=S)NN=Cc2cn(C[C@@H]3CCCO3)nn2)cc1	ZINC000872331868	FD	On-Demand	Mild	PROKR1	43	30
COc1ccc(CNC(=S)NN=Cc2cn(C[C@H]3CCCO3)nn2)cc1	ZINC000872331869	FD	On-Demand	Mild	PROKR1	43	30
N#Cc1ccccc1OCC(=O)NN=CC1CC2(C1)OCCO2	ZINC000872331890	DD	On-Demand	Reactive	ADRB1	42	33
O=C(NN=CCCCCCO)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872331892	FD	On-Demand	Reactive	TGM2	72	39
O=C(NN=CCCCCCO)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872331892	FD	On-Demand	Reactive	F13A1	70	44
COc1ccc(CNC(=S)NN=C(C)c2cn(C)cn2)cc1	ZINC000872331896	DD	On-Demand	Mild	PROKR1	42	30
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cn(C)cn1	ZINC000872331902	GD	On-Demand	Reactive	NAMPT	26	41
COc1ccc(Cn2cc(C=NNC(=S)NC3CC3)nn2)cc1	ZINC000872331936	ED	On-Demand	Mild	PROKR1	54	32
Cc1scc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	ZINC000872331971	GF	On-Demand	Reactive	TGM2	48	35
Cc1scc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	ZINC000872331971	GF	On-Demand	Reactive	F13A1	42	41
S=C(NCc1ccc2c(c1)OCO2)NN=Cc1cn(C[C@@H]2CCCO2)nn1	ZINC000872331981	GD	On-Demand	Mild	NOS2	42	34
S=C(NCc1ccc2c(c1)OCO2)NN=Cc1cn(C[C@H]2CCCO2)nn1	ZINC000872331983	GD	On-Demand	Mild	NOS2	42	34
CN1CCC(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	ZINC000872332072	GD	On-Demand	Reactive	TGM2	67	41
CN1CCC(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	ZINC000872332072	GD	On-Demand	Reactive	F13A1	60	44
O=C(NN=Cc1cnsc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332076	FD	On-Demand	Reactive	TGM2	56	36
O=C(NN=Cc1cnsc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332076	FD	On-Demand	Reactive	F13A1	49	42
O=C(NN=C1CC[C@@H]2C[C@H]12)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332096	ED	On-Demand	Reactive	TGM2	53	39
O=C(NN=C1CC[C@@H]2C[C@H]12)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332096	ED	On-Demand	Reactive	F13A1	41	39
O=C(NN=Cc1cn(C2CC2)cn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332108	GD	On-Demand	Reactive	TGM2	57	37
O=C(NN=Cc1cn(C2CC2)cn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332108	GD	On-Demand	Reactive	F13A1	47	40
CCC(CCC(F)(F)F)=NNC(=O)COc1ccccc1C#N	ZINC000872332131	EG	On-Demand	Reactive	ADRB1	43	33
CC(=O)c1ccccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872332135	EF	On-Demand	Anodyne	PRTN3	60	47
CC(CCc1cccnc1)=NNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000872332137	DI	On-Demand	Reactive	TBXAS1	45	40
CC(CCc1cccnc1)=NNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000872332137	DI	On-Demand	Reactive	PTAFR	29	43
CC(CCc1cccnc1)=NNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000872332137	DI	On-Demand	Reactive	MAP3K5	40	38
CC(CCc1cccnc1)=NNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000872332137	DI	On-Demand	Reactive	NAMPT	32	48
O=C(NN=C1CCCc2ncccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332147	GE	On-Demand	Reactive	NAMPT	33	44
CCC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872332167	EE	On-Demand	Reactive	IDO1	38	43
N#Cc1ccccc1OCC(=O)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872332190	DE	On-Demand	Reactive	ADRB1	43	35
N#Cc1ccccc1OCC(=O)NN=C[C@H]1CCC(F)(F)C1	ZINC000872332191	DE	On-Demand	Reactive	ADRB1	43	35
O=C(NN=C1CCC[C@@H]1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332195	FE	On-Demand	Reactive	TGM2	44	39
O=C(NN=C1CCC[C@H]1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332196	FE	On-Demand	Reactive	TGM2	44	39
CC(=O)c1ccccc1NS(=O)(=O)c1onc(C2CC2)c1Cl	ZINC000872332197	EG	On-Demand	Anodyne	PRTN3	45	40
CCOC(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872332216	DD	On-Demand	Reactive	LEF	37	41
CC(C)n1nc(C(=O)NN=C2CCN(C)[C@@H]2C)c2ccccc2c1=O	ZINC000872332278	ED	On-Demand	Reactive	HTR4	23	41
CC(C)n1nc(C(=O)NN=C2CCN(C)[C@H]2C)c2ccccc2c1=O	ZINC000872332280	ED	On-Demand	Reactive	HTR4	23	41
Cn1ncc2cc(C=NNC(=O)c3ccc(C(C)(C)C)cc3)cnc21	ZINC000872332304	EG	On-Demand	Reactive	MAP3K5	44	33
Cn1ncc2cc(C=NNC(=O)c3ccc(C(C)(C)C)cc3)cnc21	ZINC000872332304	EG	On-Demand	Reactive	ADCYAP1R1	62	35
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1C(F)(F)F	ZINC000872332318	GG	On-Demand	Anodyne	KCNQ2	68	39
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1C(F)(F)F	ZINC000872332318	GG	On-Demand	Anodyne	SFRP1	56	32
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1C(F)(F)F	ZINC000872332318	GG	On-Demand	Anodyne	WNT3	56	32
CCC(=O)NNS(=O)(=O)c1ccc(OC(C)C)nc1	ZINC000872332351	CC	On-Demand	Reactive	ACACB	22	42
COC1(CS(=O)(=O)Nc2ccccc2C(C)=O)CCC1	ZINC000872332364	CE	On-Demand	Anodyne	PRTN3	50	43
CC(=NNC(=O)c1ccc(C(C)(C)C)cc1)c1cn(C)cn1	ZINC000872332369	CF	On-Demand	Reactive	MAP3K5	49	38
CN1CCC(C=NNC(=O)c2ccc(C(C)(C)C)cc2)CC1	ZINC000872332376	DG	On-Demand	Reactive	SLC6A5	21	41
CC(=O)c1ccccc1NS(=O)(=O)c1cncc(OC(C)C)c1	ZINC000872332395	EF	On-Demand	Anodyne	PRTN3	65	51
COCCc1ncc(C=NNC(=S)NCc2ccc3c(c2)OCO3)s1	ZINC000872332407	GE	On-Demand	Mild	NOS2	94	36
COCCc1ncc(C=NNC(=S)Nc2ccc(OC)c(OC)c2)s1	ZINC000872332449	GF	On-Demand	Mild	QPCT	28	43
COCCc1ncc(C=NNC(=S)Nc2ccc(OC)c(OC)c2)s1	ZINC000872332449	GF	On-Demand	Mild	ENPP1	69	35
C=CCC1(C=NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCOCC1	ZINC000872332452	GG	On-Demand	Reactive	HTR4	20	41
COC1(CS(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)CCC1	ZINC000872332470	FD	On-Demand	Reactive	ADAM17	91	47
O=C(NN=CCCOCC(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332478	GD	On-Demand	Reactive	TGM2	73	37
O=C(NN=CCCOCC(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332478	GD	On-Demand	Reactive	F13A1	73	41
CN1CCC(C=NNC(=O)COc2ccccc2C#N)CC1	ZINC000872332484	DD	On-Demand	Reactive	ADRB1	43	34
Cn1ncc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1C(F)(F)F	ZINC000872332506	FG	On-Demand	Anodyne	SGK1	54	39
CCC(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872332511	CD	On-Demand	Reactive	LEF	35	41
CC(=O)c1ccccc1NS(=O)(=O)c1c2c(nn1C)CCCC2	ZINC000872332514	EE	On-Demand	Anodyne	PRTN3	50	42
N#Cc1ccccc1OCC(=O)NN=CC(F)(F)C(F)(F)F	ZINC000872332547	DE	On-Demand	Reactive	ADRB1	46	37
N#Cc1ccccc1OCC(=O)NN=CCCOCC(F)F	ZINC000872332549	DD	On-Demand	Reactive	ADRB1	48	38
CCOC(=O)NNS(=O)(=O)c1ccc(OCC)c(C(C)C)c1	ZINC000872332565	EE	On-Demand	Reactive	MMP12	24	40
Cn1ncc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1Br	ZINC000872332634	GF	On-Demand	Anodyne	KCNQ2	70	38
COc1nscc1C=NNC(=O)c1ccc(OCCC(C)C)cc1	ZINC000872332644	EG	On-Demand	Reactive	ADCYAP1R1	44	32
CC(C)c1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872332671	GE	On-Demand	Mild	LTA4H	25	42
CC(=O)c1ccccc1NS(=O)(=O)CCOCC1CCC1	ZINC000872332707	DE	On-Demand	Anodyne	PRTN3	48	41
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCCC1	ZINC000872332732	FF	On-Demand	Reactive	EPHX2	25	44
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCCC1	ZINC000872332732	FF	On-Demand	Reactive	LEF	22	43
O=C(NN=CC1CC2(C1)OCCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332767	GD	On-Demand	Reactive	TGM2	52	37
O=C(NN=CC1CC2(C1)OCCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332767	GD	On-Demand	Reactive	F13A1	40	41
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332784	GF	On-Demand	Reactive	TGM2	60	38
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332784	GF	On-Demand	Reactive	F13A1	51	41
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332785	GF	On-Demand	Reactive	TGM2	60	38
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872332785	GF	On-Demand	Reactive	F13A1	51	41
N#Cc1ccccc1OCC(=O)NN=C1CCCN2CCSC[C@@H]12	ZINC000872332792	ED	On-Demand	Reactive	ADRB1	42	33
N#Cc1ccccc1OCC(=O)NN=C1CCCN2CCSC[C@H]12	ZINC000872332793	ED	On-Demand	Reactive	ADRB1	42	33
O=S(=O)(Nc1ccccc1N1CCCCC1)c1[nH]cnc1Br	ZINC000872332809	GF	On-Demand	Anodyne	KCNQ2	67	37
CC(=NNC(=S)NCc1ccc2c(c1)OCO2)c1cn(C)cn1	ZINC000872332831	ED	On-Demand	Mild	NOS2	91	35
Cn1nc2c(c1C=NNC(=O)c1nn(C)c(=O)c3ccccc13)CCCC2	ZINC000872332908	FD	On-Demand	Reactive	IMDH_CRYPV	24	40
S=C(NCc1ccc2c(c1)OCO2)NN=Cc1cn(C2CC2)cn1	ZINC000872332909	ED	On-Demand	Mild	NOS2	96	37
N#Cc1ccccc1OCC(=O)NN=CCCCC1CC1	ZINC000872332910	CF	On-Demand	Reactive	ADRB1	42	33
N#Cc1ccccc1OCC(=O)NN=CCCCCCO	ZINC000872332930	CD	On-Demand	Reactive	ADRB1	44	34
CCOC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872332936	FE	On-Demand	Reactive	IDO1	33	40
COCCc1ncc(C=NNC(=O)COc2ccccc2C#N)s1	ZINC000872332939	ED	On-Demand	Reactive	ADRB1	45	35
N#Cc1ccccc1OCC(=O)NN=C1CCC[C@H]1F	ZINC000872332970	CD	On-Demand	Reactive	ADRB1	42	33
N#Cc1ccccc1OCC(=O)NN=C1CCC[C@@H]1F	ZINC000872332971	CD	On-Demand	Reactive	ADRB1	42	33
CCC(=NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)[C@H]1CCCOC1	ZINC000872332976	FF	On-Demand	Reactive	HTR4	22	40
CCC(=NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)[C@@H]1CCCOC1	ZINC000872332977	FF	On-Demand	Reactive	HTR4	22	40
N#Cc1ccccc1OCC(=O)NN=C1CC[C@@H]2C[C@H]12	ZINC000872332984	CD	On-Demand	Reactive	ADRB1	42	33
CC(CCc1cccnc1)=NNC(=O)COc1ccc(C)cc1	ZINC000872332998	DF	On-Demand	Reactive	PPO2	41	47
CC(=O)c1ccccc1NS(=O)(=O)c1cnn(C2CCCC2)c1	ZINC000872332999	EG	On-Demand	Anodyne	PRTN3	62	48
COCCc1ncc(C=NNC(=O)c2ccc(C(C)(C)C)cc2)s1	ZINC000872333008	EG	On-Demand	Reactive	MAP3K5	43	33
COCCc1ncc(C=NNC(=O)c2ccc(C(C)(C)C)cc2)s1	ZINC000872333008	EG	On-Demand	Reactive	ADCYAP1R1	64	36
Cc1ccc(F)c(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c1	ZINC000872333036	EF	On-Demand	Anodyne	SGK1	15	41
Sc1nnc(-c2ccco2)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872333040	GE	On-Demand	Mild	LTA4H	29	42
CC(C)c1nnc(S)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872333043	EF	On-Demand	Mild	L3MBTL3	41	34
COC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872333057	ED	On-Demand	Reactive	IDO1	39	44
COc1ccc(Cn2cc(C=NNC(=O)c3cc4c(s3)CCC4)nn2)cc1	ZINC000872333073	GF	On-Demand	Reactive	PROKR1	43	30
COc1cc(C=NNC(=O)C(C)C)c(F)cc1Br	ZINC000872333098	DF	On-Demand	Reactive	PDE10A	18	42
O=C(c1ccc(C=NN2C(=O)NC3(CCCCC3)C2=O)cc1)N1CCCC1	ZINC000872333115	FF	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=NN2C(=O)NC3(CCCCC3)C2=O)cc1)N1CCCC1	ZINC000872333115	FF	On-Demand	Mild	L3MBTL3	46	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	ACE	17	49
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MME	27	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	EDNRB	40	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	EDNRA	38	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	TACR1	33	48
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	CCKAR	86	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	CTSL	25	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	BRS3	29	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	NMBR	49	47
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MC3R	56	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MC5R	68	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP2	27	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP8	35	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP14	22	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	GRPR	61	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	ECE1	57	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP11	72	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	CCKBR	83	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	GHSR	69	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP9	25	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MC1R	80	39
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	MMP1	23	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	NPR	30	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	SSSIM	27	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	KISS1R	63	32
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)C	ZINC000872333160	CG	On-Demand	Reactive	ERAP2	40	38
COc1cc(C=NNC(=O)C(C)C)c(Cl)cc1O	ZINC000872333161	CE	On-Demand	Reactive	GCGR	28	47
COc1cc(C=NNC(=O)C(C)C)c(Cl)cc1O	ZINC000872333161	CE	On-Demand	Reactive	PDE10A	18	43
COc1cc(C=NNC(=O)C(C)C)c(Cl)cc1O	ZINC000872333161	CE	On-Demand	Reactive	ADCYAP1R1	50	40
CCOC(=O)/C=C/c1ccc(C=NNC(=O)C(C)C)n1C	ZINC000872333202	CD	On-Demand	Reactive	PSMB2	40	30
Cc1c(C=NNC(=O)C(C)C)cccc1[N+](=O)[O-]	ZINC000872333214	BE	On-Demand	Reactive	COLA	115	36
CC(CCc1cccnc1)=NNC(=O)C(C)C	ZINC000872333246	BE	On-Demand	Reactive	TBXAS1	42	44
CC(CCc1cccnc1)=NNC(=O)C(C)C	ZINC000872333246	BE	On-Demand	Reactive	C3AR1	39	40
CC(CCc1cccnc1)=NNC(=O)C(C)C	ZINC000872333246	BE	On-Demand	Reactive	PPO2	35	45
CC(CCc1cccnc1)=NNC(=O)C(C)C	ZINC000872333246	BE	On-Demand	Reactive	NAMPT	31	43
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1OCC	ZINC000872333247	GG	On-Demand	Anodyne	ALPL	16	41
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NN=CCCCCCO)nc2)C1	ZINC000872333280	GF	On-Demand	Mild	GCKR	65	32
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	ACE	26	42
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	MME	74	42
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	CTSB	42	38
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	PAPA1_CARPA	45	37
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	CAPNS1	56	34
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	CAPN1	69	36
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	CAPN2	81	36
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	ACE2	50	36
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	NPR	66	33
CC(CCOCc1ccccc1)=NNC(=O)C(C)C	ZINC000872333284	CF	On-Demand	Reactive	PPO2	40	41
Cc1ccc([N+](=O)[O-])c(C)c1C=NNC(=O)C(C)C	ZINC000872333336	CE	On-Demand	Reactive	COLA	98	39
CN1CCC(C=NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	ZINC000872333409	GC	On-Demand	Mild	TGM2	45	40
CN1CCC(C=NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	ZINC000872333409	GC	On-Demand	Mild	GCKR	52	33
O=S(=O)(Nc1ccc2c(c1)CCC2)c1[nH]cnc1Br	ZINC000872333412	EE	On-Demand	Anodyne	MLNR	15	41
CCc1nc2ccccc2n1CC(=O)NN=Cc1cncc(OC)c1C	ZINC000872333441	FE	On-Demand	Reactive	PDE10A	15	42
CCC(=NNC(=O)C(C)C)c1cccc(OC)c1OC	ZINC000872333468	CF	On-Demand	Reactive	KCNK3	50	39
CCC(=NNC(=O)C(C)C)c1cccc(OC)c1OC	ZINC000872333468	CF	On-Demand	Reactive	KCNK9	42	39
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NN=CC3CCN(C)CC3)nc2)C1	ZINC000872333503	GE	On-Demand	Mild	GCKR	42	33
Cn1nc2c(c1S(=O)(=O)NNC(=O)c1cccc(Cl)c1)CCCC2	ZINC000872333526	FD	On-Demand	Reactive	CNR1	41	31
COc1ccc(Cn2cc(C=NNC(=O)C(C)C)nn2)cc1	ZINC000872333550	DD	On-Demand	Reactive	PROKR1	65	36
CCc1nc2ccccc2n1CC(=O)NN=Cc1c(OC)cc(F)cc1OC	ZINC000872333557	GF	On-Demand	Reactive	PDE10A	15	42
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(CC)cc1	ZINC000872333571	DI	On-Demand	Reactive	ECR	26	40
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(CC)cc1	ZINC000872333571	DI	On-Demand	Reactive	E3UJZ5_SPOLI	25	40
COC(=O)c1ccc(C=NNC(=O)C(C)C)cc1Br	ZINC000872333669	EE	On-Demand	Reactive	PDE10A	21	42
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872333796	GE	On-Demand	Reactive	PIK3CD	18	44
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872333796	GE	On-Demand	Reactive	PIK3CB	28	44
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872333796	GE	On-Demand	Reactive	STAT6	42	31
O=C(NN=Cc1nncn1Cc1ccccc1)c1csc(N2CCOCC2)n1	ZINC000872333870	GD	On-Demand	Reactive	PIK3CB	15	44
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1cccc(O)c1F	ZINC000872333916	GE	On-Demand	Reactive	PIK3CB	42	35
CC(=O)Nc1cccc(C=NNC(=O)c2csc(N3CCOCC3)n2)c1	ZINC000872333994	FD	On-Demand	Reactive	MTOR	40	36
CC(CCc1cccnc1)=NNC(=O)[C@H](C)Oc1ccc(F)cc1	ZINC000872333995	EG	On-Demand	Reactive	PTAFR	26	40
CC(CCc1cccnc1)=NNC(=O)[C@H](C)Oc1ccc(F)cc1	ZINC000872333995	EG	On-Demand	Reactive	C3AR1	33	41
CC(CCc1cccnc1)=NNC(=O)[C@H](C)Oc1ccc(F)cc1	ZINC000872333995	EG	On-Demand	Reactive	PPO2	32	42
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC000872333996	EG	On-Demand	Reactive	PTAFR	26	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC000872333996	EG	On-Demand	Reactive	C3AR1	33	41
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC000872333996	EG	On-Demand	Reactive	PPO2	32	42
CC(=O)Nc1cccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c1	ZINC000872334052	GE	On-Demand	Reactive	PIK3CD	28	41
CC(=O)Nc1cccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c1	ZINC000872334052	GE	On-Demand	Reactive	PIK3CB	39	41
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC(C)C)nc2)cc1	ZINC000872334059	FE	On-Demand	Reactive	ACACB	17	41
CC(=O)Nc1cccc(C=NNC(=S)NC(C)(C)C)c1	ZINC000872334075	CE	On-Demand	Mild	UREA_CANEN	24	40
CC(=O)Nc1cccc(C=NNC(=S)NC(C)(C)C)c1	ZINC000872334075	CE	On-Demand	Mild	IMDH_CRYPV	53	34
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cc(F)ccc1N(C)C	ZINC000872334096	GE	On-Demand	Reactive	PIK3CB	23	41
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cc(F)ccc1N(C)C	ZINC000872334096	GE	On-Demand	Reactive	EPHB4	44	33
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cccc(Cl)c1C	ZINC000872334104	GG	On-Demand	Reactive	PIK3CD	21	43
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cccc(Cl)c1C	ZINC000872334104	GG	On-Demand	Reactive	PIK3CB	47	43
CC(C)(C)NC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872334120	DC	On-Demand	Mild	CA2	19	40
CC(C)(C)NC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872334120	DC	On-Demand	Mild	UREA_CANEN	39	42
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	ACE	15	40
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	HTR1D	61	45
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	HTR1B	57	45
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	HTR1F	70	40
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	CCKAR	54	42
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	BRS3	24	40
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	NMBR	44	37
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	MC5R	44	35
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	ECE1	47	38
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	SSTR3	21	40
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	CCKBR	62	38
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	GHSR	55	40
CN1CCC(C=NNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872334149	CE	On-Demand	Reactive	MC1R	42	35
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872334220	GE	On-Demand	Reactive	SCD1	22	40
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872334220	GE	On-Demand	Reactive	SCD	22	40
Cn1nc2c(c1C=NNC(=O)Cc1c[nH]c3ccccc13)CCCC2	ZINC000872334233	EE	On-Demand	Reactive	ACHE	38	44
Cn1nc2c(c1C=NNC(=O)Cc1c[nH]c3ccccc13)CCCC2	ZINC000872334233	EE	On-Demand	Reactive	BCHE	35	43
Cn1nc2c(c1C=NNC(=O)Cc1c[nH]c3ccccc13)CCCC2	ZINC000872334233	EE	On-Demand	Reactive	NMBR	79	33
CC(C)(C)NC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872334235	EF	On-Demand	Mild	L3MBTL3	53	36
CCC(=NNC(=O)Cc1c[nH]c2ccccc12)[C@@H]1CCCOC1	ZINC000872334248	DG	On-Demand	Reactive	CCKBR	43	37
CCC(=NNC(=O)Cc1c[nH]c2ccccc12)[C@@H]1CCCOC1	ZINC000872334248	DG	On-Demand	Reactive	GHSR	42	36
CCC(=NNC(=O)Cc1c[nH]c2ccccc12)[C@H]1CCCOC1	ZINC000872334249	DG	On-Demand	Reactive	CCKBR	43	37
CCC(=NNC(=O)Cc1c[nH]c2ccccc12)[C@H]1CCCOC1	ZINC000872334249	DG	On-Demand	Reactive	GHSR	42	36
O=C(NN=Cc1cnc(Cl)c(F)c1)c1csc(N2CCOCC2)n1	ZINC000872334253	FD	On-Demand	Reactive	STAT6	43	32
CC(CCc1cccnc1)=NNC(=O)c1sc(N2CCOCC2)nc1C	ZINC000872334278	FE	On-Demand	Reactive	SCD1	33	45
CC(CCc1cccnc1)=NNC(=O)c1sc(N2CCOCC2)nc1C	ZINC000872334278	FE	On-Demand	Reactive	SCD	33	45
CC(CCc1cccnc1)=NNC(=S)NC(C)(C)C	ZINC000872334292	CF	On-Demand	Mild	PPO2	36	40
CCOc1cc(F)cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c1	ZINC000872334344	GF	On-Demand	Reactive	PIK3CB	16	41
CCC(CCC(F)(F)F)=NNC(=O)c1csc(N2CCOCC2)n1	ZINC000872334365	FF	On-Demand	Reactive	ETHR	46	32
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872334370	GF	On-Demand	Reactive	PIK3CD	21	43
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872334370	GF	On-Demand	Reactive	PIK3CB	40	33
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872334370	GF	On-Demand	Reactive	STAT6	45	34
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(F)c(F)c1O	ZINC000872334421	GE	On-Demand	Reactive	PIK3CB	21	41
COc1ccc(Cn2cc(C=NNC(=S)NC(C)(C)C)nn2)cc1	ZINC000872334433	ED	On-Demand	Mild	PROKR1	58	35
O=C(NN=Cc1ccc(C(F)F)nc1)c1csc(N2CCOCC2)n1	ZINC000872334476	FE	On-Demand	Reactive	STAT6	41	29
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1cc(O)ccc1F	ZINC000872334499	GE	On-Demand	Reactive	PIK3CD	17	40
COc1cc(C=NNC(=O)CC(C)C)c(F)cc1Br	ZINC000872334511	EG	On-Demand	Reactive	PDE10A	20	46
CCCNC(=O)c1ccccc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872334512	GE	On-Demand	Anodyne	PRTN3	52	43
CCCOc1ccc(C(=O)NN=Cc2cnc(CCOC)s2)cc1OC	ZINC000872334517	GF	On-Demand	Reactive	ADCYAP1R1	59	39
CCCOc1ccc(C(=O)NN=Cc2c(OC)cc(F)cc2OC)cc1OC	ZINC000872334530	GG	On-Demand	Reactive	GCGR	23	41
CCCOc1ccc(C(=O)NN=Cc2c(OC)cc(F)cc2OC)cc1OC	ZINC000872334530	GG	On-Demand	Reactive	ADCYAP1R1	69	42
CCCOc1ccc(C(=O)NN=Cc2ccc(C(F)F)nc2)cc1OC	ZINC000872334532	FH	On-Demand	Reactive	GCGR	20	42
CCCOc1ccc(C(=O)NN=Cc2ccc(C(F)F)nc2)cc1OC	ZINC000872334532	FH	On-Demand	Reactive	PDE10A	24	40
CCCOc1ccc(C(=O)NN=Cc2ccc(C(F)F)nc2)cc1OC	ZINC000872334532	FH	On-Demand	Reactive	ADCYAP1R1	71	44
CCCOc1ccc(C(=O)NN=Cc2cnsc2)cc1OC	ZINC000872334546	DF	On-Demand	Reactive	GCGR	24	41
CCCOc1ccc(C(=O)NN=Cc2cnsc2)cc1OC	ZINC000872334546	DF	On-Demand	Reactive	ADCYAP1R1	73	44
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1C(F)(F)F	ZINC000872334575	GE	On-Demand	Anodyne	PRTN3	47	35
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1C(F)(F)F	ZINC000872334575	GE	On-Demand	Anodyne	CCR8	46	32
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1C(F)(F)F	ZINC000872334575	GE	On-Demand	Anodyne	SFRP1	84	34
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1C(F)(F)F	ZINC000872334575	GE	On-Demand	Anodyne	WNT3	61	34
CCCOc1ccc(C(=O)NN=Cc2cn(CCC)nn2)cc1OC	ZINC000872334576	EE	On-Demand	Reactive	ADCYAP1R1	44	37
CCCOc1ccc(C(=O)NN=Cc2cn(C3CC3)cn2)cc1OC	ZINC000872334589	EF	On-Demand	Reactive	ADCYAP1R1	43	36
O=C(c1ccccc1NS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCCC1	ZINC000872334598	GH	On-Demand	Anodyne	PRTN3	48	35
O=C(c1ccccc1NS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCCC1	ZINC000872334598	GH	On-Demand	Anodyne	SFRP1	54	36
COc1ccc(Cn2cc(C=NNC(=O)CC(C)C)nn2)cc1	ZINC000872334602	DD	On-Demand	Reactive	PROKR1	58	35
CCCOc1ccc(C(=O)NN=Cc2cnc3onc(C)c3c2)cc1OC	ZINC000872334611	FG	On-Demand	Reactive	GCGR	22	40
CCCOc1ccc(C(=O)NN=Cc2cnc3onc(C)c3c2)cc1OC	ZINC000872334611	FG	On-Demand	Reactive	ADCYAP1R1	69	41
COC1(CS(=O)(=O)NNC(=O)c2ccccc2C)CCC1	ZINC000872334618	DD	On-Demand	Reactive	CCR8	54	34
COc1cc(C=NNC(=O)CC(C)C)c(Cl)cc1O	ZINC000872334619	CF	On-Demand	Reactive	GCGR	26	46
COc1cc(C=NNC(=O)CC(C)C)c(Cl)cc1O	ZINC000872334619	CF	On-Demand	Reactive	ADCYAP1R1	50	40
CCCOc1ccc(C(=O)NN=Cc2cncc(OC)c2C)cc1OC	ZINC000872334625	FF	On-Demand	Reactive	GCGR	33	43
CCCOc1ccc(C(=O)NN=Cc2cncc(OC)c2C)cc1OC	ZINC000872334625	FF	On-Demand	Reactive	ADCYAP1R1	66	39
CC(CCc1cccnc1)=NNC(=O)CSc1ccc(C)cc1	ZINC000872334654	EH	On-Demand	Reactive	C3AR1	36	42
CC(CCc1cccnc1)=NNCc1ccccc1	ZINC000872334658	CG	On-Demand	Mild	TBXAS1	49	43
CC(CCc1cccnc1)=NNCc1ccccc1	ZINC000872334658	CG	On-Demand	Mild	PTAFR	21	40
CC(CCc1cccnc1)=NNCc1ccccc1	ZINC000872334658	CG	On-Demand	Mild	NAMPT	37	48
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1Br	ZINC000872334706	GD	On-Demand	Anodyne	PRTN3	46	34
Cn1ncc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1Br	ZINC000872334706	GD	On-Demand	Anodyne	CCR8	50	33
CN1CCC(C=NNC(=O)CCSc2ccc(F)cc2)CC1	ZINC000872334720	DF	On-Demand	Reactive	HTR1F	40	36
CCCOc1ccc(C(=O)NN=C2CCC(CNC(C)=O)CC2)cc1OC	ZINC000872334722	GF	On-Demand	Reactive	MTNR1A	26	42
CCCOc1ccc(C(=O)NN=C2CCC(CNC(C)=O)CC2)cc1OC	ZINC000872334722	GF	On-Demand	Reactive	MTNR1B	21	42
CCCOc1ccc(C(=O)NN=C2CCN(C)[C@@H]2C)cc1OC	ZINC000872334727	DE	On-Demand	Reactive	SLC9A1	55	30
CCCOc1ccc(C(=O)NN=C2CCN(C)[C@H]2C)cc1OC	ZINC000872334728	DE	On-Demand	Reactive	SLC9A1	55	30
COc1ccc(Cn2cc(C=NNC(=O)Cn3nc(C)cc3C)nn2)cc1	ZINC000872334732	FD	On-Demand	Reactive	PROKR1	56	33
CCCOc1ccc(C(=O)NN=Cc2c3c(nn2C)CCCC3)cc1OC	ZINC000872334735	FF	On-Demand	Reactive	ADCYAP1R1	44	36
CC(CCc1cccnc1)=NNC(=O)CC(C)C	ZINC000872334783	BF	On-Demand	Reactive	TBXAS1	36	42
CC(CCc1cccnc1)=NNC(=O)CC(C)C	ZINC000872334783	BF	On-Demand	Reactive	PPO2	32	41
CC(CCc1cccnc1)=NNC(=O)CC(C)C	ZINC000872334783	BF	On-Demand	Reactive	NAMPT	15	44
O=C(CN1CCCC1=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872334808	EC	On-Demand	Reactive	L3MBTL3	40	34
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000872334823	GG	On-Demand	Mild	TBXAS1	22	42
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000872334823	GG	On-Demand	Mild	C3AR1	37	42
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000872334823	GG	On-Demand	Mild	TGM2	24	41
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000872334823	GG	On-Demand	Mild	NAMPT	62	53
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN1CCCC1=O	ZINC000872334827	EE	On-Demand	Reactive	NMBR	45	33
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN1CCCC1=O	ZINC000872334827	EE	On-Demand	Reactive	GHSR	41	35
COC(=O)c1ccc(C=NNC(=O)CC(C)C)cc1Br	ZINC000872334850	EF	On-Demand	Reactive	PDE10A	21	41
O=C(NN=CCCCCCO)c1ccc(Cl)cc1Cl	ZINC000872334856	DG	On-Demand	Reactive	PYGL	24	41
O=C(CN1CCCC1=O)NN=Cc1cccc(F)c1I	ZINC000872334857	GD	On-Demand	Reactive	ABAT	19	41
Cc1c(C=NNC(=O)CC(C)C)cccc1[N+](=O)[O-]	ZINC000872334878	CE	On-Demand	Reactive	COLA	89	32
COc1ccc(Cn2cc(C=NNC(=O)CCN3CCCCCC3)nn2)cc1	ZINC000872334884	GE	On-Demand	Reactive	HRH3	23	41
COc1ccc(Cn2cc(C=NNC(=O)CCN3CCCCCC3)nn2)cc1	ZINC000872334884	GE	On-Demand	Reactive	PROKR1	54	32
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C(F)(F)F	ZINC000872334888	GE	On-Demand	Anodyne	MAPK14	46	39
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C(F)(F)F	ZINC000872334888	GE	On-Demand	Anodyne	MAPK13	70	36
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C(F)(F)F	ZINC000872334888	GE	On-Demand	Anodyne	CCR2	45	38
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C(F)(F)F	ZINC000872334888	GE	On-Demand	Anodyne	SFRP1	85	33
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C(F)(F)F	ZINC000872334888	GE	On-Demand	Anodyne	WNT3	53	33
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	ESR1	69	39
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	ESR2	46	39
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	LTA4H	70	63
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	HRH3	30	49
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	PSMB2	41	41
C(=NNCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872334907	EF	On-Demand	Mild	PSMB1	44	41
N#Cc1cc(F)cc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	ZINC000872334961	GG	On-Demand	Mild	PRTN3	43	31
CCCOc1ccc(C(=O)NN=Cc2csnc2OC)cc1OC	ZINC000872334967	EF	On-Demand	Reactive	GCGR	28	42
CCCOc1ccc(C(=O)NN=Cc2csnc2OC)cc1OC	ZINC000872334967	EF	On-Demand	Reactive	ADCYAP1R1	49	38
CCCNC(=S)NN=C(C)CCc1cccnc1	ZINC000872334991	CE	On-Demand	Mild	PPO2	39	40
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCC1	ZINC000872334992	FF	On-Demand	Mild	PRTN3	44	32
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCC1	ZINC000872334992	FF	On-Demand	Mild	CCR8	51	35
O=C(CCN1CCCCCC1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872334997	FF	On-Demand	Reactive	L3MBTL3	55	42
O=C(CCN1CCCCCC1)NN=C1CCCc2ncccc21	ZINC000872335061	DF	On-Demand	Reactive	HNMT	48	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)Cn1nc(C)cc1C	ZINC000872335128	EG	On-Demand	Reactive	MC5R	48	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)Cn1nc(C)cc1C	ZINC000872335128	EG	On-Demand	Reactive	GHSR	41	36
CCCOc1ccc(C(=O)NN=C(C)CCc2cccnc2)cc1OC	ZINC000872335143	FH	On-Demand	Reactive	PTAFR	35	49
COCCc1ncc(C=NNC(=O)CSc2ccc(C)cc2)s1	ZINC000872335163	EF	On-Demand	Reactive	FAS	53	34
CCCOc1ccc(C(=O)NN=Cc2c(C)ccnc2N)cc1OC	ZINC000872335177	EF	On-Demand	Reactive	ADCYAP1R1	46	40
O=C(c1ccc(C=NNCc2ccccc2)cc1)N1CCCC1	ZINC000872335184	DG	On-Demand	Mild	L3MBTL3	78	43
CC(=NNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1cc(O)ccc1F	ZINC000872335198	GF	On-Demand	Mild	GCKR	45	33
CC(=O)Nc1cccc(C=NNC(=O)CCN2CCCCCC2)c1	ZINC000872335233	EE	On-Demand	Reactive	ABAT	19	43
CC(=O)Nc1cccc(C=NNC(=O)CCN2CCCCCC2)c1	ZINC000872335233	EE	On-Demand	Reactive	CHRNA7	20	57
CC(=O)Nc1cccc(C=NNC(=O)CCN2CCCCCC2)c1	ZINC000872335233	EE	On-Demand	Reactive	MCHR1	28	40
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000872335251	GG	On-Demand	Mild	PRTN3	43	31
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000872335251	GG	On-Demand	Mild	CCR8	51	36
C=CCC1(C=NNC(=O)c2ccc(Cl)cc2Cl)CCOCC1	ZINC000872335258	EI	On-Demand	Reactive	SLC6A9	44	37
CCCOc1ccc(C(=O)NN=Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000872335263	FG	On-Demand	Reactive	GCGR	27	40
CCCOc1ccc(C(=O)NN=Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000872335263	FG	On-Demand	Reactive	PDE10A	19	41
CCCOc1ccc(C(=O)NN=Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000872335263	FG	On-Demand	Reactive	ADCYAP1R1	79	47
CCCOc1ccc(C(=O)NN=Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000872335263	FG	On-Demand	Reactive	KCNK3	48	40
CCCOc1ccc(C(=O)NN=Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000872335263	FG	On-Demand	Reactive	KCNK9	48	40
Cn1ncc(S(=O)(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1Br	ZINC000872335266	GD	On-Demand	Anodyne	MAPK13	49	33
C[S@](=O)(=NS(=O)(=O)Nc1ccc2c(c1)OCCCO2)c1ccccc1	ZINC000872335278	GF	On-Demand	Anodyne	PKM	25	40
CCCOc1ccc(C(=O)NN=CC2CCN(C)CC2)cc1OC	ZINC000872335283	EF	On-Demand	Reactive	SLC9A1	55	31
CCCOc1ccc(C(=O)NN=CC2CCN(C)CC2)cc1OC	ZINC000872335283	EF	On-Demand	Reactive	ACKR3	54	36
CN1CCC(C=NNC(=O)c2ccc(COc3ccccc3)o2)CC1	ZINC000872335304	EF	On-Demand	Reactive	SLC6A5	33	45
CCCOc1ccc(C(=O)NN=Cc2cnc3c(cnn3C)c2)cc1OC	ZINC000872335311	FF	On-Demand	Reactive	ADCYAP1R1	66	39
O=C(CCN1CCCCCC1)NN=Cc1cnc2c(F)cccc2c1	ZINC000872335386	EG	On-Demand	Reactive	CHRNA7	18	41
O=C(CCN1CCCCCC1)NN=Cc1cc2c(O)nccc2o1	ZINC000872335388	EE	On-Demand	Reactive	HNMT	41	31
CCCNC(=S)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872335397	ED	On-Demand	Mild	PROKR1	71	36
Cn1nc2c(c1C=NNC(=O)c1ccc(Cl)cc1Cl)CCCC2	ZINC000872335408	FG	On-Demand	Reactive	CNR1	54	33
Cn1nc2c(c1C=NNC(=O)c1ccc(Cl)cc1Cl)CCCC2	ZINC000872335408	FG	On-Demand	Reactive	SLC6A9	40	31
Cn1nc2c(c1C=NNC(=O)c1ccc(Cl)cc1Cl)CCCC2	ZINC000872335408	FG	On-Demand	Reactive	HEMY	18	41
O=C1CCCN1c1ccc(NS(=O)(=O)c2ccc(C(F)F)o2)cc1Cl	ZINC000872335418	GH	On-Demand	Anodyne	PKM	17	44
COc1cc(C(=O)NN=C2CCC(CNC(C)=O)CC2)ccc1OC(C)C	ZINC000872335463	GF	On-Demand	Reactive	MTNR1A	26	44
COc1cc(C(=O)NN=C2CCC(CNC(C)=O)CC2)ccc1OC(C)C	ZINC000872335463	GF	On-Demand	Reactive	MTNR1B	22	44
COc1cc(C(=O)NN=Cc2cnsc2)ccc1OC(C)C	ZINC000872335464	DF	On-Demand	Reactive	GCGR	21	44
COc1cc(C(=O)NN=Cc2cnsc2)ccc1OC(C)C	ZINC000872335464	DF	On-Demand	Reactive	ADCYAP1R1	77	44
Cc1nnc(C)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872335470	ED	On-Demand	Mild	LTA4H	47	48
Cc1nnc(C)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872335470	ED	On-Demand	Mild	HRH3	24	41
Cc1nnc(C)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872335470	ED	On-Demand	Mild	PSMB1	42	37
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC000872335496	DG	On-Demand	Reactive	CNR1	40	30
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC000872335496	DG	On-Demand	Reactive	HTR1F	32	46
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC000872335496	DG	On-Demand	Reactive	SLC6A9	48	37
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCC(C)CC1	ZINC000872335501	EF	On-Demand	Reactive	CHRNA7	42	35
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCC(C)CC1	ZINC000872335501	EF	On-Demand	Reactive	C3AR1	41	42
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCC(C)CC1	ZINC000872335501	EF	On-Demand	Reactive	NAMPT	18	41
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCC(C)CC1	ZINC000872335502	EF	On-Demand	Reactive	CHRNA7	42	35
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCC(C)CC1	ZINC000872335502	EF	On-Demand	Reactive	C3AR1	41	42
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCC(C)CC1	ZINC000872335502	EF	On-Demand	Reactive	NAMPT	18	41
COc1cc(C=NNC(=O)CN2CCCC2=O)c(Cl)cc1O	ZINC000872335521	ED	On-Demand	Reactive	ADCYAP1R1	41	33
COc1cc(C(=O)NN=Cc2cnc3onc(C)c3c2)ccc1OC(C)C	ZINC000872335536	FG	On-Demand	Reactive	GCGR	24	43
COc1cc(C(=O)NN=Cc2cnc3onc(C)c3c2)ccc1OC(C)C	ZINC000872335536	FG	On-Demand	Reactive	PDE10A	24	43
COc1cc(C(=O)NN=Cc2cnc3onc(C)c3c2)ccc1OC(C)C	ZINC000872335536	FG	On-Demand	Reactive	ADCYAP1R1	75	42
COc1ccc(Cn2cc(C=Nn3c(C)nnc3C)nn2)cc1	ZINC000872335554	DD	On-Demand	Mild	PROKR1	60	33
COc1cc(C(=O)NN=Cc2csnc2OC)ccc1OC(C)C	ZINC000872335576	EF	On-Demand	Reactive	GCGR	23	43
COc1cc(C(=O)NN=Cc2csnc2OC)ccc1OC(C)C	ZINC000872335576	EF	On-Demand	Reactive	ADCYAP1R1	49	38
COc1cc(C(=O)NN=Cc2c3c(nn2C)CCCC3)ccc1OC(C)C	ZINC000872335594	FF	On-Demand	Reactive	ADCYAP1R1	43	38
COc1cc(C(=O)NN=C(C)CCc2cccnc2)ccc1OC(C)C	ZINC000872335612	FH	On-Demand	Reactive	PTAFR	37	50
O=S(=O)(c1ccc(NN=C2CCCc3ncccc32)nc1)N1CCCCC1	ZINC000872335613	GF	On-Demand	Mild	NAMPT	25	43
CCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872335629	DC	On-Demand	Mild	CA2	35	40
CCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872335629	DC	On-Demand	Mild	AMD1	17	42
CCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872335629	DC	On-Demand	Mild	CA12	18	40
CCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872335629	DC	On-Demand	Mild	CA9	19	40
CCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872335629	DC	On-Demand	Mild	UREA_CANEN	38	40
O=C(CN1CCCC1=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872335642	FD	On-Demand	Reactive	ACHE	20	44
CC(CCc1cccnc1)=NNC(=O)CN1CCCC1=O	ZINC000872335650	CD	On-Demand	Reactive	CHRNA7	41	34
CC(CCc1cccnc1)=NNC(=O)CN1CCCC1=O	ZINC000872335650	CD	On-Demand	Reactive	NAMPT	25	40
CCC(=NNC(=O)CNc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872335655	DE	On-Demand	Reactive	MTNR1A	34	40
CCC(=NNC(=O)CNc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872335655	DE	On-Demand	Reactive	MTNR1B	36	41
CCC(=NNC(=O)CNc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872335656	DE	On-Demand	Reactive	MTNR1A	34	40
CCC(=NNC(=O)CNc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872335656	DE	On-Demand	Reactive	MTNR1B	36	41
CC(CCc1cccnc1)=NNC(=O)CCN1CCCCCC1	ZINC000872335666	DF	On-Demand	Reactive	TBXAS1	21	41
CC(CCc1cccnc1)=NNC(=O)CCN1CCCCCC1	ZINC000872335666	DF	On-Demand	Reactive	CHRNA7	51	47
CC(CCc1cccnc1)=NNC(=O)CCN1CCCCCC1	ZINC000872335666	DF	On-Demand	Reactive	C3AR1	42	44
CC(CCc1cccnc1)=NNC(=O)CCN1CCCCCC1	ZINC000872335666	DF	On-Demand	Reactive	NAMPT	26	42
O=C(CN1CCCC1=O)NN=C1CCCCc2ccccc2C1	ZINC000872335684	DE	On-Demand	Reactive	ABAT	17	51
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1Br	ZINC000872335686	GD	On-Demand	Anodyne	MAPK14	42	39
Cn1ncc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1Br	ZINC000872335686	GD	On-Demand	Anodyne	MAPK13	57	33
COc1cc(C(=O)NN=Cc2c(OC)cc(F)cc2OC)ccc1OC(C)C	ZINC000872335723	GG	On-Demand	Reactive	GCGR	22	44
COc1cc(C(=O)NN=Cc2c(OC)cc(F)cc2OC)ccc1OC(C)C	ZINC000872335723	GG	On-Demand	Reactive	ADCYAP1R1	72	40
COc1cc(C(=O)NN=Cc2cncc(OC)c2C)ccc1OC(C)C	ZINC000872335735	FF	On-Demand	Reactive	GCGR	29	44
COc1cc(C(=O)NN=Cc2cncc(OC)c2C)ccc1OC(C)C	ZINC000872335735	FF	On-Demand	Reactive	ADCYAP1R1	56	39
COC1(CS(=O)(=O)Nc2ccccc2C(=O)NCC(F)(F)F)CCC1	ZINC000872335738	GE	On-Demand	Anodyne	PRTN3	48	38
CCCNC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872335751	DE	On-Demand	Mild	L3MBTL3	51	35
CC(CCc1cccnc1)=NNC(=O)CNc1ccc(C)cc1C	ZINC000872335753	DG	On-Demand	Reactive	TBXAS1	24	40
CCC(CCC(F)(F)F)=NNC(=O)CNc1cccc(OC)c1	ZINC000872335772	EG	On-Demand	Reactive	MTNR1A	27	43
CCC(CCC(F)(F)F)=NNC(=O)CNc1cccc(OC)c1	ZINC000872335772	EG	On-Demand	Reactive	MTNR1B	32	43
O=C(CCN1CCCCCC1)NN=Cc1cccc2ncccc12	ZINC000872335786	DF	On-Demand	Reactive	HNMT	101	43
O=C(Cc1ccc(F)cc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872335795	FF	On-Demand	Reactive	L3MBTL3	53	36
COCCc1ncc(C=NNC(=O)c2ccc(OC(C)C)c(OC)c2)s1	ZINC000872335799	GF	On-Demand	Reactive	GCGR	24	40
COCCc1ncc(C=NNC(=O)c2ccc(OC(C)C)c(OC)c2)s1	ZINC000872335799	GF	On-Demand	Reactive	ADCYAP1R1	55	39
COc1cc(C(=O)NN=CCCCCCO)ccc1OC(C)C	ZINC000872335833	DF	On-Demand	Reactive	ADCYAP1R1	48	37
Cc1nocc1S(=O)(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000872335868	FF	On-Demand	Anodyne	PKM	27	48
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(Cl)cc1Cl	ZINC000872335871	DI	On-Demand	Reactive	SLC6A9	40	34
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(Cl)cc1Cl	ZINC000872335872	DI	On-Demand	Reactive	SLC6A9	40	34
O=C(CN1CCCC1=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872335874	FC	On-Demand	Reactive	LTA4H	31	40
O=C(CN1CCCC1=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872335874	FC	On-Demand	Reactive	EPHX2	22	46
O=C(CCN1CCCCCC1)NN=Cc1ccc2nccnc2c1	ZINC000872335892	EE	On-Demand	Reactive	HNMT	57	33
CCOc1ccc(NS(=O)(=O)N=S(=O)(CC)CC)cc1OC	ZINC000872335902	FE	On-Demand	Anodyne	ENPP1	44	32
Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(C)on3)CC2)c(C#N)c1	ZINC000872335908	FD	On-Demand	Mild	TRPV4	44	36
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1OC	ZINC000872335917	GE	On-Demand	Anodyne	ALPL	23	41
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2Br)cc1OC	ZINC000872335924	GE	On-Demand	Anodyne	SSTR5	15	41
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OC(C)C	ZINC000872335948	FF	On-Demand	Reactive	GCGR	17	42
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OC(C)C	ZINC000872335948	FF	On-Demand	Reactive	PDE10A	20	41
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OC(C)C	ZINC000872335948	FF	On-Demand	Reactive	ADCYAP1R1	71	41
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OC(C)C	ZINC000872335948	FF	On-Demand	Reactive	ENPP1	44	30
Cn1nc2c(c1C=NNC(=O)Cc1ccc(F)cc1)CCCC2	ZINC000872335955	DE	On-Demand	Reactive	PDE4B	15	40
COC(=O)c1sccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872335965	FE	On-Demand	Anodyne	FAS	26	41
CC(CCc1cccnc1)=NNC(=S)NCCC(C)C	ZINC000872335971	CF	On-Demand	Mild	PPO2	32	43
Cc1nnc(C)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872335985	CE	On-Demand	Mild	MLYCD	19	43
Cc1nnc(C)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872335985	CE	On-Demand	Mild	L3MBTL3	62	40
Cc1nnc(C)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872335985	CE	On-Demand	Mild	HPGD	45	37
CN1CCC(C=NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	ZINC000872336008	DC	On-Demand	Reactive	KCNJ1	44	34
CCCc1ccc(NS(=O)(=O)N=S(=O)(CC)CC)cc1	ZINC000872336018	DF	On-Demand	Anodyne	PTPRB	42	33
CCOc1ccc(NS(=O)(=O)c2[nH]cnc2Br)cc1OC	ZINC000872336027	GE	On-Demand	Anodyne	ENPP1	45	34
O=C(Cc1ccc(Cl)cc1)NN=Cc1cn(C2CC2)cn1	ZINC000872336045	DF	On-Demand	Reactive	AVPR1A	17	40
COc1cc(C(=O)NN=Cc2ccc(C(F)F)nc2)ccc1OC(C)C	ZINC000872336057	FH	On-Demand	Reactive	GCGR	21	44
COc1cc(C(=O)NN=Cc2ccc(C(F)F)nc2)ccc1OC(C)C	ZINC000872336057	FH	On-Demand	Reactive	PDE10A	21	43
COc1cc(C(=O)NN=Cc2ccc(C(F)F)nc2)ccc1OC(C)C	ZINC000872336057	FH	On-Demand	Reactive	ADCYAP1R1	77	43
Cn1ncc(S(=O)(=O)Nc2cccc(S(C)(=O)=O)c2)c1C(F)(F)F	ZINC000872336073	GD	On-Demand	Anodyne	CACNA1B	40	32
COc1cc(C(=O)NN=CC2CCN(C)CC2)ccc1OC(C)C	ZINC000872336092	EF	On-Demand	Reactive	SLC5A7	31	41
COc1cc(C(=O)NN=CC2CCN(C)CC2)ccc1OC(C)C	ZINC000872336092	EF	On-Demand	Reactive	ACKR3	42	35
CCOc1ccc(NS(=O)(=O)c2cccc(F)c2OC)cc1OC	ZINC000872336128	FG	On-Demand	Anodyne	ALPL	27	43
CN1CCC(C=NNC(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872336142	CE	On-Demand	Reactive	AVPR1A	21	46
CN1CCC(C=NNC(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872336142	CE	On-Demand	Reactive	SLC6A3	20	41
CN1CCC(C=NNC(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872336142	CE	On-Demand	Reactive	CCR1	24	40
COc1cc(C(=O)NN=Cc2c(C)ccnc2N)ccc1OC(C)C	ZINC000872336176	EF	On-Demand	Reactive	GCGR	15	41
COc1cc(C(=O)NN=Cc2c(C)ccnc2N)ccc1OC(C)C	ZINC000872336176	EF	On-Demand	Reactive	ADCYAP1R1	46	39
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OCCC(C)C	ZINC000872336210	GG	On-Demand	Reactive	GCGR	15	40
COc1cc(C(=O)NN=Cc2cnc3c(cnn3C)c2)ccc1OCCC(C)C	ZINC000872336210	GG	On-Demand	Reactive	ADCYAP1R1	55	39
CCCc1ccc(NS(=O)(=O)c2occc2C(=O)OC)cc1	ZINC000872336211	DF	On-Demand	Anodyne	PTPRB	65	37
O=C(Cc1ccc(Cl)cc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872336217	FG	On-Demand	Reactive	L3MBTL3	51	39
CSc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1	ZINC000872336231	FF	On-Demand	Anodyne	SGK1	50	35
COc1cc(C(=O)NN=Cc2csnc2OC)ccc1OCCC(C)C	ZINC000872336264	GG	On-Demand	Reactive	GCGR	24	40
COc1cc(C(=O)NN=Cc2csnc2OC)ccc1OCCC(C)C	ZINC000872336264	GG	On-Demand	Reactive	ADCYAP1R1	49	38
COc1cc(C(=O)NN=Cc2cnsc2)ccc1OCCC(C)C	ZINC000872336268	EG	On-Demand	Reactive	GCGR	23	43
COc1cc(C(=O)NN=Cc2cnsc2)ccc1OCCC(C)C	ZINC000872336268	EG	On-Demand	Reactive	ADCYAP1R1	77	43
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	GCGR	22	42
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	PDE10A	21	42
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	TAAR1	39	41
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	ADCYAP1R1	78	44
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	KCNK3	86	42
COc1cc(C(=O)NN=Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000872336284	FG	On-Demand	Reactive	KCNK9	73	41
CN1CCC(C=NNC(=O)Cc2ccc(F)cc2)CC1	ZINC000872336319	CD	On-Demand	Reactive	HTR1F	65	39
CN1CCC(C=NNC(=O)Cc2ccc(F)cc2)CC1	ZINC000872336319	CD	On-Demand	Reactive	CCR3	36	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCOCC1	ZINC000872336479	DD	On-Demand	Reactive	CHRNA7	35	42
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCOCC1	ZINC000872336480	DD	On-Demand	Reactive	CHRNA7	35	42
C[C@H](CN1CCOCC1)C(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872336512	ED	On-Demand	Reactive	STAT6	40	34
COC(=O)c1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1F	ZINC000872336529	FE	On-Demand	Anodyne	SGK1	28	41
CCCCCNC(=S)NN=C(C)CCc1cccnc1	ZINC000872336594	CG	On-Demand	Mild	PPO2	39	43
NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872336605	CD	On-Demand	Anodyne	PKM	37	47
COc1ccc(Cn2cc(C=NNC(=O)[C@@H](C)CN3CCCCCC3)nn2)cc1	ZINC000872336610	GE	On-Demand	Reactive	PROKR1	53	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H](C)CN3CCCCCC3)nn2)cc1	ZINC000872336611	GE	On-Demand	Reactive	PROKR1	53	33
CCCCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872336659	ED	On-Demand	Mild	CA2	25	45
CCCCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872336659	ED	On-Demand	Mild	CA12	16	45
CCCCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872336659	ED	On-Demand	Mild	CA9	15	45
CCCCCNC(=S)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872336659	ED	On-Demand	Mild	UREA_CANEN	36	40
C[C@H](CN1CCOCC1)C(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872336726	EE	On-Demand	Reactive	PTGDS	37	41
COc1ccc(Cn2cc(C=NNC(=O)c3ccc(CN(C)C)o3)nn2)cc1	ZINC000872336741	GD	On-Demand	Reactive	PROKR1	56	33
COc1ccc(Cn2cc(C=NNC(=O)[C@@H](C)CN3CCOCC3)nn2)cc1	ZINC000872336749	GC	On-Demand	Reactive	PROKR1	44	32
COc1ccc(Cn2cc(C=NNC(=O)[C@H](C)CN3CCOCC3)nn2)cc1	ZINC000872336750	GC	On-Demand	Reactive	PROKR1	44	32
CCC(=NNC(=O)c1ccccc1C)[C@@H]1CCCOC1	ZINC000872336761	CF	On-Demand	Reactive	CCR8	43	32
CCC(=NNC(=O)c1ccccc1C)[C@H]1CCCOC1	ZINC000872336762	CF	On-Demand	Reactive	CCR8	43	32
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)CN1CCOCC1	ZINC000872336806	EE	On-Demand	Reactive	CAPN1	24	40
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)CN1CCOCC1	ZINC000872336806	EE	On-Demand	Reactive	CAPN2	27	40
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)CN1CCOCC1	ZINC000872336806	EE	On-Demand	Reactive	NPR	59	32
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)CN1CCOCC1	ZINC000872336806	EE	On-Demand	Reactive	PSMB8	50	38
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)CN1CCOCC1	ZINC000872336807	EE	On-Demand	Reactive	CAPN1	24	40
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)CN1CCOCC1	ZINC000872336807	EE	On-Demand	Reactive	CAPN2	27	40
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)CN1CCOCC1	ZINC000872336807	EE	On-Demand	Reactive	NPR	59	32
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)CN1CCOCC1	ZINC000872336807	EE	On-Demand	Reactive	PSMB8	50	38
COc1cc(C=NNC(=O)[C@H](C)CN2CCCCC2)c(Cl)cc1O	ZINC000872336811	FF	On-Demand	Reactive	PDE10A	15	41
COc1cc(C=NNC(=O)[C@H](C)CN2CCCCC2)c(Cl)cc1O	ZINC000872336811	FF	On-Demand	Reactive	ADCYAP1R1	40	35
COc1cc(C=NNC(=O)[C@@H](C)CN2CCCCC2)c(Cl)cc1O	ZINC000872336812	FF	On-Demand	Reactive	PDE10A	15	41
COc1cc(C=NNC(=O)[C@@H](C)CN2CCCCC2)c(Cl)cc1O	ZINC000872336812	FF	On-Demand	Reactive	ADCYAP1R1	40	35
CCCCCNC(=S)NN=Cc1ccc2nccnc2c1	ZINC000872336847	DF	On-Demand	Mild	AMD1	15	42
CCN1CCC(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872336878	GE	On-Demand	Anodyne	PKM	37	46
Cn1ncc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1C(F)(F)F	ZINC000872336900	GF	On-Demand	Anodyne	EPHX2	21	42
Cn1ncc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1C(F)(F)F	ZINC000872336900	GF	On-Demand	Anodyne	SFRP1	40	32
Cc1c(C=NNC(=O)[C@@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-]	ZINC000872336907	EF	On-Demand	Reactive	COLA	58	32
Cc1c(C=NNC(=O)[C@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-]	ZINC000872336908	EF	On-Demand	Reactive	COLA	58	32
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1ccc(CN(C)C)o1	ZINC000872336947	FH	On-Demand	Reactive	TACR1	19	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCCCC1	ZINC000872336994	DF	On-Demand	Reactive	CHRNA7	36	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCCCC1	ZINC000872336994	DF	On-Demand	Reactive	C3AR1	42	44
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCCCC1	ZINC000872336995	DF	On-Demand	Reactive	CHRNA7	36	40
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCCCC1	ZINC000872336995	DF	On-Demand	Reactive	C3AR1	42	44
CCN1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872337005	DD	On-Demand	Mild	CCR8	93	40
CCN1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872337005	DD	On-Demand	Mild	SFRP1	64	35
CCOc1cc(F)cc(C=NNC(=O)c2ccc(CN(C)C)o2)c1	ZINC000872337007	EF	On-Demand	Reactive	ADCYAP1R1	48	31
COc1cc(C=NNC(=O)c2ccc(CN(C)C)o2)c(Cl)cc1O	ZINC000872337014	FE	On-Demand	Reactive	GCGR	36	43
COc1cc(C=NNC(=O)c2ccc(CN(C)C)o2)c(Cl)cc1O	ZINC000872337014	FE	On-Demand	Reactive	ADCYAP1R1	76	40
CCN1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872337058	DD	On-Demand	Mild	CCR8	80	37
C#Cc1cccc(NS(=O)(=O)c2cn(CCCC)nc2C)c1	ZINC000872337060	DF	On-Demand	Mild	NR1I2	39	40
Cc1c(C=NNC(=O)[C@H](C)CN2CCCCC2)cccc1[N+](=O)[O-]	ZINC000872337063	EE	On-Demand	Reactive	COLA	58	32
Cc1c(C=NNC(=O)[C@@H](C)CN2CCCCC2)cccc1[N+](=O)[O-]	ZINC000872337064	EE	On-Demand	Reactive	COLA	58	32
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872337117	GD	On-Demand	Anodyne	SRD5A1	15	41
CCCCCNC(=S)NN=C1CCC(CNC(C)=O)CC1	ZINC000872337130	DE	On-Demand	Mild	ASAH1	41	35
COc1ccc(Cn2cc(C=NNC(=O)[C@@H](C)CN3CCCCC3)nn2)cc1	ZINC000872337170	GD	On-Demand	Reactive	PROKR1	53	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H](C)CN3CCCCC3)nn2)cc1	ZINC000872337171	GD	On-Demand	Reactive	PROKR1	53	33
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	ADRA1D	31	43
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	ADRA1A	22	43
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	ADRA1B	24	43
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	HTR7	15	49
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	SFRP1	109	38
CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872337190	EF	On-Demand	Anodyne	WNT3	73	36
CC(=O)Nc1ccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)cc1Cl	ZINC000872337200	GG	On-Demand	Anodyne	SGK1	17	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCCCCC1	ZINC000872337201	EG	On-Demand	Reactive	CHRNA7	36	40
CC(CCc1cccnc1)=NNC(=O)[C@@H](C)CN1CCCCCC1	ZINC000872337201	EG	On-Demand	Reactive	C3AR1	42	44
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCCCCC1	ZINC000872337202	EG	On-Demand	Reactive	CHRNA7	36	40
CC(CCc1cccnc1)=NNC(=O)[C@H](C)CN1CCCCCC1	ZINC000872337202	EG	On-Demand	Reactive	C3AR1	42	44
Cn1nc2c(c1C=NNc1nc3ccccc3c(=O)n1C)CCCC2	ZINC000872337341	ED	On-Demand	Mild	BCHE	42	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)N(CCO)c3ccccc3)cc2N1	ZINC000872337392	GF	On-Demand	Anodyne	PKM	34	41
COCCCn1c(NN=C(C)CCc2cccnc2)nc2ccccc2c1=O	ZINC000872337416	GG	On-Demand	Mild	TBXAS1	20	45
O=c1c2ccccc2ncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872337477	GD	On-Demand	Mild	ACHE	16	49
O=c1c2ccccc2ncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872337477	GD	On-Demand	Mild	LTA4H	50	47
O=c1c2ccccc2ncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872337477	GD	On-Demand	Mild	HRH3	23	41
CN1CCC(C=NNc2ccccc2C(=O)O)CC1	ZINC000872337482	CE	On-Demand	Mild	AKR1C3	16	40
O=C(c1ccc(NS(=O)(=O)c2[nH]cnc2Br)cc1)N1CCCC1	ZINC000872337536	GE	On-Demand	Anodyne	L3MBTL3	56	36
CCOCCCn1c(NN=C(C)CCc2cccnc2)nc2ccccc2c1=O	ZINC000872337538	GH	On-Demand	Mild	TBXAS1	18	42
CCC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1cccc(OC)c1OC	ZINC000872337543	FF	On-Demand	Reactive	KCNK3	49	42
CCC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1cccc(OC)c1OC	ZINC000872337543	FF	On-Demand	Reactive	KCNK9	45	42
O=C(O)c1ccccc1NN=C1CCC[C@H]1F	ZINC000872337544	BF	On-Demand	Mild	AKR1C2	33	40
O=C(O)c1ccccc1NN=C1CCC[C@@H]1F	ZINC000872337545	BF	On-Demand	Mild	AKR1C2	33	40
C[C@@H]1Cc2ccccc2N1C(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000872337546	JG	On-Demand	Anodyne	DRD4	21	52
C[C@@H]1Cc2ccccc2N1C(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000872337546	JG	On-Demand	Anodyne	BMP1	40	33
C[C@@H]1Cc2ccccc2N1C(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000872337546	JG	On-Demand	Anodyne	NOS2	58	33
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cnc(Cl)c(F)c1	ZINC000872337608	GD	On-Demand	Reactive	PIK3CB	21	40
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cnc(Cl)c(F)c1	ZINC000872337608	GD	On-Demand	Reactive	STAT6	43	32
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	CA2	21	48
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	DRD4	22	43
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	CA7	36	48
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	CA4	18	48
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	CA12	15	48
C[C@@H]1Cc2ccccc2N1C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872337643	EE	On-Demand	Anodyne	TPP2	44	34
C(=NN(Cc1ccccc1)Cc1ccccc1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872337668	GG	On-Demand	Mild	G6PC	60	38
C(=NN(Cc1ccccc1)Cc1ccccc1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872337669	GG	On-Demand	Mild	G6PC	60	38
CCn1c(NN=C2CCC[C@H]2F)nc2ccccc2c1=O	ZINC000872337680	CF	On-Demand	Mild	Q8MHZ5_SHEEP	57	32
CCn1c(NN=C2CCC[C@@H]2F)nc2ccccc2c1=O	ZINC000872337682	CF	On-Demand	Mild	Q8MHZ5_SHEEP	57	32
O=C(NN=C(CCc1ccccc1)c1ccccn1)C(=O)NC1CC1	ZINC000872337689	ED	On-Demand	Reactive	CES1	42	33
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)NC1CC1	ZINC000872337738	ED	On-Demand	Reactive	DRD4	25	43
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)NC1CC1	ZINC000872337738	ED	On-Demand	Reactive	SIGMAR1	28	44
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000872337761	FF	On-Demand	Mild	L3MBTL3	50	34
O=C(O)c1ccccc1NN=CCCCCCO	ZINC000872337764	CE	On-Demand	Mild	AKR1C3	16	40
O=C(O)c1ccccc1NN=CCCCCCO	ZINC000872337764	CE	On-Demand	Mild	AKR1C2	35	40
C(=NNc1nc(-c2ccccc2)cs1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872337785	FG	On-Demand	Mild	MAOB	23	42
C(=NNc1nc(-c2ccccc2)cs1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872337786	FG	On-Demand	Mild	MAOB	23	42
COCCCn1c(NN=Cc2c3c(nn2C)CCCC3)nc2ccccc2c1=O	ZINC000872337829	GE	On-Demand	Mild	ACHE	57	33
COCCCn1c(NN=Cc2c3c(nn2C)CCCC3)nc2ccccc2c1=O	ZINC000872337829	GE	On-Demand	Mild	BCHE	81	33
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)CCC(=O)N3)c1C(F)(F)F	ZINC000872337864	FE	On-Demand	Anodyne	PKM	55	53
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)CCC(=O)N3)c1C(F)(F)F	ZINC000872337864	FE	On-Demand	Anodyne	PTK2B	21	41
CCOc1ccc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)cc1C(C)C	ZINC000872337883	GG	On-Demand	Anodyne	MGAT1	45	32
CC(=O)Nc1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1F	ZINC000872337977	FF	On-Demand	Anodyne	SGK1	31	42
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cnc2c(F)cccc2c1	ZINC000872337989	GE	On-Demand	Reactive	STAT6	49	35
CCn1c(NN=C(C)CCc2cccnc2)nc2ccccc2c1=O	ZINC000872338008	EG	On-Demand	Mild	TBXAS1	24	42
CCn1c(NN=C(C)CCc2cccnc2)nc2ccccc2c1=O	ZINC000872338008	EG	On-Demand	Mild	PDE7A	21	43
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCOCC1	ZINC000872338009	GE	On-Demand	Mild	CCR8	46	38
C(=NNc1nc(-c2ccccc2)cs1)C1CC2(C1)OCCO2	ZINC000872338012	DG	On-Demand	Mild	MAOB	25	47
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCOC(C)(C)C3)sc2n1	ZINC000872338090	EG	On-Demand	Reactive	CHRM4	31	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	HTR1B	22	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	MPO	20	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	NMBR	41	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	MC5R	33	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	MMP8	15	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	SSTR3	16	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	CCKBR	57	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	GHSR	47	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC1CC1	ZINC000872338092	DD	On-Demand	Reactive	MC1R	18	40
Cc1cccc(C(=O)N2CCCC2)c1NS(=O)(=O)c1cc(F)cc(C#N)c1	ZINC000872338093	GG	On-Demand	Mild	SLC6A9	17	40
C(=NN(Cc1ccccc1)Cc1ccccc1)C1CC2(C1)OCCO2	ZINC000872338135	EH	On-Demand	Mild	G6PC	62	39
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	ACE	15	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	MME	22	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	TACR1	28	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	CCKAR	42	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	BRS3	26	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	NMBR	44	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	MC5R	55	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	GRPR	42	31
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	ECE1	49	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	MMP11	41	33
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	CCKBR	55	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	GHSR	64	39
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	MMP9	20	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	MC1R	52	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)NC(C)C	ZINC000872338136	DE	On-Demand	Reactive	NPR	27	41
CC(CCc1cccnc1)=NNC(=O)c1sc2nc(C)cc(C)c2c1N	ZINC000872338143	FH	On-Demand	Reactive	CHRM4	33	53
C(=NN(Cc1ccccc1)Cc1ccccc1)c1cn(C[C@@H]2CCOC2)nn1	ZINC000872338150	GG	On-Demand	Mild	G6PC	59	38
C(=NN(Cc1ccccc1)Cc1ccccc1)c1cn(C[C@H]2CCOC2)nn1	ZINC000872338152	GG	On-Demand	Mild	G6PC	59	38
O=C(NN=C1CCC[C@H]1F)c1ccc(-c2ccc(F)cc2)s1	ZINC000872338164	DI	On-Demand	Reactive	MAPK11	17	44
O=C(NN=C1CCC[C@@H]1F)c1ccc(-c2ccc(F)cc2)s1	ZINC000872338173	DI	On-Demand	Reactive	MAPK11	17	44
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccc[nH]2)c1	ZINC000872338188	EF	On-Demand	Reactive	ADCYAP1R1	41	35
O=C(O)c1ccccc1NN=C1CC[C@@H]2C[C@H]12	ZINC000872338202	BF	On-Demand	Mild	AKR1C2	33	40
CCN(Cc1cccc(NS(=O)(=O)c2conc2C)c1)C(=O)C(F)(F)F	ZINC000872338212	GF	On-Demand	Anodyne	LIMK2	18	41
Cn1ncc(S(=O)(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1C(F)(F)F	ZINC000872338239	GE	On-Demand	Anodyne	PKM	41	45
O=C(O)c1ccccc1NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872338246	EH	On-Demand	Mild	SIGMAR1	33	43
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCN(C)[C@H]3C)sc2n1	ZINC000872338260	EE	On-Demand	Reactive	CHRM4	31	47
CC(CCc1cccnc1)=NNC(=O)C(=O)NC1CC1	ZINC000872338262	CC	On-Demand	Reactive	TBXAS1	28	40
CC(CCc1cccnc1)=NNC(=O)C(=O)NC1CC1	ZINC000872338262	CC	On-Demand	Reactive	CHRNA7	45	41
CC(CCc1cccnc1)=NNC(=O)C(=O)NC1CC1	ZINC000872338262	CC	On-Demand	Reactive	C3AR1	48	48
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCN(C)[C@@H]3C)sc2n1	ZINC000872338263	EE	On-Demand	Reactive	CHRM4	31	47
C(=NNc1nc(-c2ccccc2)cs1)c1cn(C[C@H]2CCOC2)nn1	ZINC000872338278	FF	On-Demand	Mild	MAOB	17	42
C(=NNc1nc(-c2ccccc2)cs1)c1cn(C[C@@H]2CCOC2)nn1	ZINC000872338279	FF	On-Demand	Mild	MAOB	17	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc[nH]1	ZINC000872338358	ED	On-Demand	Reactive	LTA4H	38	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc[nH]1	ZINC000872338358	ED	On-Demand	Reactive	EPHX2	20	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc[nH]1	ZINC000872338358	ED	On-Demand	Reactive	FLT3	15	42
COCCCn1c(NN=C2CCC(CNC(C)=O)CC2)nc2ccccc2c1=O	ZINC000872338364	GF	On-Demand	Mild	AVPR1B	25	40
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338367	EG	On-Demand	Anodyne	ACE	25	46
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338367	EG	On-Demand	Anodyne	DRD4	23	42
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338367	EG	On-Demand	Anodyne	TPP2	60	37
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338368	EG	On-Demand	Anodyne	ACE	25	46
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338368	EG	On-Demand	Anodyne	DRD4	23	42
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000872338368	EG	On-Demand	Anodyne	TPP2	60	37
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338369	EG	On-Demand	Anodyne	ACE	25	46
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338369	EG	On-Demand	Anodyne	DRD4	23	42
C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338369	EG	On-Demand	Anodyne	TPP2	60	37
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338370	EG	On-Demand	Anodyne	ACE	25	46
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338370	EG	On-Demand	Anodyne	DRD4	23	42
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000872338370	EG	On-Demand	Anodyne	TPP2	60	37
COCCOc1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1OC	ZINC000872338385	GF	On-Demand	Anodyne	ENPP1	45	31
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)NC1CC1	ZINC000872338439	FC	On-Demand	Reactive	ESR1	51	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)NC1CC1	ZINC000872338439	FC	On-Demand	Reactive	LTA4H	41	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)NC1CC1	ZINC000872338439	FC	On-Demand	Reactive	HRH3	20	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)NC1CC1	ZINC000872338439	FC	On-Demand	Reactive	EPHX2	24	52
Cn1ncc(S(=O)(=O)NNC(=O)C2CCCC2)c1C(F)(F)F	ZINC000872338462	EC	On-Demand	Reactive	SFRP1	63	32
Cn1ncc(S(=O)(=O)NNC(=O)C2CCCC2)c1C(F)(F)F	ZINC000872338462	EC	On-Demand	Reactive	WNT3	56	32
CCC(=NNC(=O)c1ccc[nH]1)c1cccc(OC)c1OC	ZINC000872338486	DF	On-Demand	Reactive	KCNK3	43	37
CCn1c(NN=Cc2c3c(nn2C)CCCC3)nc2ccccc2c1=O	ZINC000872338506	FE	On-Demand	Mild	ACHE	40	35
CCn1c(NN=Cc2c3c(nn2C)CCCC3)nc2ccccc2c1=O	ZINC000872338506	FE	On-Demand	Mild	BCHE	54	35
Cn1ncc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1Br	ZINC000872338513	GE	On-Demand	Anodyne	TYK2	42	37
CCOc1ccc(S(=O)(=O)Nc2ccc(CC(=O)NC)cc2)cc1C(C)C	ZINC000872338533	GG	On-Demand	Anodyne	RORC	39	42
CCOc1ccc(S(=O)(=O)Nc2ccc(CC(=O)NC)cc2)cc1C(C)C	ZINC000872338533	GG	On-Demand	Anodyne	MGAT1	45	32
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC1CC1	ZINC000872338553	EC	On-Demand	Reactive	EPHX2	15	44
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC1CC1	ZINC000872338553	EC	On-Demand	Reactive	L3MBTL3	92	42
CC(=O)Nc1cccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c1	ZINC000872338582	GD	On-Demand	Reactive	PIK3CA	26	40
CC(=O)Nc1cccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c1	ZINC000872338582	GD	On-Demand	Reactive	PIK3CD	33	40
CC(=O)Nc1cccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c1	ZINC000872338582	GD	On-Demand	Reactive	PIK3CB	47	40
O=C(NN=C1CCCCc2ccccc2C1)C(=O)NC1CC1	ZINC000872338624	CD	On-Demand	Reactive	ABAT	15	46
COCCOc1cc(NS(=O)(=O)c2cccc(F)c2OC)ccc1OC	ZINC000872338632	GF	On-Demand	Anodyne	DRTS_TRYCR	48	35
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCCC1	ZINC000872338650	EE	On-Demand	Reactive	LEF	23	41
CCC(=NNC(=O)c1sc2nc(C)cc(C)c2c1N)[C@@H]1CCCOC1	ZINC000872338660	FG	On-Demand	Reactive	CHRM4	31	46
CCC(=NNC(=O)c1sc2nc(C)cc(C)c2c1N)[C@H]1CCCOC1	ZINC000872338661	FG	On-Demand	Reactive	CHRM4	31	46
Cn1cccc1C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872338663	DE	On-Demand	Reactive	L3MBTL3	57	35
CC(CCc1cccnc1)=NNC(=O)c1cccn1C	ZINC000872338669	CE	On-Demand	Reactive	TBXAS1	32	40
CC(CCc1cccnc1)=NNC(=O)c1cccn1C	ZINC000872338669	CE	On-Demand	Reactive	CHRNA7	32	51
CCC(CCC(F)(F)F)=NNC(=O)C(=O)Nc1ccc(C)cc1	ZINC000872338684	EG	On-Demand	Reactive	HDAH	26	42
CCC(CCC(F)(F)F)=NNC(=O)C(=O)Nc1ccc(C)c(C)c1	ZINC000872338704	EG	On-Demand	Reactive	HDAH	22	45
CCC(CCC(F)(F)F)=NNc1cccc(OC)c1	ZINC000872338707	CI	On-Demand	Mild	MTNR1A	21	42
CCC(CCC(F)(F)F)=NNc1cccc(OC)c1	ZINC000872338707	CI	On-Demand	Mild	MTNR1B	26	42
CCC(=NNC(=O)c1cc(Cl)ccc1O)[C@H]1CCCOC1	ZINC000872338713	DF	On-Demand	Reactive	PYK	77	39
CCC(=NNC(=O)c1cc(Cl)ccc1O)[C@@H]1CCCOC1	ZINC000872338714	DF	On-Demand	Reactive	PYK	77	39
CCOc1ccc(S(=O)(=O)Nc2cccc(NC(C)=O)c2C)cc1C(C)C	ZINC000872338721	GI	On-Demand	Anodyne	PRTN3	50	32
Cc1cc(C)c2c(N)c(C(=O)NN=Cc3cn(C4CC4)cn3)sc2n1	ZINC000872338741	FF	On-Demand	Reactive	CHRM4	28	46
O=C(NN=C1CCOC2(CCCC2)C1)c1cc(Cl)ccc1O	ZINC000872338744	DG	On-Demand	Reactive	KCNMA1	22	40
CN1CCC(C=NNC(=O)c2ccc[nH]2)CC1	ZINC000872338745	BD	On-Demand	Reactive	HTR1F	58	33
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cc(Cl)ccc1O	ZINC000872338760	CF	On-Demand	Reactive	KCNMA1	25	44
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	ESR1	49	37
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	TNF	23	40
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	LTA4H	52	50
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	CYSLTR2	49	33
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	MAPK14	16	40
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	HRH3	16	46
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	EPHX2	19	52
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	PSMB2	38	40
O=C(O)c1ccccc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338763	FF	On-Demand	Mild	PSMB1	41	40
CN1CCC(C=NNc2nc(-c3ccccc3)cs2)CC1	ZINC000872338768	DH	On-Demand	Mild	MAOB	29	52
CN1CCC(C=NNc2nc(-c3ccccc3)cs2)CC1	ZINC000872338768	DH	On-Demand	Mild	SPHK2	43	34
CN1CCC(C=NNc2nc(-c3ccccc3)cs2)CC1	ZINC000872338768	DH	On-Demand	Mild	SPHK1	47	41
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1)N1CCCC1	ZINC000872338777	GH	On-Demand	Anodyne	L3MBTL3	71	40
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1ccc(C(F)F)nc1	ZINC000872338787	GE	On-Demand	Reactive	STAT6	41	30
c1ccc(-c2csc(NN=C3CCCC4(C3)OCCO4)n2)cc1	ZINC000872338788	EH	On-Demand	Mild	MAOB	34	67
CC(CCc1cccnc1)=NNC(=O)C(=O)Nc1ccc(C)c(C)c1	ZINC000872338814	EF	On-Demand	Reactive	PTAFR	19	43
CC(CCc1cccnc1)=NNC(=O)C(=O)Nc1ccc(C)c(C)c1	ZINC000872338814	EF	On-Demand	Reactive	NAMPT	29	44
O=C(c1ccc(C=Nn2c(S)nnc2[C@@H]2CCCO2)cc1)N1CCCC1	ZINC000872338821	FF	On-Demand	Mild	L3MBTL3	48	36
O=C(c1ccc(C=Nn2c(S)nnc2[C@H]2CCCO2)cc1)N1CCCC1	ZINC000872338822	FF	On-Demand	Mild	L3MBTL3	48	36
O=C(NN=CCCCCCO)c1cc(Cl)ccc1O	ZINC000872338848	CE	On-Demand	Reactive	KCNMA1	25	45
O=C(NN=CCCCCCO)c1cc(Cl)ccc1O	ZINC000872338848	CE	On-Demand	Reactive	PYK	63	39
CCOc1ccc(-c2nnc(S)n2N=Cc2cn(C3CC3)cn2)cc1	ZINC000872338852	FG	On-Demand	Mild	CACNA2D2	49	30
FC(F)COCCC=NNc1nc(-c2ccccc2)cs1	ZINC000872338859	DH	On-Demand	Mild	MAOB	24	48
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCC(C)(N(C)C)CC3)sc2n1	ZINC000872338860	FG	On-Demand	Reactive	CHRM4	30	47
Cn1ncc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1C(F)(F)F	ZINC000872338867	GF	On-Demand	Anodyne	SFRP1	92	33
Cn1ncc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1C(F)(F)F	ZINC000872338867	GF	On-Demand	Anodyne	WNT3	61	33
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCC[C@H]3F)sc2n1	ZINC000872338891	DG	On-Demand	Reactive	CHRM4	32	52
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCC[C@H]3F)sc2n1	ZINC000872338891	DG	On-Demand	Reactive	EEF2K	46	32
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCC[C@@H]3F)sc2n1	ZINC000872338892	DG	On-Demand	Reactive	CHRM4	32	52
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCC[C@@H]3F)sc2n1	ZINC000872338892	DG	On-Demand	Reactive	EEF2K	46	32
CCC(CCC(F)(F)F)=NNC(=O)c1sc2nc(C)cc(C)c2c1N	ZINC000872338895	FI	On-Demand	Reactive	CHRM4	32	53
CC(CCOCc1ccccc1)=NNC(=O)C(=O)NC(C)C	ZINC000872338897	DD	On-Demand	Reactive	CAPNS1	53	32
CC(CCOCc1ccccc1)=NNC(=O)C(=O)NC(C)C	ZINC000872338897	DD	On-Demand	Reactive	CAPN1	56	34
CC(CCOCc1ccccc1)=NNC(=O)C(=O)NC(C)C	ZINC000872338897	DD	On-Demand	Reactive	CAPN2	77	32
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)C1CCCC1	ZINC000872338915	EC	On-Demand	Reactive	SFRP1	91	34
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)C1CCCC1	ZINC000872338915	EC	On-Demand	Reactive	WNT3	70	34
Cn1cccc1C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338922	FD	On-Demand	Reactive	ESR1	41	34
Cn1cccc1C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338922	FD	On-Demand	Reactive	LTA4H	38	43
Cn1cccc1C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338922	FD	On-Demand	Reactive	EPHX2	20	45
Cn1cccc1C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872338922	FD	On-Demand	Reactive	FLT3	16	41
CCC(CCC(F)(F)F)=NNC(=O)c1cn(C)c2ccccc12	ZINC000872338930	EI	On-Demand	Reactive	CNR2	19	42
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCCN4CCSC[C@H]34)sc2n1	ZINC000872338935	GF	On-Demand	Reactive	CHRM4	20	45
Cc1cc(C)c2c(N)c(C(=O)NN=C3CCCN4CCSC[C@@H]34)sc2n1	ZINC000872338936	GF	On-Demand	Reactive	CHRM4	20	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)Cc1nc(C)cs1	ZINC000872338941	EH	On-Demand	Reactive	GHSR	42	35
O=C(c1ccc(C=Nn2c(S)nnc2S)cc1)N1CCCC1	ZINC000872338949	ED	On-Demand	Mild	MLYCD	19	43
O=C(c1ccc(C=Nn2c(S)nnc2S)cc1)N1CCCC1	ZINC000872338949	ED	On-Demand	Mild	L3MBTL3	60	40
COCCOc1cc(NS(=O)(=O)c2cc(F)cc(F)c2O)ccc1OC	ZINC000872338989	GF	On-Demand	Clean	ENPP1	56	31
O=C(NN=CC1CC2(C1)OCCO2)c1cc(Cl)ccc1O	ZINC000872338990	DD	On-Demand	Reactive	KCNMA1	24	41
CCC(=NNC(=O)c1cn(C)c2ccccc12)[C@@H]1CCCOC1	ZINC000872339004	DG	On-Demand	Reactive	CNR2	15	41
CCC(=NNC(=O)c1cn(C)c2ccccc12)[C@H]1CCCOC1	ZINC000872339005	DG	On-Demand	Reactive	CNR2	15	41
O=C(NN=C1CCC[C@H]1F)c1cc(Cl)ccc1O	ZINC000872339007	CF	On-Demand	Reactive	KCNMA1	25	44
O=C(NN=C1CCC[C@@H]1F)c1cc(Cl)ccc1O	ZINC000872339008	CF	On-Demand	Reactive	KCNMA1	25	44
CC(=NNC(=O)c1sc2nc(C)cc(C)c2c1N)c1cn(C)cn1	ZINC000872339024	EE	On-Demand	Reactive	CHRM4	30	46
CC(CCc1cccnc1)=NNC(=O)C(=O)NC(C)C	ZINC000872339033	CD	On-Demand	Reactive	TBXAS1	37	41
CC(CCc1cccnc1)=NNC(=O)C(=O)NC(C)C	ZINC000872339033	CD	On-Demand	Reactive	C3AR1	39	41
CC(CCc1cccnc1)=NNC(=O)C(=O)NC(C)C	ZINC000872339033	CD	On-Demand	Reactive	PPO2	30	41
CC(CCc1cccnc1)=NNC(=O)C(=O)NC(C)C	ZINC000872339033	CD	On-Demand	Reactive	NAMPT	15	41
C=CCC1(C=NNC(=O)c2cn(C)c3ccccc23)CCOCC1	ZINC000872339042	EG	On-Demand	Reactive	CNR2	15	40
CCC(CCC(F)(F)F)=NNC(=O)c1cc(Cl)ccc1O	ZINC000872339054	DH	On-Demand	Reactive	KCNMA1	25	42
CCC(CCC(F)(F)F)=NNC(=O)c1cc(Cl)ccc1O	ZINC000872339054	DH	On-Demand	Reactive	PYK	96	44
CCC(=NNc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872339057	CG	On-Demand	Mild	MTNR1A	17	41
CCC(=NNc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000872339057	CG	On-Demand	Mild	MTNR1B	18	41
CCC(=NNc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872339058	CG	On-Demand	Mild	MTNR1A	17	41
CCC(=NNc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000872339058	CG	On-Demand	Mild	MTNR1B	18	41
O=C(NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)C1CCCC1	ZINC000872339062	GF	On-Demand	Reactive	SFRP1	49	31
CN1CCC(C=NNC(=O)c2cc(Cl)ccc2O)CC1	ZINC000872339067	CE	On-Demand	Reactive	KCNMA1	25	42
CN1CCC(C=NNC(=O)c2cc(Cl)ccc2O)CC1	ZINC000872339067	CE	On-Demand	Reactive	PYK	52	42
O=C(NN=C1CCCC2(C1)OCCO2)c1cc(Cl)ccc1O	ZINC000872339079	DE	On-Demand	Reactive	KCNMA1	22	40
Sc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872339090	FD	On-Demand	Mild	LTA4H	46	48
Sc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872339090	FD	On-Demand	Mild	HRH3	15	44
Sc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872339090	FD	On-Demand	Mild	PSMB1	41	37
Cc1cc(C)c2c(N)c(C(=O)NN=C3CC[C@@H]4C[C@H]34)sc2n1	ZINC000872339094	DG	On-Demand	Reactive	CHRM4	31	52
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1cc(Cl)ccc1O	ZINC000872339121	DG	On-Demand	Reactive	KCNMA1	23	40
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1cc(Cl)ccc1O	ZINC000872339121	DG	On-Demand	Reactive	PYK	42	36
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1cc(Cl)ccc1O	ZINC000872339122	DG	On-Demand	Reactive	KCNMA1	23	40
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1cc(Cl)ccc1O	ZINC000872339122	DG	On-Demand	Reactive	PYK	42	36
CCC(=NNC(=O)C(=O)NC1CC1)c1cccc(OC)c1OC	ZINC000872339123	DD	On-Demand	Reactive	DRD2	21	42
COCCOc1cc(NS(=O)(=O)c2ccc(C)cc2C#N)ccc1OC	ZINC000872339136	GF	On-Demand	Mild	ALPL	18	42
Cn1cccc1C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872339158	FF	On-Demand	Reactive	ADCYAP1R1	45	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCS(=O)(=O)C1	ZINC000872339161	EE	On-Demand	Reactive	GHSR	35	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCS(=O)(=O)C1	ZINC000872339162	EE	On-Demand	Reactive	GHSR	35	40
CCOc1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1C(C)C	ZINC000872339182	DF	On-Demand	Anodyne	PDE5A	15	40
CCOc1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1C(C)C	ZINC000872339182	DF	On-Demand	Anodyne	HTR6	15	43
CCOc1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1C(C)C	ZINC000872339182	DF	On-Demand	Anodyne	MGAT1	45	33
Oc1nncc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1Cl	ZINC000872339226	GD	On-Demand	Mild	ESR1	42	36
Oc1nncc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1Cl	ZINC000872339226	GD	On-Demand	Mild	LTA4H	19	40
O=C(Cc1cc(O)nc(S)n1)NN=C1CCCCc2ccccc2C1	ZINC000872339282	FE	On-Demand	Reactive	ABAT	15	46
CC(CCOCc1ccccc1)=NNC(=O)c1cc(Br)c[nH]1	ZINC000872339284	FG	On-Demand	Reactive	PYK	51	32
CCNC(=O)c1ccccc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872339388	GD	On-Demand	Anodyne	PRTN3	51	40
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC)c2C)cc1C(C)C	ZINC000872339413	GH	On-Demand	Anodyne	PRTN3	48	34
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC)c2C)cc1C(C)C	ZINC000872339413	GH	On-Demand	Anodyne	CCR2	15	40
CCOc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2C)cc1C(C)C	ZINC000872339453	GG	On-Demand	Anodyne	TRY2_BOVIN	40	34
COCc1ccccc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872339479	GH	On-Demand	Anodyne	PKM	42	50
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000872339515	GC	On-Demand	Reactive	EPHX2	18	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000872339516	GC	On-Demand	Reactive	EPHX2	18	44
Cc1cccc(C#N)c1S(=O)(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000872339561	GF	On-Demand	Mild	CPT1A	58	41
C(=Nn1cnc2ccccc21)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339575	FF	On-Demand	Mild	ESR1	54	36
C(=Nn1cnc2ccccc21)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339575	FF	On-Demand	Mild	ESR2	36	41
C(=Nn1cnc2ccccc21)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339575	FF	On-Demand	Mild	LTA4H	57	50
C(=Nn1cnc2ccccc21)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339575	FF	On-Demand	Mild	HRH3	16	44
C(=Nn1cnc2ccccc21)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339575	FF	On-Demand	Mild	PSMB1	40	37
CCC(=NNC(=O)c1cccn1C)c1cccc(OC)c1OC	ZINC000872339616	DF	On-Demand	Reactive	KCNK3	52	40
CCC(=NNC(=O)c1cccn1C)c1cccc(OC)c1OC	ZINC000872339616	DF	On-Demand	Reactive	KCNK9	44	40
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCS(=O)(=O)C1	ZINC000872339623	DC	On-Demand	Reactive	NAMPT	36	41
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCS(=O)(=O)C1	ZINC000872339624	DC	On-Demand	Reactive	NAMPT	36	41
O=C(NN=Cc1ccc(F)c2ccccc12)[C@@H]1CCS(=O)(=O)C1	ZINC000872339645	ED	On-Demand	Reactive	GCGR	16	41
O=C(NN=Cc1ccc(F)c2ccccc12)[C@H]1CCS(=O)(=O)C1	ZINC000872339646	ED	On-Demand	Reactive	GCGR	16	41
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000872339732	FC	On-Demand	Reactive	L3MBTL3	69	39
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000872339733	FC	On-Demand	Reactive	L3MBTL3	69	39
CCCNC(=O)c1cccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c1	ZINC000872339755	GE	On-Demand	Anodyne	DRD4	42	32
CCNC(=O)c1ccccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872339791	FE	On-Demand	Anodyne	PRTN3	53	41
C(=Nn1cnnc1-c1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872339807	GF	On-Demand	Mild	LTA4H	48	49
COCCc1ncc(C=NNC(=O)c2ccc3c(c2)OCCO3)s1	ZINC000872339839	ED	On-Demand	Reactive	ADCYAP1R1	63	32
CC[C@@H](C)C(=O)NNS(=O)(=O)c1cccc(F)c1OC	ZINC000872339990	DD	On-Demand	Reactive	ACE2	43	33
Cc1cccc(C#N)c1S(=O)(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872340047	GE	On-Demand	Mild	BTK	37	42
CC[C@@H](C)C(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872340091	DE	On-Demand	Reactive	LEF	40	47
CC(C)(C)C(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872340122	DE	On-Demand	Reactive	LEF	34	41
COc1ncccc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872340182	GF	On-Demand	Anodyne	PKM	41	49
CC(=NNC(=O)c1cc(Br)cn1C)c1cn(C)cn1	ZINC000872340222	DD	On-Demand	Reactive	PYK	52	37
CC(CCc1cccnc1)=NNC(=O)c1ccc2c(c1)OCCO2	ZINC000872340224	EF	On-Demand	Reactive	CHRNA7	27	52
CC[C@@H](C)C(=O)NNS(=O)(=O)c1ccc(C(C)(C)C)c(F)c1	ZINC000872340285	EE	On-Demand	Reactive	LEF	37	43
CC(C)(C)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872340301	FF	On-Demand	Reactive	PRTN3	50	32
CC(C)(C)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872340301	FF	On-Demand	Reactive	IDO1	34	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)Cc1cc(C)[nH]n1	ZINC000872340311	DF	On-Demand	Reactive	MC5R	54	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)Cc1cc(C)[nH]n1	ZINC000872340311	DF	On-Demand	Reactive	MC1R	56	35
Cn1ncc(S(=O)(=O)N2CCCc3cc(C(N)=O)ccc32)c1C(F)(F)F	ZINC000872340344	GD	On-Demand	Anodyne	CYP11B2	25	40
CC[C@@H](C)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872340424	FF	On-Demand	Reactive	IDO1	35	40
C#CCNC(=O)c1ccccc1NS(=O)(=O)CC1(OC)CCC1	ZINC000872340437	ED	On-Demand	Mild	PRTN3	46	36
CC(CCOCc1ccccc1)=NNC(=O)c1cnccn1	ZINC000872340443	CE	On-Demand	Reactive	PSMB5	45	41
CCOc1cc(NS(=O)(=O)c2cnn(C)c2Br)ccc1OC	ZINC000872340452	GE	On-Demand	Anodyne	ALPL	23	41
CCOc1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1OC	ZINC000872340467	FF	On-Demand	Anodyne	SSTR5	17	42
O=C(c1ccc(C=NOCc2ccccc2)cc1)N1CCCC1	ZINC000872340515	DG	On-Demand	Mild	PREP	34	41
O=C(c1ccc(C=NOCc2ccccc2)cc1)N1CCCC1	ZINC000872340515	DG	On-Demand	Mild	L3MBTL3	73	38
Cn1ncc2c(=O)n(N=CC(F)(F)C(F)(F)F)cnc21	ZINC000872340518	CD	On-Demand	Mild	Q9M629_MAIZE	41	32
O=c1ccc(NS(=O)(=O)c2cnn(C3CCCC3)c2)cn1Cc1ccccc1	ZINC000872340530	GG	On-Demand	Anodyne	NR1I2	45	38
CCC(CCC(F)(F)F)=NNC(=O)c1cc(-c2ccccc2)on1	ZINC000872340533	EI	On-Demand	Reactive	HDAC10	15	47
Cn1ncc(S(=O)(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c1C(F)(F)F	ZINC000872340534	GD	On-Demand	Anodyne	PANC	45	32
Cn1ncc(S(=O)(=O)Nc2cnn(C[C@H]3CCCO3)c2)c1C(F)(F)F	ZINC000872340535	GD	On-Demand	Anodyne	PANC	45	32
CCOc1cc(NS(=O)(=O)c2cn(C)nc2Br)ccc1OC	ZINC000872340541	GE	On-Demand	Anodyne	SSTR5	19	44
CCOc1cc(NS(=O)(=O)c2cn(C)nc2Br)ccc1OC	ZINC000872340541	GE	On-Demand	Anodyne	DRTS_TRYCR	44	32
CCOc1cc(NS(=O)(=O)N=S(=O)(CC)CC)ccc1OC	ZINC000872340558	FE	On-Demand	Anodyne	ENPP1	44	32
CCOc1cc(NS(=O)(=O)N=S(=O)(CC)CC)ccc1OC	ZINC000872340558	FE	On-Demand	Anodyne	DRTS_TRYCR	43	31
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2Br)cc1Cl	ZINC000872340567	GG	On-Demand	Anodyne	NR1I2	48	39
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2Br)cc1Cl	ZINC000872340567	GG	On-Demand	Anodyne	ALPL	19	44
CCOc1cc(NS(=O)(=O)c2[nH]cnc2Br)ccc1OC	ZINC000872340610	GE	On-Demand	Anodyne	ENPP1	45	34
O=C(NN=Cc1cccc(CC2CCC2)c1)c1cnccn1	ZINC000872340625	CF	On-Demand	Reactive	PSMB5	46	35
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	ESR1	76	41
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	KCNH2	17	44
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	ESR2	50	41
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	LTA4H	67	63
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	HRH3	28	49
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	PSMB2	41	41
C(=NOCc1ccccc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872340629	EF	On-Demand	Mild	PSMB1	44	41
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1cnccn1	ZINC000872340653	EE	On-Demand	Reactive	PSMB5	41	35
Cn1nc2c(c1S(=O)(=O)Nc1ccc(=O)n(Cc3ccccc3)c1)CCCC2	ZINC000872340661	GE	On-Demand	Anodyne	NR1I2	47	39
CCC(=NNC(=O)c1cnccn1)c1cccc(OC)c1OC	ZINC000872340672	DE	On-Demand	Reactive	KCNK3	42	38
C#CCNC(=O)c1ccccc1NS(=O)(=O)c1cnn(C2CCCC2)c1	ZINC000872340682	FE	On-Demand	Mild	PRTN3	51	40
CC(CCc1cccnc1)=NNC(=O)c1sc(N)nc1C	ZINC000872340683	DE	On-Demand	Reactive	TBXAS1	24	40
CC(CCc1cccnc1)=NNC(=O)c1sc(N)nc1C	ZINC000872340683	DE	On-Demand	Reactive	SCD1	18	41
CC(CCc1cccnc1)=NNC(=O)c1sc(N)nc1C	ZINC000872340683	DE	On-Demand	Reactive	SCD	17	41
Cn1ncc2c(=O)n(N=Cc3ccc(OCCN4CCOCC4)cc3)cnc21	ZINC000872340690	GC	On-Demand	Mild	LTA4H	18	40
Cn1ncc2c(=O)n(N=Cc3ccc(OCCN4CCOCC4)cc3)cnc21	ZINC000872340690	GC	On-Demand	Mild	MKNK1	21	42
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1Cl	ZINC000872340746	GG	On-Demand	Anodyne	SGK1	46	36
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1Cl	ZINC000872340746	GG	On-Demand	Anodyne	ALPL	19	44
CN1CCC(C=NNC(=O)COc2ccc3ccccc3c2)CC1	ZINC000872340772	EF	On-Demand	Reactive	HTR1B	20	41
CN1CCC(C=NNC(=O)COc2ccc3ccccc3c2)CC1	ZINC000872340772	EF	On-Demand	Reactive	MCHR1	17	41
CCOc1cc(F)ccc1NS(=O)(=O)c1cnn(C)c1C(F)(F)F	ZINC000872340777	FF	On-Demand	Anodyne	MOGAT2	45	32
Cn1nc2c(c1C=NNC(=O)Cc1cccc3ccccc13)CCCC2	ZINC000872340791	EG	On-Demand	Reactive	BCHE	57	33
C#CCNC(=O)c1ccccc1NS(=O)(=O)c1c2c(nn1C)CCCC2	ZINC000872340798	FD	On-Demand	Mild	PRTN3	40	36
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccc2c(c1)OCCO2	ZINC000872340802	GE	On-Demand	Reactive	L3MBTL3	47	34
CCOc1cc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)ccc1OC	ZINC000872340804	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
C#CCNC(=O)c1ccccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872340810	FD	On-Demand	Mild	PRTN3	50	39
COCCc1ncc(C=NNC(=O)c2ccc(Cl)cc2OC)s1	ZINC000872340822	FF	On-Demand	Reactive	F10	47	31
O=S(=O)(Nc1cnn(C[C@@H]2CCCO2)c1)c1ccc2c3c(cccc13)CC2	ZINC000872340862	GG	On-Demand	Anodyne	PANC	40	30
O=S(=O)(Nc1cnn(C[C@H]2CCCO2)c1)c1ccc2c3c(cccc13)CC2	ZINC000872340863	GG	On-Demand	Anodyne	PANC	40	30
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872340886	FC	On-Demand	Reactive	LTA4H	33	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872340886	FC	On-Demand	Reactive	EPHX2	17	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872340886	FC	On-Demand	Reactive	FLT3	15	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872340886	FC	On-Demand	Reactive	EPHA2	17	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872340886	FC	On-Demand	Reactive	MKNK1	22	42
CC(=NNC(=O)c1cnccn1)c1ccc(C2CCC2)cc1	ZINC000872340957	CF	On-Demand	Reactive	PPO2	20	42
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1Cl	ZINC000872340968	GG	On-Demand	Anodyne	HTR2A	19	43
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1Cl	ZINC000872340968	GG	On-Demand	Anodyne	ALPL	20	46
CCOc1cc(NS(=O)(=O)c2cccc(F)c2OC)ccc1OC	ZINC000872341004	FG	On-Demand	Anodyne	ALPL	27	43
CCOc1cc(NS(=O)(=O)c2cccc(F)c2OC)ccc1OC	ZINC000872341004	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	ESR1	85	40
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	ESR2	59	40
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	LTA4H	55	53
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	HRH3	49	48
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	PSMB2	45	43
CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341067	CD	On-Demand	Mild	PSMB1	49	44
CC(C)(C)OC(=O)NCc1cccc(C=NNc2cnccn2)c1	ZINC000872341077	EF	On-Demand	Mild	PDS	62	35
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1F	ZINC000872341079	GF	On-Demand	Anodyne	HTR2A	17	41
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1F	ZINC000872341079	GF	On-Demand	Anodyne	ALPL	16	44
CC(CCCc1cccnc1)=NNC(=N)N	ZINC000872341096	BD	On-Demand	Mild	PPO2	38	40
O=C(c1ccc(C=NNc2cnccn2)cc1)N1CCCC1	ZINC000872341130	CE	On-Demand	Mild	L3MBTL3	50	36
CCC(=NNc1ncccn1)c1cccc(OC)c1OC	ZINC000872341189	CF	On-Demand	Mild	KCNK3	42	38
CC(=O)Nc1cccc2c1CCCN2S(=O)(=O)c1c(C)cccc1C#N	ZINC000872341233	FF	On-Demand	Mild	CSNK2A1	52	33
N=C(N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341235	CC	On-Demand	Mild	ESR1	59	37
N=C(N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341235	CC	On-Demand	Mild	LTA4H	47	48
N=C(N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341235	CC	On-Demand	Mild	HRH3	20	44
N=C(N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341235	CC	On-Demand	Mild	EPHX2	16	45
N=C(N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872341235	CC	On-Demand	Mild	PSMB1	43	37
O=c1ccc2cc(NS(=O)(=O)c3cnn(C4CCCC4)c3)ccc2o1	ZINC000872341260	FF	On-Demand	Anodyne	GRK5	40	34
O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1cc(Cl)cnc1Cl	ZINC000872341265	GG	On-Demand	Clean	STAT6	43	32
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	ESR1	54	37
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	LTA4H	61	54
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	HRH3	26	44
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	FLT3	15	45
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	EPHA2	17	41
C(=NNc1ncccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341316	ED	On-Demand	Mild	PSMB1	42	39
O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1cc(F)cc(F)c1O	ZINC000872341317	FE	On-Demand	Clean	STAT6	41	36
CON=Cc1cccc(OC(C)(C)C)c1	ZINC000872341324	BF	On-Demand	Mild	CYP1B1	18	40
CON=Cc1cccc(OC(C)(C)C)c1	ZINC000872341324	BF	On-Demand	Mild	CYP1A1	16	40
COC(=O)c1ccoc1S(=O)(=O)Nc1cccc(N2CCOCC2)c1	ZINC000872341331	FD	On-Demand	Anodyne	EPHB4	61	35
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)cc1F	ZINC000872341387	FF	On-Demand	Anodyne	ALPL	15	42
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2Br)cc1F	ZINC000872341397	GF	On-Demand	Anodyne	ALPL	16	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ncccn1)C2	ZINC000872341403	EG	On-Demand	Mild	GPR119	20	45
Cc1nocc1S(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000872341407	EF	On-Demand	Anodyne	PKM	18	42
CC(=O)Nc1cccc2c1CCCN2S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872341441	FF	On-Demand	Mild	CSNK2A1	44	32
FC(F)COCCC=NNc1ncnc2c1cnn2-c1ccccc1	ZINC000872341445	EF	On-Demand	Mild	GSK3B	17	55
CCOc1ccc(S(=O)(=O)NNC(=O)NC)cc1C(C)C	ZINC000872341470	DD	On-Demand	Reactive	MMP12	51	36
CCOc1ccc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1CO	ZINC000872341479	GG	On-Demand	Anodyne	LEF	20	43
CCC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(OC)c1OC	ZINC000872341496	GF	On-Demand	Reactive	KCNK3	47	39
CCC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(OC)c1OC	ZINC000872341496	GF	On-Demand	Reactive	KCNK9	48	39
CCCNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872341509	BC	On-Demand	Mild	CA2	33	43
CCCNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872341509	BC	On-Demand	Mild	CA1	25	43
CCCNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872341509	BC	On-Demand	Mild	CA4	25	40
CCCNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872341511	BG	On-Demand	Mild	MPO	49	45
CCCNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872341511	BG	On-Demand	Mild	ALOX15	17	45
Cn1ncc2c(NN=Cc3ccc(C(=O)N4CCCC4)cc3)ncnc21	ZINC000872341513	EE	On-Demand	Mild	GSK3B	16	53
O=C(c1ccc(C=NNCc2cccc(F)c2)cc1)N1CCCC1	ZINC000872341539	EG	On-Demand	Mild	L3MBTL3	44	35
CON=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872341578	BD	On-Demand	Mild	PROKR1	64	35
CON=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872341593	CF	On-Demand	Mild	PDS	59	34
CC(=NNC(=N)N)c1ccc(C2CCC2)cc1	ZINC000872341608	BE	On-Demand	Mild	PPO2	32	46
CC[C@H](C)NC(=O)c1ccc(NS(=O)(=O)c2cccc(F)c2OC)cc1	ZINC000872341637	GG	On-Demand	Anodyne	CTSS	18	41
COC1(CS(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)CCC1	ZINC000872341671	EF	On-Demand	Anodyne	NPY2R	46	34
C(=NNc1cnccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341693	ED	On-Demand	Mild	LTA4H	39	45
C(=NNc1cnccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872341693	ED	On-Demand	Mild	EPHA2	15	43
N=C(N)NN=C1CCCc2ncccc21	ZINC000872341699	BC	On-Demand	Mild	AMD1	16	55
CCOc1ccc(NS(=O)(=O)c2cccc(F)c2OC)cc1CO	ZINC000872341700	FF	On-Demand	Anodyne	ALPL	20	40
CN1CCC(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	ZINC000872341702	DD	On-Demand	Reactive	CACNA1B	43	36
CN1CCC(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	ZINC000872341702	DD	On-Demand	Reactive	AKR1C3	49	38
C=CCC1(C=NNc2ncnc3c2cnn3-c2ccccc2)CCOCC1	ZINC000872341730	FH	On-Demand	Mild	GSK3B	15	48
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CCCC1	ZINC000872341731	DF	On-Demand	Reactive	L3MBTL3	95	45
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC2CC2)cn1	ZINC000872341769	FE	On-Demand	Mild	C3AR1	36	40
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC2CC2)cn1	ZINC000872341769	FE	On-Demand	Mild	NAMPT	36	47
COc1ccnc(NN=C2CCC(CNC(C)=O)CC2)n1	ZINC000872341775	CD	On-Demand	Mild	MTNR1A	23	40
COc1ccnc(NN=C2CCC(CNC(C)=O)CC2)n1	ZINC000872341775	CD	On-Demand	Mild	MTNR1B	21	40
COc1cc(C=NNC(=O)C2CCCC2)c(Cl)cc1O	ZINC000872341784	CF	On-Demand	Reactive	GCGR	21	43
CC(C)(C)OC(=O)NCc1cccc(C=NNc2ncccn2)c1	ZINC000872341839	EF	On-Demand	Mild	PDS	60	34
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1cnccn1)C2	ZINC000872341867	EG	On-Demand	Mild	GPR119	15	41
CON=Cc1cn(C[C@H]2CCCO2)nn1	ZINC000872341869	BC	On-Demand	Mild	PDE8B	40	37
CON=Cc1cn(C[C@@H]2CCCO2)nn1	ZINC000872341871	BC	On-Demand	Mild	PDE8B	40	37
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000872341876	FF	On-Demand	Anodyne	NPY2R	60	35
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000872341876	FF	On-Demand	Anodyne	SLC6A9	19	40
C[S@](=O)(=NS(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000872341887	GG	On-Demand	Anodyne	NPY2R	73	38
C[S@](=O)(=NS(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000872341887	GG	On-Demand	Anodyne	SLC6A9	17	41
C(=NNc1ncnc2c1cnn2-c1ccccc1)C1CC2(C1)OCCO2	ZINC000872341908	FE	On-Demand	Mild	GSK3B	15	49
Cn1ncc2c(NN=Cc3ccc(OCCN4CCOCC4)cc3)ncnc21	ZINC000872341909	GD	On-Demand	Mild	LTA4H	16	40
Cn1ncc2c(NN=Cc3ccc(OCCN4CCOCC4)cc3)ncnc21	ZINC000872341909	GD	On-Demand	Mild	GSK3B	16	50
CCCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872341925	CE	On-Demand	Mild	L3MBTL3	71	39
CCCNN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872341963	CG	On-Demand	Mild	PDS	57	34
CC(CCc1cccnc1)=NNc1ccc(S(C)(=O)=O)cc1	ZINC000872341969	DF	On-Demand	Mild	TBXAS1	47	45
CC(CCc1cccnc1)=NNc1ccc(S(C)(=O)=O)cc1	ZINC000872341969	DF	On-Demand	Mild	NAMPT	64	53
CCOc1ccc(NS(=O)(=O)c2cnn(C)c2Br)cc1CO	ZINC000872341984	GD	On-Demand	Anodyne	ALPL	16	41
Cn1ncc2c(NN=Cc3cccc(OC(C)(C)C)c3)ncnc21	ZINC000872342015	DF	On-Demand	Mild	GSK3B	19	56
CNC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872342026	ED	On-Demand	Reactive	CA12	17	40
CNC(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872342026	ED	On-Demand	Reactive	IDO1	36	45
CCCNN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872342031	CD	On-Demand	Mild	PROKR1	71	36
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342070	FF	On-Demand	Mild	TBXAS1	22	41
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342070	FF	On-Demand	Mild	C3AR1	36	40
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342070	FF	On-Demand	Mild	TGM2	26	41
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342070	FF	On-Demand	Mild	NAMPT	63	52
CS(=O)(=O)c1ccc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872342074	FF	On-Demand	Mild	L3MBTL3	57	39
FC1(F)CC[C@@H](C=NNc2ncnc3c2cnn3-c2ccccc2)C1	ZINC000872342119	EH	On-Demand	Mild	GSK3B	15	55
FC1(F)CC[C@H](C=NNc2ncnc3c2cnn3-c2ccccc2)C1	ZINC000872342120	EH	On-Demand	Mild	GSK3B	15	55
CCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872342149	CD	On-Demand	Mild	LTA4H	42	48
CCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872342149	CD	On-Demand	Mild	HRH3	19	42
CCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872342149	CD	On-Demand	Mild	PSMB2	40	37
CCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872342149	CD	On-Demand	Mild	PSMB1	42	37
CCCNN=C(C)CCc1cccnc1	ZINC000872342184	BE	On-Demand	Mild	TBXAS1	36	41
CS(=O)(=O)c1ccc(NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872342185	DF	On-Demand	Mild	PTGS2	27	40
CCC(CCC(F)(F)F)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342208	GG	On-Demand	Mild	GCK	57	33
CCC(CCC(F)(F)F)=NNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000872342208	GG	On-Demand	Mild	GCKR	76	35
CC(=NNc1ccc(S(=O)(=O)N2CCCC2)cn1)c1cc(O)ccc1F	ZINC000872342228	GF	On-Demand	Mild	GCK	46	30
CC(=NNc1ccc(S(=O)(=O)N2CCCC2)cn1)c1cc(O)ccc1F	ZINC000872342228	GF	On-Demand	Mild	GCKR	50	33
COc1ccnc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1	ZINC000872342254	EE	On-Demand	Mild	L3MBTL3	49	34
O=S(=O)(c1ccc(NN=C2CCCc3ncccc32)nc1)N1CCCC1	ZINC000872342285	FE	On-Demand	Mild	NAMPT	25	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	ESR1	86	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	ESR2	58	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	LTA4H	54	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	HRH3	42	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	EPHX2	21	51
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	FLT3	15	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	PSMB2	40	38
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCCC1	ZINC000872342312	EE	On-Demand	Reactive	PSMB1	45	41
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC(C)C)cn1	ZINC000872342314	FF	On-Demand	Mild	TBXAS1	44	40
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC(C)C)cn1	ZINC000872342314	FF	On-Demand	Mild	NAMPT	31	42
CCC(CCC(F)(F)F)=NNc1ccc(S(=O)(=O)NC2CC2)cn1	ZINC000872342315	FG	On-Demand	Mild	SFRP1	67	32
CCCNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872342328	CF	On-Demand	Mild	SIGMAR1	22	44
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872342332	GE	On-Demand	Anodyne	PRTN3	44	32
c1ccc(CN2C[C@H]3C(=NNc4ncccn4)CC[C@H]3C2)cc1	ZINC000872342333	DF	On-Demand	Mild	SIGMAR1	16	44
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1cnn(C2CCCC2)c1	ZINC000872342366	GF	On-Demand	Anodyne	PRTN3	46	33
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC(C)(C)C)cn1	ZINC000872342399	GF	On-Demand	Mild	TBXAS1	42	40
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC(C)(C)C)cn1	ZINC000872342399	GF	On-Demand	Mild	NAMPT	29	42
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000872342404	FF	On-Demand	Anodyne	PTPRB	49	36
O=C(NN=Cc1cn(C[C@H]2CCCO2)nn1)C1CCCC1	ZINC000872342424	CD	On-Demand	Reactive	PDE8B	41	32
O=C(NN=Cc1cn(C[C@@H]2CCCO2)nn1)C1CCCC1	ZINC000872342429	CD	On-Demand	Reactive	PDE8B	41	32
COCCc1ncc(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)s1	ZINC000872342434	FD	On-Demand	Reactive	ADCYAP1R1	74	34
CS(=O)(=O)c1cccc(C(=O)NN=CC(F)(F)C(F)(F)F)c1	ZINC000872342460	EE	On-Demand	Reactive	ADCYAP1R1	48	31
COc1ccc(Cn2cc(C=NNC(=O)C3CCCC3)nn2)cc1	ZINC000872342472	ED	On-Demand	Reactive	GHSR	21	40
COc1ccc(Cn2cc(C=NNC(=O)C3CCCC3)nn2)cc1	ZINC000872342472	ED	On-Demand	Reactive	PROKR1	65	36
CN1CCC(C=NNc2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000872342569	EF	On-Demand	Mild	GSK3B	17	58
CS(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872342584	GE	On-Demand	Reactive	ADCYAP1R1	70	35
O=S(=O)(c1ccc(NN=CC2CC3(C2)OCCO3)nc1)N1CCCC1	ZINC000872342664	FD	On-Demand	Mild	TGM2	19	40
O=C(c1ccc(C=NNc2ncccn2)cc1)N1CCCC1	ZINC000872342701	CE	On-Demand	Mild	L3MBTL3	85	42
O=C(c1ccc(C=NNc2ncccn2)cc1)N1CCCC1	ZINC000872342701	CE	On-Demand	Mild	HPGD	40	39
O=S(=O)(c1ccc(NN=CC(F)(F)C(F)(F)F)nc1)N1CCCC1	ZINC000872342702	FE	On-Demand	Mild	GCK	58	32
O=S(=O)(c1ccc(NN=CC(F)(F)C(F)(F)F)nc1)N1CCCC1	ZINC000872342702	FE	On-Demand	Mild	GCKR	64	32
O=C(c1ccc(C=NNc2cncc(Cl)n2)cc1)N1CCCC1	ZINC000872342709	EF	On-Demand	Mild	L3MBTL3	46	35
CC(CCc1cccnc1)=NNC(=O)C1CCCC1	ZINC000872342734	CF	On-Demand	Reactive	FKBP1A	17	41
CC(CCc1cccnc1)=NNC(=O)C1CCCC1	ZINC000872342734	CF	On-Demand	Reactive	TBXAS1	32	41
CC(CCc1cccnc1)=NNC(=O)C1CCCC1	ZINC000872342734	CF	On-Demand	Reactive	CHRNA7	44	35
CC(CCc1cccnc1)=NNC(=O)C1CCCC1	ZINC000872342734	CF	On-Demand	Reactive	C3AR1	42	44
CC(CCc1cccnc1)=NNC(=O)C1CCCC1	ZINC000872342734	CF	On-Demand	Reactive	NAMPT	38	42
CC(C)(C)OC(=O)NC1CC(C=NNc2ccc(S(C)(=O)=O)cc2)C1	ZINC000872342749	FF	On-Demand	Mild	GPR119	17	40
CCCCNC(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872342815	EE	On-Demand	Reactive	LEF	34	42
CC(=NNC(=O)C(C)(C)C)c1cccc(O)c1F	ZINC000872342866	CE	On-Demand	Reactive	PYK	48	32
O=C(NCC1CC1)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872342876	ED	On-Demand	Reactive	LEF	31	41
CC(C)(C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872342911	DE	On-Demand	Reactive	NPY2R	17	41
CC(C)(C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872342911	DE	On-Demand	Reactive	MLYCD	19	43
CC(C)(C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872342911	DE	On-Demand	Reactive	L3MBTL3	71	40
CC(C)(C)C(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872342949	CG	On-Demand	Reactive	ADCYAP1R1	43	32
C(=NNc1ccc(-n2cccn2)nn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872342983	GD	On-Demand	Mild	LTA4H	31	42
O=C(Cc1ccc2ccccc2c1)NN=CCCCCCO	ZINC000872343005	CG	On-Demand	Reactive	HDAC8	15	40
COc1cc(C=NNC(=O)C(C)(C)C)c(Cl)cc1O	ZINC000872343038	CF	On-Demand	Reactive	GCGR	23	46
COc1cc(C=NNC(=O)C(C)(C)C)c(Cl)cc1O	ZINC000872343038	CF	On-Demand	Reactive	ADCYAP1R1	54	38
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)C(C)(C)C)c1	ZINC000872343043	EG	On-Demand	Reactive	ADCYAP1R1	41	35
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)C(C)(C)C)c1	ZINC000872343043	EG	On-Demand	Reactive	PDS	41	32
CC(CCOCc1ccccc1)=NNC(=O)C(C)(C)C	ZINC000872343096	CG	On-Demand	Reactive	PPO2	34	41
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	ESR1	55	36
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	LTA4H	40	45
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	HRH3	25	43
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	EPHX2	23	47
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	FLT3	15	44
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	PSMB1	42	40
CC(C)(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343301	ED	On-Demand	Reactive	TBK1	15	43
COc1ccc(Cn2cc(C=NNC(=O)C(C)(C)C)nn2)cc1	ZINC000872343313	DD	On-Demand	Reactive	PROKR1	78	40
CC(C)(C)C(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872343320	CE	On-Demand	Reactive	ADCYAP1R1	47	31
CC(CCc1cccnc1)=NNC(=O)C(C)(C)C	ZINC000872343321	BF	On-Demand	Reactive	TBXAS1	53	45
CC(CCc1cccnc1)=NNC(=O)C(C)(C)C	ZINC000872343321	BF	On-Demand	Reactive	NAMPT	21	43
CCOc1ccc(S(=O)(=O)NNC(=O)NCC2CC2)cc1C(C)C	ZINC000872343327	FE	On-Demand	Reactive	CACNA1I	42	34
CCOC(=O)/C=C/c1ccc(C=NNC(=O)[C@@H](C)CC)n1C	ZINC000872343404	DE	On-Demand	Reactive	PSMB2	40	31
CCOC(=O)/C=C/c1ccc(C=NNC(=O)[C@H](C)CC)n1C	ZINC000872343405	DE	On-Demand	Reactive	PSMB2	40	31
CC[C@@H](C)C(=O)NN=C[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000872343408	DF	On-Demand	Reactive	CTSK	15	40
CN1CCC(C=NNC(=O)c2ccc3ccccc3c2)CC1	ZINC000872343414	CF	On-Demand	Reactive	HTR1F	52	40
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C=NNCCN1CCCCC1	ZINC000872343444	EG	On-Demand	Mild	SLC6A1	28	49
CC[C@@H](C)C(=O)NN=C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000872343457	CE	On-Demand	Reactive	CTSK	16	40
CC[C@@H](C)C(=O)NN=CC1CC(NC(=O)OC(C)(C)C)C1	ZINC000872343458	CE	On-Demand	Reactive	CTSK	16	40
O=C(NN=CCCCCCO)c1ccc2ccccc2c1	ZINC000872343493	CG	On-Demand	Reactive	HDAC8	16	43
CC(CCc1cccnc1)=NNCCN1CCCCC1	ZINC000872343494	CE	On-Demand	Mild	TBXAS1	22	40
CC(CCc1cccnc1)=NNCCN1CCCCC1	ZINC000872343494	CE	On-Demand	Mild	CHRNA7	40	42
CC(CCc1cccnc1)=NNCCN1CCCCC1	ZINC000872343494	CE	On-Demand	Mild	NAMPT	20	41
CC[C@@H](C)C(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872343498	DD	On-Demand	Reactive	PROKR1	70	37
O=C(NN=CCCOCC(F)F)c1ccc2ccccc2c1	ZINC000872343505	DG	On-Demand	Reactive	PIN1	34	45
COc1ccc(Cn2cc(C=NNCCN3CCCCC3)nn2)cc1	ZINC000872343512	ED	On-Demand	Mild	HRH3	26	45
COc1ccc(Cn2cc(C=NNCCN3CCCCC3)nn2)cc1	ZINC000872343512	ED	On-Demand	Mild	PROKR1	55	32
C(=NNCCN1CCCCC1)c1cccc2ncccc12	ZINC000872343516	CF	On-Demand	Mild	SLC6A1	27	42
C(=NNCCN1CCCCC1)c1cccc2ncccc12	ZINC000872343516	CF	On-Demand	Mild	HNMT	115	52
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(Cl)nc1	ZINC000872343544	GE	On-Demand	Reactive	LTA4H	26	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(Cl)nc1	ZINC000872343544	GE	On-Demand	Reactive	EPHX2	21	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(Cl)nc1	ZINC000872343544	GE	On-Demand	Reactive	FLT3	18	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(Cl)nc1	ZINC000872343544	GE	On-Demand	Reactive	ADCYAP1R1	57	42
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	ESR1	80	36
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	ESR2	52	36
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	LTA4H	44	44
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	HRH3	22	42
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	EPHX2	21	46
CC[C@@H](C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872343548	ED	On-Demand	Reactive	PSMB1	41	39
Cc1scc(C=NNCCN2CCCCC2)c1C	ZINC000872343550	CF	On-Demand	Mild	SLC6A1	26	41
c1cnc2c(c1)C(=NNCCN1CCCCC1)CCC2	ZINC000872343557	CE	On-Demand	Mild	HNMT	92	42
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)c1ccc(Cl)nc1	ZINC000872343590	FE	On-Demand	Reactive	ADCYAP1R1	56	30
O=C(c1ccc(C=NNCCN2CCCCC2)cc1)N1CCCC1	ZINC000872343592	EE	On-Demand	Mild	SLC6A1	29	42
O=C(c1ccc(C=NNCCN2CCCCC2)cc1)N1CCCC1	ZINC000872343592	EE	On-Demand	Mild	L3MBTL3	64	43
COc1ccc(Cn2cc(C=NNC(=O)CC(F)(F)F)nn2)cc1	ZINC000872343609	ED	On-Demand	Reactive	PROKR1	58	34
Cc1c(C=NNCCN2CCCCC2)cccc1[N+](=O)[O-]	ZINC000872343610	CE	On-Demand	Mild	SLC6A1	29	45
CC[C@@H](C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872343633	DE	On-Demand	Reactive	L3MBTL3	63	37
Fc1cc(OC(F)F)ccc1C=NNCCN1CCCCC1	ZINC000872343641	DF	On-Demand	Mild	SLC6A1	30	45
CC[C@@H](C)C(=O)NN=Cc1c(C)ccc([N+](=O)[O-])c1C	ZINC000872343652	CF	On-Demand	Reactive	COLA	76	38
C(=NNCCN1CCCCC1)c1ccc2nccnc2c1	ZINC000872343662	CE	On-Demand	Mild	HNMT	89	41
CC[C@@H](C)C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872343755	EG	On-Demand	Reactive	CTSK	15	42
CC[C@@H](C)C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872343755	EG	On-Demand	Reactive	FPR1	44	35
CC[C@@H](C)C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872343755	EG	On-Demand	Reactive	PDS	66	36
CCC(=NNC(=O)CC(F)(F)F)c1cccc(OC)c1OC	ZINC000872343768	DF	On-Demand	Reactive	KCNK3	44	38
CCC(=NNC(=O)CC(F)(F)F)c1cccc(OC)c1OC	ZINC000872343768	DF	On-Demand	Reactive	KCNK9	42	38
CC[C@@H](C)C(=O)NN=C(C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872343769	CF	On-Demand	Reactive	COLA	104	35
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872343812	CF	On-Demand	Reactive	GCGR	19	41
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872343812	CF	On-Demand	Reactive	PDE10A	24	52
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872343812	CF	On-Demand	Reactive	ADCYAP1R1	42	38
CC(=O)Nc1cccc(C=NNCCN2CCCCC2)c1	ZINC000872343848	CE	On-Demand	Mild	SLC6A1	28	42
CC(=O)Nc1cccc(C=NNCCN2CCCCC2)c1	ZINC000872343848	CE	On-Demand	Mild	CHRNA7	20	53
CC(=O)Nc1cccc(C=NNCCN2CCCCC2)c1	ZINC000872343848	CE	On-Demand	Mild	EPHX2	15	42
CC(=O)Nc1cccc(C=NNCCN2CCCCC2)c1	ZINC000872343848	CE	On-Demand	Mild	MCHR1	33	41
CC[C@@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872344007	BF	On-Demand	Reactive	TBXAS1	39	42
CC[C@@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872344007	BF	On-Demand	Reactive	PTAFR	30	40
CC[C@@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872344007	BF	On-Demand	Reactive	PPO2	32	41
CC[C@@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872344007	BF	On-Demand	Reactive	NAMPT	25	41
C(=NNCCN1CCCCC1)c1cn(C2CC2)cn1	ZINC000872344051	CD	On-Demand	Mild	SLC6A1	26	40
Fc1cc(C=NNCCN2CCCCC2)cnc1Cl	ZINC000872344093	CE	On-Demand	Mild	SLC6A1	27	41
CCC(CCC(F)(F)F)=NNC(=O)c1ccc2ccccc2c1	ZINC000872344104	DJ	On-Demand	Reactive	KCNJ11	68	35
CCC(CCC(F)(F)F)=NNC(=O)c1ccc2ccccc2c1	ZINC000872344104	DJ	On-Demand	Reactive	HDAC8	22	41
O=C(NCC(F)(F)F)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344123	FD	On-Demand	Reactive	LTA4H	31	42
O=C(NCC(F)(F)F)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344123	FD	On-Demand	Reactive	EPHX2	25	51
CC[C@@H](C)C(=O)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872344143	EF	On-Demand	Reactive	PDE10A	23	40
O=C(NCC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344154	ED	On-Demand	Reactive	ESR1	52	36
O=C(NCC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344154	ED	On-Demand	Reactive	AVPR1B	23	41
O=C(NCC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344154	ED	On-Demand	Reactive	LTA4H	42	42
O=C(NCC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344154	ED	On-Demand	Reactive	HRH3	16	41
O=C(NCC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344154	ED	On-Demand	Reactive	EPHX2	25	48
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872344168	EG	On-Demand	Reactive	PDE10A	22	44
C(=NNCCN1CCCCC1)c1nncn1Cc1ccccc1	ZINC000872344173	DD	On-Demand	Mild	HNMT	43	33
CC[C@@H](C)C(=O)NN=Cc1nncn1Cc1ccccc1	ZINC000872344195	CD	On-Demand	Reactive	ACE2	41	35
CC(CCOCc1ccccc1)=NNc1ncnc2[nH]cnc12	ZINC000872344200	DF	On-Demand	Mild	MGMT	24	40
CN(C)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000872344224	FD	On-Demand	Reactive	IDO1	32	43
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)NCC(F)(F)F)c1	ZINC000872344233	FF	On-Demand	Reactive	PDS	40	34
O=C(c1ccc(C=NNS(=O)(=O)Cc2ccccc2)cc1)N1CCCC1	ZINC000872344254	FE	On-Demand	Mild	L3MBTL3	55	36
O=C(c1ccc(C=NNS(=O)(=O)Cc2ccccc2)cc1)N1CCCC1	ZINC000872344254	FE	On-Demand	Mild	TMPRSS11D	85	32
CNC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344276	CD	On-Demand	Reactive	MLYCD	19	43
CNC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344276	CD	On-Demand	Reactive	L3MBTL3	71	40
CC[C@@H](C)C(=O)NN=Cc1cccc([N+](=O)[O-])c1C	ZINC000872344281	CE	On-Demand	Reactive	COLA	109	34
O=C(NCC(F)(F)F)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344309	EE	On-Demand	Reactive	MLYCD	21	47
O=C(NCC(F)(F)F)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344309	EE	On-Demand	Reactive	L3MBTL3	48	36
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(C)cc1O	ZINC000872344317	DH	On-Demand	Reactive	PYK	46	33
CC[C@@H](C)C(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872344332	CE	On-Demand	Reactive	AMD1	20	40
CCC(=NNC(=O)CCc1ccc(OC)cc1)[C@H]1CCCOC1	ZINC000872344378	DF	On-Demand	Reactive	PPO2	29	40
CCC(=NNC(=O)CCc1ccc(OC)cc1)[C@@H]1CCCOC1	ZINC000872344379	DF	On-Demand	Reactive	PPO2	29	40
Cc1cc(C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344385	HG	On-Demand	Anodyne	CA2	21	46
Cc1cc(C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344385	HG	On-Demand	Anodyne	DRD4	25	45
Cc1cc(C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344385	HG	On-Demand	Anodyne	CA7	16	46
Cc1cc(C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344385	HG	On-Demand	Anodyne	CA4	19	46
Cc1cc(C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344385	HG	On-Demand	Anodyne	CA9	18	46
Cc1cc(C(=O)N2c3ccccc3C[C@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344392	HG	On-Demand	Anodyne	CA2	21	46
Cc1cc(C(=O)N2c3ccccc3C[C@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344392	HG	On-Demand	Anodyne	DRD4	25	45
Cc1cc(C(=O)N2c3ccccc3C[C@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344392	HG	On-Demand	Anodyne	CA7	16	46
Cc1cc(C(=O)N2c3ccccc3C[C@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344392	HG	On-Demand	Anodyne	CA4	19	46
Cc1cc(C(=O)N2c3ccccc3C[C@H]2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	ZINC000872344392	HG	On-Demand	Anodyne	CA9	18	46
COCCCNC(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872344394	DF	On-Demand	Reactive	GCGR	26	43
Oc1nccc2oc(C=NNCCN3CCCCC3)cc12	ZINC000872344409	CD	On-Demand	Mild	HNMT	52	36
O=C(NCC1CC1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344433	DD	On-Demand	Reactive	L3MBTL3	88	40
CC(CCOCc1ccccc1)=NNC(=O)c1ccc(C)cc1O	ZINC000872344489	EG	On-Demand	Reactive	PYK	49	35
CC(CCc1cccnc1)=NNC(=O)CC(F)(F)F	ZINC000872344520	CE	On-Demand	Reactive	TBXAS1	30	41
CCOc1ccc(S(=O)(=O)Nc2cc(C(N)=O)ccc2C)cc1C(C)C	ZINC000872344534	GG	On-Demand	Anodyne	PTGDR2	25	42
O=C(NNS(=O)(=O)CCC1CCCCC1)c1ccoc1	ZINC000872344595	DD	On-Demand	Reactive	BMP1	43	32
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC(F)(F)F	ZINC000872344613	DH	On-Demand	Reactive	TACR1	27	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC(F)(F)F	ZINC000872344613	DH	On-Demand	Reactive	MPO	42	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC(F)(F)F	ZINC000872344613	DH	On-Demand	Reactive	CCKBR	40	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC(F)(F)F	ZINC000872344613	DH	On-Demand	Reactive	GHSR	43	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC(F)(F)F	ZINC000872344613	DH	On-Demand	Reactive	MMP9	15	43
CC(CCc1cccnc1)=NNC(=O)NCC(F)(F)F	ZINC000872344619	CE	On-Demand	Reactive	TBXAS1	28	40
CC(CCc1cccnc1)=NNC(=O)NCC(F)(F)F	ZINC000872344619	CE	On-Demand	Reactive	NAMPT	27	42
O=C(CC(F)(F)F)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344624	EE	On-Demand	Reactive	MLYCD	20	45
O=C(CC(F)(F)F)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872344624	EE	On-Demand	Reactive	L3MBTL3	54	37
COc1ccc(Cn2cc(C=NNC(=O)NCC3CC3)nn2)cc1	ZINC000872344664	ED	On-Demand	Reactive	PROKR1	59	35
FC(F)(F)Cc1ccccc1C=NNCCN1CCCCC1	ZINC000872344701	DG	On-Demand	Mild	SLC6A1	31	46
COc1cc(C=NNCCN2CCCCC2)c(Cl)cc1O	ZINC000872344720	DE	On-Demand	Mild	SLC6A1	27	43
COc1cc(C=NNCCN2CCCCC2)c(Cl)cc1O	ZINC000872344720	DE	On-Demand	Mild	HTR4	31	44
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(OC(C)C)nc2)c(F)cc1F	ZINC000872344721	GF	On-Demand	Anodyne	GRM4	17	41
Fc1cccc2cc(C=NNCCN3CCCCC3)cnc12	ZINC000872344729	DF	On-Demand	Mild	SLC6A1	26	42
Fc1cccc2cc(C=NNCCN3CCCCC3)cnc12	ZINC000872344729	DF	On-Demand	Mild	HNMT	51	32
Brc1ncccc1C=NNCCN1CCCCC1	ZINC000872344732	DE	On-Demand	Mild	SLC6A1	29	44
Brc1ncccc1C=NNCCN1CCCCC1	ZINC000872344732	DE	On-Demand	Mild	HNMT	75	38
CC[C@@H](C)C(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872344735	DE	On-Demand	Reactive	PDE10A	27	45
COc1cncc(C=NNCCN2CCCCC2)c1C	ZINC000872344737	CD	On-Demand	Mild	SLC6A1	25	42
O=C(CC(F)(F)F)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872344763	EF	On-Demand	Reactive	SIGMAR1	23	40
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872344796	CF	On-Demand	Reactive	GCGR	26	44
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872344796	CF	On-Demand	Reactive	PDE10A	20	45
CC[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872344796	CF	On-Demand	Reactive	ADCYAP1R1	50	40
COc1cc(C=NNC(=O)NCC2CC2)c(Cl)cc1O	ZINC000872344848	CE	On-Demand	Reactive	GCGR	22	42
COc1cc(C=NNC(=O)NCC2CC2)c(Cl)cc1O	ZINC000872344848	CE	On-Demand	Reactive	ADCYAP1R1	41	35
CCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344856	ED	On-Demand	Reactive	HRH2	22	40
CCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344856	ED	On-Demand	Reactive	LTA4H	24	41
CCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344856	ED	On-Demand	Reactive	HRH3	18	42
CCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344856	ED	On-Demand	Reactive	FAAH	21	40
CCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344856	ED	On-Demand	Reactive	EPHX2	26	48
CNC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872344860	BD	On-Demand	Reactive	PPO2	35	42
COc1ccc(Cn2cc(C=NNC(=O)NCC(F)(F)F)nn2)cc1	ZINC000872344869	FD	On-Demand	Reactive	PROKR1	60	35
CCCCNC(=O)NN=Cc1ccc2nccnc2c1	ZINC000872344901	CE	On-Demand	Reactive	AMD1	15	46
O=C(c1ccc(C=NNCc2cc(F)ccc2F)cc1)N1CCCC1	ZINC000872344925	EG	On-Demand	Mild	DPP4	19	40
O=C(c1ccc(C=NNCc2cc(F)ccc2F)cc1)N1CCCC1	ZINC000872344925	EG	On-Demand	Mild	L3MBTL3	70	36
O=C(CC(F)(F)F)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344959	FD	On-Demand	Reactive	LTA4H	37	43
O=C(CC(F)(F)F)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872344959	FD	On-Demand	Reactive	EPHX2	23	49
CNC(=O)NN=C(C)CCc1cccnc1	ZINC000872344964	BD	On-Demand	Reactive	TBXAS1	41	45
CNC(=O)NN=C(C)CCc1cccnc1	ZINC000872344964	BD	On-Demand	Reactive	NAMPT	30	44
COc1cc(C=NNC(=O)CC(F)(F)F)c(Cl)cc1O	ZINC000872344965	DE	On-Demand	Reactive	GCGR	25	43
COc1cc(C=NNC(=O)CC(F)(F)F)c(Cl)cc1O	ZINC000872344965	DE	On-Demand	Reactive	ADCYAP1R1	74	38
COc1cc(C=NNC(=O)NCC(F)(F)F)c(Cl)cc1O	ZINC000872345016	EE	On-Demand	Reactive	GCGR	26	42
COc1cc(C=NNC(=O)NCC(F)(F)F)c(Cl)cc1O	ZINC000872345016	EE	On-Demand	Reactive	ADCYAP1R1	76	39
O=C(c1ccc(C=NNCc2ccc(F)c(F)c2)cc1)N1CCCC1	ZINC000872345023	EG	On-Demand	Mild	L3MBTL3	50	35
CCC(=NNC(=O)NCC(F)(F)F)c1cccc(OC)c1OC	ZINC000872345032	EF	On-Demand	Reactive	KCNK3	43	37
CC(CCc1cccnc1)=NNC(=O)NCC1CC1	ZINC000872345071	CE	On-Demand	Reactive	CHRNA7	44	36
COCCCNC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872345097	EE	On-Demand	Reactive	GCGR	17	41
COCCCNC(=O)NN=C(C)CCc1cccnc1	ZINC000872345102	CD	On-Demand	Reactive	TBXAS1	37	40
COCCCNC(=O)NN=C(C)CCc1cccnc1	ZINC000872345102	CD	On-Demand	Reactive	PTAFR	35	43
CCC(=NNC(=O)NCCCOC)c1cccc(OC)c1OC	ZINC000872345104	DE	On-Demand	Reactive	KCNK3	43	39
COCCCNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345107	DF	On-Demand	Reactive	TACR1	18	40
COCCCNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345107	DF	On-Demand	Reactive	CCKAR	55	39
COCCCNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345107	DF	On-Demand	Reactive	NMBR	26	43
COCCCNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345107	DF	On-Demand	Reactive	KISS1R	50	31
COCCCNC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872345117	DD	On-Demand	Reactive	GCGR	24	43
COCCCNC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872345117	DD	On-Demand	Reactive	ADCYAP1R1	48	36
CCCCNC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872345118	CE	On-Demand	Reactive	AMD1	17	51
CNC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872345176	CD	On-Demand	Reactive	DRD4	22	40
CNC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872345176	CD	On-Demand	Reactive	SIGMAR1	30	42
COc1ccc(Cn2cc(C=NN(C)C(=O)OC(C)(C)C)nn2)cc1	ZINC000872345181	EF	On-Demand	Reactive	PROKR1	54	32
CCC(CCC(F)(F)F)=NNC(=O)CCc1ccc(OC)cc1	ZINC000872345183	EH	On-Demand	Reactive	PPO2	36	44
CC(CCc1cccnc1)=NNS(=O)(=O)Cc1ccccc1	ZINC000872345186	DF	On-Demand	Mild	TBXAS1	65	45
CC(CCc1cccnc1)=NNS(=O)(=O)Cc1ccccc1	ZINC000872345186	DF	On-Demand	Mild	NAMPT	29	49
CCCCNC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872345201	EE	On-Demand	Reactive	PDE10A	18	42
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	ESR1	55	36
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	LTA4H	43	48
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	HRH3	24	43
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	EPHX2	28	50
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	FLT3	15	44
CNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345219	DC	On-Demand	Reactive	PSMB1	42	37
CCCCNC(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872345220	ED	On-Demand	Reactive	PROKR1	73	37
CCC(=NNC(=O)NC)c1cccc(OC)c1OC	ZINC000872345229	CD	On-Demand	Reactive	KCNK3	44	39
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	PGC	53	36
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	PAPA1_CARPA	64	48
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	CTSK	35	54
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	CTSL	28	48
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	TACR3	15	43
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	CAPNS1	51	32
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	REN	67	41
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	CAPN1	43	40
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	CAPN2	45	32
CNC(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345263	EE	On-Demand	Reactive	FPR1	59	43
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	PGC	53	36
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	PAPA1_CARPA	64	48
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	CTSK	35	54
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	CTSL	28	48
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	TACR3	15	43
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	CAPNS1	51	32
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	REN	67	41
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	CAPN1	43	40
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	CAPN2	45	32
CNC(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872345265	EE	On-Demand	Reactive	FPR1	59	43
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCC1	ZINC000872345378	FE	On-Demand	Reactive	EPHX2	19	43
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCC1	ZINC000872345378	FE	On-Demand	Reactive	LEF	23	42
COCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345430	FD	On-Demand	Reactive	LTA4H	23	40
COCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345430	FD	On-Demand	Reactive	HRH3	15	41
COCCCNC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345430	FD	On-Demand	Reactive	EPHX2	25	47
Cn1ncc(S(=O)(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1C(F)(F)F	ZINC000872345459	GG	On-Demand	Mild	SGK1	58	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)NCC(F)(F)F	ZINC000872345521	EG	On-Demand	Reactive	TACR1	20	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)NCC(F)(F)F	ZINC000872345521	EG	On-Demand	Reactive	NMBR	57	38
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)CC(F)(F)F)c1	ZINC000872345535	FG	On-Demand	Reactive	PDS	41	34
COc1ccc(C(=O)N2CCCC2)cc1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872345549	GF	On-Demand	Mild	HRH3	25	40
CCC(CCC(F)(F)F)=NNC(=O)c1nnc(-c2ccccc2)o1	ZINC000872345592	EH	On-Demand	Reactive	CES1	17	42
CNC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872345597	DD	On-Demand	Reactive	ADCYAP1R1	40	35
COCCCNC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872345636	ED	On-Demand	Reactive	PDE10A	21	41
COCCCNC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872345678	CD	On-Demand	Reactive	MTNR1A	44	38
COCCCNC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872345691	ED	On-Demand	Reactive	L3MBTL3	41	38
CCCCNC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872345706	DE	On-Demand	Reactive	L3MBTL3	50	38
CCOc1ccc(S(=O)(=O)Nc2c(C)noc2C)cc1C(C)C	ZINC000872345811	EH	On-Demand	Anodyne	EDNRA	16	42
O=C(NCc1ccco1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345851	FD	On-Demand	Reactive	LTA4H	28	44
O=C(NCc1ccco1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872345851	FD	On-Demand	Reactive	EPHX2	22	46
Cn1ncc(C(=O)OC(C)(C)C)c1C=NNC(=O)NCCc1cccs1	ZINC000872345862	GE	On-Demand	Reactive	GPR142	40	32
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	TACR1	23	43
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	MPO	43	40
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	NMBR	50	40
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	MMP2	18	40
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	GHSR	49	38
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	MMP9	17	46
CNC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872345877	CE	On-Demand	Reactive	MMP1	15	40
CCCCNC(=O)NN=C(C)CCc1cccnc1	ZINC000872345955	CE	On-Demand	Reactive	TBXAS1	40	42
CCCCNC(=O)NN=C(C)CCc1cccnc1	ZINC000872345955	CE	On-Demand	Reactive	PTAFR	33	42
CCCCNC(=O)NN=C(C)CCc1cccnc1	ZINC000872345955	CE	On-Demand	Reactive	NAMPT	27	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	HTR1D	19	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	TACR1	26	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	MPO	56	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	CCKBR	41	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	GHSR	46	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N(C)C	ZINC000872345981	CF	On-Demand	Reactive	MMP9	15	45
O=C(NN=C(CCc1ccccc1)c1ccccn1)N1CCOCC1	ZINC000872345989	EE	On-Demand	Reactive	FAAH	50	36
O=C(NN=C(CCc1ccccc1)c1ccccn1)N1CCOCC1	ZINC000872345989	EE	On-Demand	Reactive	CTSS	19	40
O=C(NN=C(CCc1ccccc1)c1ccccn1)N1CCOCC1	ZINC000872345989	EE	On-Demand	Reactive	CES1	49	34
O=C(NN=Cc1ccccc1CC(F)(F)F)N1CCOCC1	ZINC000872345991	DE	On-Demand	Reactive	ITGAL	58	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)NC1CCCC1	ZINC000872345996	EE	On-Demand	Reactive	EPHX2	41	49
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)NC1CCCC1	ZINC000872345996	EE	On-Demand	Reactive	L3MBTL3	90	42
CC(CCc1cccnc1)=NNC(=O)N(C)C	ZINC000872345998	BD	On-Demand	Reactive	TBXAS1	41	44
CC(CCc1cccnc1)=NNC(=O)N(C)C	ZINC000872345998	BD	On-Demand	Reactive	NAMPT	23	43
O=C(NN=Cc1nncn1Cc1ccccc1)N1CCOCC1	ZINC000872346003	DC	On-Demand	Reactive	CTSH	16	46
COc1ccc(Cn2cc(C=NNC(=O)NC3CCCC3)nn2)cc1	ZINC000872346019	ED	On-Demand	Reactive	PROKR1	55	33
C[C@@H]1Cc2ccccc2N1C(=O)CCCCCNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	ZINC000872346024	JH	On-Demand	Anodyne	DRD2	15	41
C[C@@H]1Cc2ccccc2N1C(=O)CCCCCNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	ZINC000872346024	JH	On-Demand	Anodyne	DRD4	29	41
O=C(NN=CC(F)(F)C(F)(F)F)NC1CCCC1	ZINC000872346044	CE	On-Demand	Reactive	EPHX2	16	40
O=C(NN=Cc1cccc(F)c1OC(F)(F)F)N1CCOCC1	ZINC000872346054	EE	On-Demand	Reactive	EPHX2	29	40
O=C(NCc1cccc(C(F)(F)F)c1)NN=Cc1cn(C[C@@H]2CCCO2)nn1	ZINC000872346061	GE	On-Demand	Reactive	CCR2	42	38
O=C(NCc1cccc(C(F)(F)F)c1)NN=Cc1cn(C[C@H]2CCCO2)nn1	ZINC000872346062	GE	On-Demand	Reactive	CCR2	42	38
CC(=O)Nc1cccc(C=NNC(=O)N2CCOCC2)c1	ZINC000872346074	CD	On-Demand	Reactive	EPHX2	20	42
COc1cc(C=NNC(=O)N2CCOCC2)c(Cl)cc1O	ZINC000872346111	DD	On-Demand	Reactive	GCGR	26	43
COc1cc(C=NNC(=O)N2CCOCC2)c(Cl)cc1O	ZINC000872346111	DD	On-Demand	Reactive	ADCYAP1R1	41	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCOCC1	ZINC000872346121	DF	On-Demand	Reactive	TACR1	27	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCOCC1	ZINC000872346121	DF	On-Demand	Reactive	GHSR	47	37
Cc1c(C=NNC(=O)NC(C)C)cccc1[N+](=O)[O-]	ZINC000872346132	CD	On-Demand	Reactive	COLA	58	33
CC(CCOCc1ccccc1)=NNC(=O)N(C)C	ZINC000872346143	CE	On-Demand	Reactive	PPO2	34	41
CC(CCc1cccnc1)=NNC(=O)N1CCOCC1	ZINC000872346149	CD	On-Demand	Reactive	CHRNA7	42	35
CC(CCc1cccnc1)=NNC(=O)N1CCOCC1	ZINC000872346149	CD	On-Demand	Reactive	C3AR1	39	40
CC(CCc1cccnc1)=NNC(=O)N1CCOCC1	ZINC000872346149	CD	On-Demand	Reactive	NAMPT	31	40
O=C(NCc1cccc(C(F)(F)F)c1)NN=Cc1cn(C2CC2)cn1	ZINC000872346164	FG	On-Demand	Reactive	CCR2	82	36
O=C(NN=Cc1nncn1Cc1ccccc1)NC1CCCC1	ZINC000872346178	DD	On-Demand	Reactive	EPHX2	15	42
COC(=O)c1ccoc1S(=O)(=O)Nc1cc(F)cc(N2CCOCC2)c1	ZINC000872346209	GD	On-Demand	Anodyne	EPHB4	71	36
CN(C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872346226	CD	On-Demand	Reactive	L3MBTL3	69	41
O=C(NCc1cccc(C(F)(F)F)c1)NN=CC1CC2(C1)OCCO2	ZINC000872346236	FF	On-Demand	Reactive	CCR2	40	38
CN1CCC(C=NNC(=O)NC2CCCC2)CC1	ZINC000872346251	CD	On-Demand	Reactive	EPHX2	15	43
CN(C)C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872346264	DE	On-Demand	Reactive	ADCYAP1R1	40	34
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	PGC	52	35
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	PAPA1_CARPA	59	50
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	CTSK	35	56
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	CTSL	26	50
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	TACR3	15	42
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	CAPNS1	51	32
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	REN	67	42
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	CAPN1	57	39
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	CAPN2	55	32
CN(C)C(=O)NN=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346280	EF	On-Demand	Reactive	FPR1	54	42
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	PGC	52	35
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	PAPA1_CARPA	59	50
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	CTSK	35	56
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	CTSL	26	50
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	TACR3	15	42
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	CAPNS1	51	32
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	REN	67	42
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	CAPN1	57	39
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	CAPN2	55	32
CN(C)C(=O)NN=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872346281	EF	On-Demand	Reactive	FPR1	54	42
CCNc1ccccc1C=NNC(=O)N1CCOCC1	ZINC000872346300	CD	On-Demand	Reactive	CTSH	15	43
CC(CCc1cccnc1)=NNC(=O)NC1CCCC1	ZINC000872346301	CF	On-Demand	Reactive	FKBP1A	15	43
CC(CCc1cccnc1)=NNC(=O)NC1CCCC1	ZINC000872346301	CF	On-Demand	Reactive	TBXAS1	28	40
CC(CCc1cccnc1)=NNC(=O)NC1CCCC1	ZINC000872346301	CF	On-Demand	Reactive	CHRNA7	46	38
CC(CCc1cccnc1)=NNC(=O)NC1CCCC1	ZINC000872346301	CF	On-Demand	Reactive	C3AR1	52	51
CC(CCc1cccnc1)=NNC(=O)NC1CCCC1	ZINC000872346301	CF	On-Demand	Reactive	EPHX2	16	43
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)N1CCOCC1	ZINC000872346303	ED	On-Demand	Reactive	SIGMAR1	30	41
O=C(NCc1cccc(C(F)(F)F)c1)NN=CCCCCCO	ZINC000872346310	EG	On-Demand	Reactive	CCR2	43	36
CN1CCC(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)CC1	ZINC000872346312	EF	On-Demand	Reactive	CACNA1B	52	33
CN1CCC(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)CC1	ZINC000872346312	EF	On-Demand	Reactive	CCR2	118	40
CN1CCC(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)CC1	ZINC000872346312	EF	On-Demand	Reactive	PDS	40	38
CC(CCOCc1ccccc1)=NNC(=O)N1CCOCC1	ZINC000872346314	DE	On-Demand	Reactive	CTSS	23	46
CC(CCOCc1ccccc1)=NNC(=O)N1CCOCC1	ZINC000872346314	DE	On-Demand	Reactive	CTSH	16	46
COc1cc(C=NNC(=O)N(C)C)c(Cl)cc1O	ZINC000872346325	CD	On-Demand	Reactive	GCGR	22	46
COc1cc(C=NNC(=O)N(C)C)c(Cl)cc1O	ZINC000872346325	CD	On-Demand	Reactive	ADCYAP1R1	43	36
CNc1ccccc1C=NNC(=O)NC1CCCC1	ZINC000872346328	CE	On-Demand	Reactive	EPHX2	18	43
COc1ccc(Cn2cc(C=NNC(=O)NC(C)C)nn2)cc1	ZINC000872346339	DD	On-Demand	Reactive	PROKR1	58	35
COCCc1ncc(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	ZINC000872346340	GG	On-Demand	Reactive	CCR2	43	35
COCCc1ncc(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	ZINC000872346340	GG	On-Demand	Reactive	SCD1	27	41
COCCc1ncc(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	ZINC000872346340	GG	On-Demand	Reactive	ADCYAP1R1	47	39
COCCc1ncc(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	ZINC000872346340	GG	On-Demand	Reactive	SCD	37	41
COCCc1ncc(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	ZINC000872346340	GG	On-Demand	Reactive	PDS	42	39
O=C(NN=Cc1cnc2c(F)cccc2c1)N1CCOCC1	ZINC000872346351	DD	On-Demand	Reactive	STAT6	47	36
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	ESR1	69	37
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	ESR2	46	37
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	LTA4H	48	45
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	HRH3	21	43
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	EPHX2	21	47
CN(C)C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872346373	DD	On-Demand	Reactive	PSMB1	41	35
CN(C)C(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872346389	DE	On-Demand	Reactive	SIGMAR1	27	41
CCC(=NNC(=O)c1ccoc1)c1cccc(OC)c1OC	ZINC000872346393	DF	On-Demand	Reactive	ITGAV	17	41
CCC(=NNC(=O)c1ccoc1)c1cccc(OC)c1OC	ZINC000872346393	DF	On-Demand	Reactive	KCNK3	43	37
CC[C@H](O)CN(c1ccccc1)S(=O)(=O)N=[S@@](C)(=O)c1ccccc1	ZINC000872346403	GF	On-Demand	Anodyne	NR1I2	18	40
CC[C@@H](O)CN(c1ccccc1)S(=O)(=O)N=[S@@](C)(=O)c1ccccc1	ZINC000872346404	GF	On-Demand	Anodyne	NR1I2	18	40
CC[C@H](O)CN(c1ccccc1)S(=O)(=O)N=[S@](C)(=O)c1ccccc1	ZINC000872346405	GF	On-Demand	Anodyne	NR1I2	18	40
CC[C@@H](O)CN(c1ccccc1)S(=O)(=O)N=[S@](C)(=O)c1ccccc1	ZINC000872346406	GF	On-Demand	Anodyne	NR1I2	18	40
COc1cc(C=NNC(=O)NC(C)C)c(Cl)cc1O	ZINC000872346438	CE	On-Demand	Reactive	GCGR	21	44
COc1cc(C=NNC(=O)NC(C)C)c(Cl)cc1O	ZINC000872346438	CE	On-Demand	Reactive	ADCYAP1R1	43	39
O=C(CCOc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872346447	FF	On-Demand	Reactive	ADCYAP1R1	30	40
O=C(CCOc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872346447	FF	On-Demand	Reactive	L3MBTL3	46	36
O=C(c1ccc(C=NNC(=S)NCC(F)(F)F)cc1)N1CCCC1	ZINC000872346496	FE	On-Demand	Mild	MLYCD	19	42
O=C(c1ccc(C=NNC(=S)NCC(F)(F)F)cc1)N1CCCC1	ZINC000872346496	FE	On-Demand	Mild	L3MBTL3	42	35
COc1ccc(Cn2cc(C=NNC(=O)N3CCOCC3)nn2)cc1	ZINC000872346515	EC	On-Demand	Reactive	PROKR1	56	35
CC(=O)Nc1cccc(C=NNC(=O)NC2CCCC2)c1	ZINC000872346519	CE	On-Demand	Reactive	EPHX2	35	49
COc1cc(C=NNC(=O)N(C)C)c(F)cc1Br	ZINC000872346521	DE	On-Demand	Reactive	PDE10A	15	40
O=C(NCc1cccc(C(F)(F)F)c1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872346532	EH	On-Demand	Reactive	CCR2	69	42
O=C(NCc1cccc(C(F)(F)F)c1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872346533	EH	On-Demand	Reactive	CCR2	69	42
O=C(NN=Cc1ccc(F)c2ccccc12)N1CCOCC1	ZINC000872346571	DE	On-Demand	Reactive	GCGR	22	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	ESR1	88	39
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	ESR2	57	39
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	LTA4H	44	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	HRH3	23	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	EPHX2	23	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	FLT3	15	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)N1CCOCC1	ZINC000872346584	FC	On-Demand	Reactive	PSMB1	41	36
CN(C)C(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872346585	CE	On-Demand	Reactive	UREA_CANEN	17	46
COc1cc2c(cc1OC)C(=NNC(=O)N1CCOCC1)CCCC2	ZINC000872346592	EE	On-Demand	Reactive	PDE3A	17	44
CCC(=NNC(=O)N(C)C)c1cccc(OC)c1OC	ZINC000872346593	CE	On-Demand	Reactive	KCNK3	43	38
CC(CCc1cccnc1)=NNC(=O)NC(C)C	ZINC000872346603	BE	On-Demand	Reactive	TBXAS1	36	42
CC(CCc1cccnc1)=NNC(=O)NC(C)C	ZINC000872346603	BE	On-Demand	Reactive	PTAFR	30	40
CC(CCc1cccnc1)=NNC(=O)NC(C)C	ZINC000872346603	BE	On-Demand	Reactive	PPO2	31	41
CC(CCc1cccnc1)=NNC(=O)NC(C)C	ZINC000872346603	BE	On-Demand	Reactive	NAMPT	25	41
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)N1CCOCC1	ZINC000872346636	ED	On-Demand	Reactive	L3MBTL3	58	37
COc1nscc1C=NNC(=O)N1CCOCC1	ZINC000872346638	CC	On-Demand	Reactive	LIPA	43	37
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(C#N)cc1	ZINC000872346707	CG	On-Demand	Reactive	CTRB_BOVIN	47	37
O=C(CCOc1ccccc1)NN=CCCCCCO	ZINC000872346733	CE	On-Demand	Reactive	LTA4H	26	40
O=C(CCOc1ccccc1)NN=CCCCCCO	ZINC000872346733	CE	On-Demand	Reactive	PLA2G4B	44	33
N#Cc1ccc(C(=O)NN=CCCOCC(F)F)cc1	ZINC000872346756	CD	On-Demand	Reactive	CTRB_BOVIN	44	33
N#Cc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872346791	GE	On-Demand	Reactive	LTA4H	25	41
N#Cc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872346791	GE	On-Demand	Reactive	EPHX2	22	43
N#Cc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872346791	GE	On-Demand	Reactive	FLT3	15	42
N#Cc1ccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872346791	GE	On-Demand	Reactive	PSMB1	41	36
CC(CCOCc1ccccc1)=NNC(=S)NCC(F)(F)F	ZINC000872346809	EF	On-Demand	Mild	PPO2	37	42
O=C(CCOc1ccccc1)NN=C1CCCc2ncccc21	ZINC000872346812	DF	On-Demand	Reactive	ABAT	15	48
COC(=O)c1ccc(C=NNC(=O)C(=O)N2CCCC2)cc1Br	ZINC000872346864	GD	On-Demand	Reactive	PDE10A	15	41
COc1cc(C=NNC(=O)C(=O)N2CCCC2)c(Cl)cc1O	ZINC000872346873	ED	On-Demand	Reactive	GCGR	20	42
COc1cc(C=NNC(=O)C(=O)N2CCCC2)c(Cl)cc1O	ZINC000872346873	ED	On-Demand	Reactive	ADCYAP1R1	41	35
O=C(CCc1ccccc1)NN=C1CCCc2ncccc21	ZINC000872346877	CF	On-Demand	Reactive	ABAT	15	50
O=C(CCc1ccccc1)NN=CCCCCCO	ZINC000872346904	CE	On-Demand	Reactive	HDAC8	18	42
O=C(CCc1ccccc1)NN=CCCCCCO	ZINC000872346904	CE	On-Demand	Reactive	HDAC2	15	40
CC(CCOCc1ccccc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872346919	DD	On-Demand	Reactive	SLC12A5	60	33
CC(CCc1cccnc1)=NNC(=O)CC1CCCC1	ZINC000872346922	CG	On-Demand	Reactive	TBXAS1	24	40
CC(CCc1cccnc1)=NNC(=O)CC1CCCC1	ZINC000872346922	CG	On-Demand	Reactive	CHRNA7	41	34
CC(CCc1cccnc1)=NNC(=O)CC1CCCC1	ZINC000872346922	CG	On-Demand	Reactive	C3AR1	41	43
CC(CCc1cccnc1)=NNC(=O)CC1CCCC1	ZINC000872346922	CG	On-Demand	Reactive	NAMPT	24	41
CN1CCC(C=NNC(=O)CCOc2ccccc2)CC1	ZINC000872346941	CD	On-Demand	Reactive	LTA4H	49	39
CN1CCC(C=NNC(=O)c2ccc(C#N)cc2)CC1	ZINC000872346965	CD	On-Demand	Reactive	HTR1F	39	45
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)N1CCCC1	ZINC000872346995	FD	On-Demand	Reactive	SIGMAR1	32	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	HTR1D	31	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	HTR1B	24	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	EDNRA	21	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	MPO	18	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	MC3R	28	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	MC5R	58	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	GHSR	51	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(=O)N1CCCC1	ZINC000872347020	EE	On-Demand	Reactive	MC1R	42	42
COc1cc(C=NNC(=O)CC2CCCC2)c(Cl)cc1O	ZINC000872347023	DG	On-Demand	Reactive	GCGR	24	41
COc1cc(C=NNC(=O)CC2CCCC2)c(Cl)cc1O	ZINC000872347023	DG	On-Demand	Reactive	ADCYAP1R1	42	34
COc1ccc(Cn2cc(C=NNC(=O)CC3CCCC3)nn2)cc1	ZINC000872347070	EE	On-Demand	Reactive	PROKR1	55	33
FC(F)(F)CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872347077	GD	On-Demand	Mild	LTA4H	27	42
FC(F)(F)CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872347077	GD	On-Demand	Mild	EPHX2	15	44
CN(C)C(=O)NN=C1CCCCc2ccccc2C1	ZINC000872347105	CF	On-Demand	Reactive	ABAT	16	49
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1	ZINC000872347142	CG	On-Demand	Reactive	TBXAS1	64	47
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1	ZINC000872347142	CG	On-Demand	Reactive	PTAFR	29	42
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1	ZINC000872347142	CG	On-Demand	Reactive	KCNA5	15	44
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1	ZINC000872347142	CG	On-Demand	Reactive	PPO2	37	43
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1	ZINC000872347142	CG	On-Demand	Reactive	NAMPT	31	54
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1Cc2ccccc2O1	ZINC000872347155	FE	On-Demand	Reactive	L3MBTL3	48	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1Cc2ccccc2O1	ZINC000872347156	FE	On-Demand	Reactive	L3MBTL3	48	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	ESR1	74	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	ESR2	52	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	LTA4H	44	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	HRH3	28	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	EPHX2	19	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	PSMB2	40	38
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)N1CCCC1	ZINC000872347189	FC	On-Demand	Reactive	PSMB1	44	38
O=C(CCc1ccco1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872347242	FE	On-Demand	Reactive	LTA4H	26	44
O=C(CCc1ccco1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872347242	FE	On-Demand	Reactive	EPHX2	15	43
CC(CCc1cccnc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872347247	CD	On-Demand	Reactive	FKBP1A	15	40
CC(CCc1cccnc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872347247	CD	On-Demand	Reactive	TBXAS1	27	42
CC(CCc1cccnc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872347247	CD	On-Demand	Reactive	CHRNA7	41	36
CC(CCc1cccnc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872347247	CD	On-Demand	Reactive	C3AR1	43	45
CC(CCc1cccnc1)=NNC(=O)C(=O)N1CCCC1	ZINC000872347247	CD	On-Demand	Reactive	NAMPT	30	43
CC(CCc1cccnc1)=NNC(=O)CCOc1ccccc1	ZINC000872347261	DF	On-Demand	Reactive	LTA4H	27	44
CC(CCc1cccnc1)=NNC(=O)CCOc1ccccc1	ZINC000872347261	DF	On-Demand	Reactive	TBXAS1	44	42
CC(CCc1cccnc1)=NNC(=O)CCOc1ccccc1	ZINC000872347261	DF	On-Demand	Reactive	FAAH	24	41
CC(CCc1cccnc1)=NNC(=O)CCOc1ccccc1	ZINC000872347261	DF	On-Demand	Reactive	PPO2	44	50
COc1ccc(Cn2cc(C=NNC(=O)N(C)C)nn2)cc1	ZINC000872347313	DC	On-Demand	Reactive	PROKR1	65	36
COc1ccc(Cn2cc(C=NNC(=S)NCC(F)(F)F)nn2)cc1	ZINC000872347321	FD	On-Demand	Mild	PROKR1	56	33
N#Cc1ccc(C(=O)NN=CCCCC2CC2)cc1	ZINC000872347331	CF	On-Demand	Reactive	CTRB_BOVIN	45	34
CN1CCC(C=NNC(=O)c2ccoc2)CC1	ZINC000872347341	BD	On-Demand	Reactive	HTR1F	37	43
CN1CCC(C=NNC(=O)CCc2ccccc2)CC1	ZINC000872347353	CE	On-Demand	Reactive	SIGMAR1	24	42
CN1CCC(C=NNC(=O)CCc2ccccc2)CC1	ZINC000872347353	CE	On-Demand	Reactive	CYP2J2	44	33
COc1ccc(Cn2cc(C=NNS(=O)(=O)C(C)C)nn2)cc1	ZINC000872347356	EC	On-Demand	Mild	PROKR1	63	34
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2ccoc2)c1	ZINC000872347441	EG	On-Demand	Reactive	ADCYAP1R1	64	38
O=C(NN=C(CCc1ccccc1)c1ccccn1)C(=O)N1CCCC1	ZINC000872347447	FE	On-Demand	Reactive	PREP	32	40
Cc1nocc1S(=O)(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000872347450	FD	On-Demand	Anodyne	CYP11B2	27	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1Cc2ccccc2O1	ZINC000872347454	GD	On-Demand	Reactive	ESR1	59	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1Cc2ccccc2O1	ZINC000872347454	GD	On-Demand	Reactive	LTA4H	29	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1Cc2ccccc2O1	ZINC000872347454	GD	On-Demand	Reactive	EPHX2	15	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1Cc2ccccc2O1	ZINC000872347455	GD	On-Demand	Reactive	ESR1	59	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1Cc2ccccc2O1	ZINC000872347455	GD	On-Demand	Reactive	LTA4H	29	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1Cc2ccccc2O1	ZINC000872347455	GD	On-Demand	Reactive	EPHX2	15	44
CCOc1ccc(S(=O)(=O)Nc2cnoc2)cc1C(C)C	ZINC000872347460	DF	On-Demand	Anodyne	MGAT1	44	31
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)CCc1ccccc1	ZINC000872347494	FE	On-Demand	Reactive	FAS	19	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCCc2ccc(S(C)(=O)=O)cc21	ZINC000872347503	GE	On-Demand	Mild	CYP11B2	20	41
O=C(CC1CCCC1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872347504	EF	On-Demand	Reactive	L3MBTL3	88	41
CC(CCc1c[nH]c2ccccc12)=NNS(=O)(=O)C(C)C	ZINC000872347584	DF	On-Demand	Mild	BRS3	25	40
CC(CCc1c[nH]c2ccccc12)=NNS(=O)(=O)C(C)C	ZINC000872347584	DF	On-Demand	Mild	MC5R	43	35
CC(CCc1c[nH]c2ccccc12)=NNS(=O)(=O)C(C)C	ZINC000872347584	DF	On-Demand	Mild	ALOX15	16	44
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCCC1	ZINC000872347592	EC	On-Demand	Reactive	MLYCD	18	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCCC1	ZINC000872347592	EC	On-Demand	Reactive	L3MBTL3	70	40
COc1ccc(Cn2cc(C=NNC(=O)CN(C)C)nn2)cc1	ZINC000872347609	DC	On-Demand	Reactive	PROKR1	58	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN(C)C	ZINC000872347625	CE	On-Demand	Reactive	HTR1D	20	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN(C)C	ZINC000872347625	CE	On-Demand	Reactive	TACR1	23	47
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN(C)C	ZINC000872347625	CE	On-Demand	Reactive	MC5R	44	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CN(C)C	ZINC000872347625	CE	On-Demand	Reactive	GHSR	41	38
CC(CCc1cccnc1)=NNC(=O)CCC(C)C	ZINC000872347653	CF	On-Demand	Reactive	TBXAS1	40	42
CC(CCc1cccnc1)=NNC(=O)CCC(C)C	ZINC000872347653	CF	On-Demand	Reactive	PTAFR	32	40
CC(CCc1cccnc1)=NNC(=O)CCC(C)C	ZINC000872347653	CF	On-Demand	Reactive	PPO2	32	41
CC(CCc1cccnc1)=NNC(=O)CCC(C)C	ZINC000872347653	CF	On-Demand	Reactive	NAMPT	18	44
O=C(c1ccc(C=NNC(=S)NCC2CCC2)cc1)N1CCCC1	ZINC000872347704	EF	On-Demand	Mild	L3MBTL3	77	38
CC(CCc1cccnc1)=NNC(=O)CN(C)C	ZINC000872347708	BD	On-Demand	Reactive	TBXAS1	36	45
CC(CCc1cccnc1)=NNC(=O)CN(C)C	ZINC000872347708	BD	On-Demand	Reactive	NAMPT	16	44
CN1CCC(C=NNC(=O)c2cccc3cccnc23)CC1	ZINC000872347741	CE	On-Demand	Reactive	HTR1F	72	39
CN1CCC(C=NNC(=O)c2cccc3cccnc23)CC1	ZINC000872347741	CE	On-Demand	Reactive	HCRTR1	15	42
O=C(CCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872347757	EG	On-Demand	Reactive	PREP	32	42
O=C(CCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872347757	EG	On-Demand	Reactive	L3MBTL3	55	36
O=C(NN=C1CCCCc2ccccc2C1)C(=O)N1CCCC1	ZINC000872347792	DE	On-Demand	Reactive	ABAT	15	47
CC(CCc1cccnc1)=NNS(=O)(=O)C(C)C	ZINC000872347813	CD	On-Demand	Mild	TBXAS1	54	44
CC(CCc1cccnc1)=NNS(=O)(=O)C(C)C	ZINC000872347813	CD	On-Demand	Mild	NAMPT	25	45
CC(CCOCc1ccccc1)=NNS(=O)(=O)C(C)C	ZINC000872347819	CE	On-Demand	Mild	CAPN2	46	33
Cc1c(C=NNC(=O)CCC(C)C)cccc1[N+](=O)[O-]	ZINC000872347864	CF	On-Demand	Reactive	COLA	84	33
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccoc1	ZINC000872347884	ED	On-Demand	Reactive	LTA4H	30	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccoc1	ZINC000872347884	ED	On-Demand	Reactive	EPHX2	20	44
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccoc1	ZINC000872347884	ED	On-Demand	Reactive	PSMB1	40	35
COc1ccc(Cn2cc(C=NNC(=S)NCC3CCC3)nn2)cc1	ZINC000872347937	FD	On-Demand	Mild	PROKR1	54	32
COCCc1ncc(C=NNC(=S)Nc2ccc(OC)c(F)c2)s1	ZINC000872347958	FF	On-Demand	Mild	MET	50	43
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	ESR1	86	39
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	ESR2	58	39
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	LTA4H	54	48
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	HRH3	38	44
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	EPHX2	15	51
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	PSMB2	40	39
C(=NNC1CCCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872347969	DE	On-Demand	Mild	PSMB1	44	39
C(=NNC1CCCC1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872347991	CD	On-Demand	Mild	PDE8B	41	32
C(=NNC1CCCC1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872347992	CD	On-Demand	Mild	PDE8B	41	32
COc1cc(C=NNC(=O)CN(C)C)c(Cl)cc1O	ZINC000872348013	CD	On-Demand	Reactive	GCGR	25	44
COc1cc(C=NNC(=O)CN(C)C)c(Cl)cc1O	ZINC000872348013	CD	On-Demand	Reactive	ADCYAP1R1	48	36
CC(CCc1cccnc1)=NNC1CCCC1	ZINC000872348030	BF	On-Demand	Mild	C3AR1	42	45
COc1ccc(Cn2cc(C=NNC(=O)CCC(C)C)nn2)cc1	ZINC000872348055	EE	On-Demand	Reactive	PROKR1	57	34
COc1ccc(Cn2cc(C=NNC3CCCC3)nn2)cc1	ZINC000872348079	CE	On-Demand	Mild	PROKR1	54	32
COc1cc(C=NNC(=O)CCC(C)C)c(Cl)cc1O	ZINC000872348100	CF	On-Demand	Reactive	GCGR	23	43
COc1cc(C=NNC(=O)CCC(C)C)c(Cl)cc1O	ZINC000872348100	CF	On-Demand	Reactive	ADCYAP1R1	49	39
COCCc1ncc(C=NNc2ccc(C#N)c(C(F)(F)F)c2)s1	ZINC000872348150	FH	On-Demand	Mild	AR	46	38
CC(=O)Nc1cccc(C=NNC(=O)CCC(C)C)c1	ZINC000872348155	CF	On-Demand	Reactive	ABAT	26	48
O=S(=O)(Nc1ccccc1)c1ccc(NN=CCCCCCO)cc1	ZINC000872348188	FG	On-Demand	Mild	CA4	15	43
O=S(=O)(Nc1ccccc1)c1ccc(NN=CCCCCCO)cc1	ZINC000872348188	FG	On-Demand	Mild	LIMK2	37	45
C=CCC1(C=NNc2ccc(C#N)c(C(F)(F)F)c2)CCOCC1	ZINC000872348217	EI	On-Demand	Mild	AR	41	37
N#Cc1ccc(NN=Cc2cn(C3CC3)cn2)cc1C(F)(F)F	ZINC000872348220	DH	On-Demand	Mild	AR	45	43
CN1CCC(C=NNc2nc(-c3ccccc3)no2)CC1	ZINC000872348243	CE	On-Demand	Mild	GRM7	51	32
O=C(c1ccc(C=NNC2CCCC2)cc1)N1CCCC1	ZINC000872348263	CF	On-Demand	Mild	MLYCD	17	40
O=C(c1ccc(C=NNC2CCCC2)cc1)N1CCCC1	ZINC000872348263	CF	On-Demand	Mild	L3MBTL3	97	46
Cc1c(C=NNC(=O)CN(C)C)cccc1[N+](=O)[O-]	ZINC000872348345	CC	On-Demand	Reactive	COLA	50	31
O=C(CCC1CCCCC1)NN=Cc1cccnc1Br	ZINC000872348370	EH	On-Demand	Reactive	BMP1	45	38
N#Cc1ccc(NN=CCCOCC(F)F)cc1C(F)(F)F	ZINC000872348372	DH	On-Demand	Mild	AR	41	39
CN1CCC(C=NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)CC1	ZINC000872348419	FG	On-Demand	Mild	LIMK2	31	43
O=C(c1ccc(C=NNCc2ccc(F)cc2F)cc1)N1CCCC1	ZINC000872348436	EG	On-Demand	Mild	L3MBTL3	42	33
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872348438	FG	On-Demand	Mild	ADRB3	46	36
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000872348438	FG	On-Demand	Mild	NAMPT	54	49
N#Cc1ccc(NN=CC2CC3(C2)OCCO3)cc1C(F)(F)F	ZINC000872348453	EG	On-Demand	Mild	AR	49	39
C(CCCC1CC1)=NNc1nc(-c2ccncc2)no1	ZINC000872348479	CG	On-Demand	Mild	BMP1	21	45
CCOC(=O)/C=C/c1ccc(C=NNC(=O)CCC(C)C)n1C	ZINC000872348489	DE	On-Demand	Reactive	PSMB2	41	31
CC(CCOCc1ccccc1)=NNC(=O)CN(C)C	ZINC000872348520	CD	On-Demand	Reactive	PPO2	33	40
N#Cc1ccc(NN=C[C@@H]2CCC(F)(F)C2)cc1C(F)(F)F	ZINC000872348543	DI	On-Demand	Mild	AR	44	42
N#Cc1ccc(NN=C[C@H]2CCC(F)(F)C2)cc1C(F)(F)F	ZINC000872348544	DI	On-Demand	Mild	AR	44	42
CN1CCC(C=NNC(=O)CNC(=O)c2cccs2)CC1	ZINC000872348572	DC	On-Demand	Reactive	HTR1F	18	43
CN1CCC(C=NNc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000872348573	DG	On-Demand	Mild	AR	57	43
N#Cc1ccc(NN=CCCCCCO)cc1C(F)(F)F	ZINC000872348632	CH	On-Demand	Mild	AR	45	41
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000872348799	FF	On-Demand	Mild	ADRB3	61	38
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000872348799	FF	On-Demand	Mild	TBXAS1	44	40
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000872348799	FF	On-Demand	Mild	NAMPT	60	56
N#Cc1ccc(NN=C2CCCC3(C2)OCCO3)cc1C(F)(F)F	ZINC000872348835	EH	On-Demand	Mild	AR	40	38
CCC(=NNC(=O)CNC(=O)c1cccs1)c1cccc(OC)c1OC	ZINC000872348846	GE	On-Demand	Reactive	KCNK3	41	34
CCC(=NNC(=O)Cc1cccnc1)c1cccc(OC)c1OC	ZINC000872349012	EF	On-Demand	Reactive	PTAFR	23	40
Cn1nc2c(c1S(=O)(=O)Nc1ccc(OCc3cccnc3)cc1)CCCC2	ZINC000872349032	GG	On-Demand	Anodyne	ADRB3	50	38
CC(CCc1cccnc1)=NNC(=O)Cc1cccnc1	ZINC000872349038	CE	On-Demand	Reactive	TBXAS1	45	46
CC(CCc1cccnc1)=NNC(=O)Cc1cccnc1	ZINC000872349038	CE	On-Demand	Reactive	PPO2	38	42
CC(CCc1cccnc1)=NNC(=O)Cc1cccnc1	ZINC000872349038	CE	On-Demand	Reactive	NAMPT	30	47
COc1cncc(C=NNCCCOc2ccccc2)c1C	ZINC000872349043	CF	On-Demand	Mild	DRD4	15	40
COc1ccc(Cn2cc(C=NNCCCc3ccccc3)nn2)cc1	ZINC000872349053	EF	On-Demand	Mild	PROKR1	57	39
O=C(NN=Cc1cn(C[C@H]2CCOC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000872349062	FE	On-Demand	Reactive	CCR2	61	37
O=C(NN=Cc1cn(C[C@H]2CCOC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000872349062	FE	On-Demand	Reactive	ADCYAP1R1	43	36
O=C(NN=Cc1cn(C[C@@H]2CCOC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000872349063	FE	On-Demand	Reactive	CCR2	61	37
O=C(NN=Cc1cn(C[C@@H]2CCOC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000872349063	FE	On-Demand	Reactive	ADCYAP1R1	43	36
O=C(Cc1ccccn1)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872349086	EF	On-Demand	Reactive	SIGMAR1	16	41
O=C(Cc1cccnc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872349090	BD	On-Demand	Reactive	CHRNA7	43	35
CN1CCC(C=NNC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872349096	DF	On-Demand	Reactive	LCK	27	43
CN1CCC(C=NNC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872349096	DF	On-Demand	Reactive	CACNA1B	57	38
CN1CCC(C=NNC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872349096	DF	On-Demand	Reactive	CCR2	100	42
CN1CCC(C=NNC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872349096	DF	On-Demand	Reactive	LYN	23	43
CN1CCC(C=NNC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872349096	DF	On-Demand	Reactive	ADCYAP1R1	51	38
F[C@@H]1CCCC1=NNCCCOc1ccccc1	ZINC000872349112	CF	On-Demand	Mild	DRD4	17	41
F[C@H]1CCCC1=NNCCCOc1ccccc1	ZINC000872349113	CF	On-Demand	Mild	DRD4	17	41
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1C(F)(F)F	ZINC000872349114	GF	On-Demand	Anodyne	PKM	50	49
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1C(F)(F)F	ZINC000872349114	GF	On-Demand	Anodyne	PTK2B	19	44
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)Cc2cccnc2)c1	ZINC000872349117	FF	On-Demand	Reactive	NAMPT	40	38
CCC(=NNC(=O)c1scnc1C)c1cccc(OC)c1OC	ZINC000872349125	EG	On-Demand	Reactive	KCNK3	42	37
O=C(NN=CCCCCCO)c1ccc(Br)cc1Cl	ZINC000872349128	EG	On-Demand	Reactive	PYK	45	38
CN1CCC(C=NNCCCc2ccccc2)CC1	ZINC000872349139	CF	On-Demand	Mild	SLC18A2	33	41
CN1CCC(C=NNCCCc2ccccc2)CC1	ZINC000872349139	CF	On-Demand	Mild	SIGMAR1	36	44
CN1CCC(C=NNC(=O)Cc2cccnc2)CC1	ZINC000872349158	CD	On-Demand	Reactive	CHRNA7	54	39
CN1CCC(C=NNC(=O)Cc2cccnc2)CC1	ZINC000872349158	CD	On-Demand	Reactive	NAMPT	56	38
Cc1ncsc1C(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872349161	FG	On-Demand	Reactive	ADCYAP1R1	41	35
Cn1nc2c(c1C=NNC(=O)Cc1cccnc1)CCCC2	ZINC000872349168	CD	On-Demand	Reactive	NAMPT	42	36
CC(CCc1cccnc1)=NNCCCOc1ccccc1	ZINC000872349189	CG	On-Demand	Mild	LTA4H	17	41
CC(CCc1cccnc1)=NNCCCOc1ccccc1	ZINC000872349189	CG	On-Demand	Mild	TBXAS1	43	40
CC(CCc1cccnc1)=NNCCCOc1ccccc1	ZINC000872349189	CG	On-Demand	Mild	PPO2	38	49
O=C(Cc1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349190	FD	On-Demand	Reactive	LTA4H	50	48
O=C(Cc1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349190	FD	On-Demand	Reactive	CHRNA7	32	44
O=C(Cc1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349190	FD	On-Demand	Reactive	EPHX2	16	50
O=C(Cc1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349190	FD	On-Demand	Reactive	FLT3	15	45
O=C(Cc1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349190	FD	On-Demand	Reactive	NAMPT	15	40
F[C@@H]1CCCC1=NNCCCc1ccccc1	ZINC000872349195	BG	On-Demand	Mild	SLC18A2	41	37
F[C@H]1CCCC1=NNCCCc1ccccc1	ZINC000872349196	BG	On-Demand	Mild	SLC18A2	41	37
Cn1ncc(C(=O)OC(C)(C)C)c1C=NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000872349229	GG	On-Demand	Reactive	BRAF	21	40
Cn1ncc(C(=O)OC(C)(C)C)c1C=NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000872349229	GG	On-Demand	Reactive	ADCYAP1R1	51	38
CC(CCc1cccnc1)=NNC(=S)Nc1ccc(N(C)C)cc1	ZINC000872349236	EG	On-Demand	Mild	NAMPT	20	42
CCC(=NNC(=O)Cc1ccccn1)c1cccc(OC)c1OC	ZINC000872349250	EF	On-Demand	Reactive	KCNK3	42	38
CC(=O)Nc1cccc(C=NNC(=O)C2CCN(c3ncccn3)CC2)c1	ZINC000872349251	FD	On-Demand	Reactive	TYK2	47	37
CC(=O)Nc1cccc(C=NNC(=O)C2CCN(c3ncccn3)CC2)c1	ZINC000872349251	FD	On-Demand	Reactive	LIMK2	17	42
O=C(NN=CCCOCC(F)F)c1cccc(C(F)(F)F)c1	ZINC000872349279	DG	On-Demand	Reactive	CCR2	74	42
O=C(NN=CCCOCC(F)F)c1cccc(C(F)(F)F)c1	ZINC000872349279	DG	On-Demand	Reactive	ADCYAP1R1	53	40
O=C(Cc1ccccn1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349297	FD	On-Demand	Reactive	LTA4H	47	44
O=C(Cc1ccccn1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349297	FD	On-Demand	Reactive	EPHX2	18	48
O=C(Cc1ccccn1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349297	FD	On-Demand	Reactive	FLT3	15	40
CN1CCC(C=NNCCCOc2ccccc2)CC1	ZINC000872349298	CE	On-Demand	Mild	HRH3	21	41
CN1CCC(C=NNCCCOc2ccccc2)CC1	ZINC000872349298	CE	On-Demand	Mild	CHRNA10	51	42
CC(CCc1cccnc1)=NNC(=O)C1CCN(c2ncccn2)CC1	ZINC000872349307	FE	On-Demand	Reactive	CHRNA7	46	37
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)Cc1cccnc1)C2	ZINC000872349313	FF	On-Demand	Reactive	GPR119	21	40
COC1(CS(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)CCC1	ZINC000872349352	FD	On-Demand	Reactive	DRD4	40	31
O=C(Cc1cccnc1)NN=CCCCCCO	ZINC000872349371	BD	On-Demand	Reactive	TBXAS1	40	40
O=C(Cc1cccnc1)NN=CCCCCCO	ZINC000872349371	BD	On-Demand	Reactive	PTAFR	18	41
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)Cc2ccccn2)c1	ZINC000872349382	FF	On-Demand	Reactive	PDS	46	32
CCC(CCC(F)(F)F)=NNC(=O)C1CCN(c2ncccn2)CC1	ZINC000872349391	FF	On-Demand	Reactive	ETHR	45	32
O=C(Cc1cccnc1)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872349408	EF	On-Demand	Reactive	CHRNA7	40	40
O=C(c1ccc(C=NNCCCc2ccccc2)cc1)N1CCCC1	ZINC000872349413	EG	On-Demand	Mild	PREP	43	45
O=C(c1ccc(C=NNCCCc2ccccc2)cc1)N1CCCC1	ZINC000872349413	EG	On-Demand	Mild	DPP7	23	44
O=C(c1ccc(C=NNCCCc2ccccc2)cc1)N1CCCC1	ZINC000872349413	EG	On-Demand	Mild	L3MBTL3	57	36
O=C(Cc1cccnc1)NN=Cc1cccc(CC2CCC2)c1	ZINC000872349423	DG	On-Demand	Reactive	CHRNA7	42	36
CC(C)(C)CC(=O)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872349437	EF	On-Demand	Reactive	LEF	36	41
Cc1ncsc1C(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349442	FD	On-Demand	Reactive	EPHX2	17	41
CN1CCC(C=NNC(=O)c2ccc(Br)cc2Cl)CC1	ZINC000872349448	FG	On-Demand	Reactive	PYK	43	35
O=C(Cc1cccnc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872349454	EE	On-Demand	Reactive	NAMPT	39	56
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)Cc1ccccn1)C2	ZINC000872349455	FF	On-Demand	Reactive	GPR119	18	42
CC(CCc1cccnc1)=NNCCCc1ccccc1	ZINC000872349465	CH	On-Demand	Mild	TBXAS1	64	47
CC(CCc1cccnc1)=NNCCCc1ccccc1	ZINC000872349465	CH	On-Demand	Mild	PTAFR	31	44
CC(CCc1cccnc1)=NNCCCc1ccccc1	ZINC000872349465	CH	On-Demand	Mild	PPO2	28	42
O=S(=O)(Nc1ccc(OCc2cccnc2)cc1)c1cnn(C2CCCC2)c1	ZINC000872349480	GH	On-Demand	Anodyne	ADRB3	50	37
O=S(=O)(Nc1ccc(OCc2cccnc2)cc1)c1cnn(C2CCCC2)c1	ZINC000872349480	GH	On-Demand	Anodyne	VCP	63	38
O=S(=O)(Nc1ccc(OCc2cccnc2)cc1)c1cnn(C2CCCC2)c1	ZINC000872349480	GH	On-Demand	Anodyne	NAMPT	45	42
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1Br	ZINC000872349482	GE	On-Demand	Anodyne	PKM	50	50
c1ccc(OCCCNN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872349485	BF	On-Demand	Mild	DRD4	15	41
CON(C)C(=O)c1ccc(NS(=O)(=O)c2cncc(OC(C)C)c2)cc1	ZINC000872349486	GE	On-Demand	Anodyne	LIMK2	30	43
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	GCGR	35	43
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	CCR2	71	39
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	BTK	21	40
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	BRAF	26	40
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	SCD1	27	42
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	ADCYAP1R1	88	43
COCCc1ncc(C=NNC(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000872349497	FG	On-Demand	Reactive	SCD	33	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCN(c2ncccn2)CC1	ZINC000872349548	GG	On-Demand	Reactive	GHSR	51	41
O=C(Cc1cccnc1)NN=Cc1cn(C2CC2)cn1	ZINC000872349552	CD	On-Demand	Reactive	CHRNA7	47	35
NC(=O)CNC(=S)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872349563	EC	On-Demand	Mild	SIGMAR1	15	40
CNC(=O)CNC(=S)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872349574	EC	On-Demand	Mild	GCGR	19	40
CNC(=O)CNC(=S)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872349574	EC	On-Demand	Mild	ADCYAP1R1	41	34
CNC(=O)CNC(=S)NN=C(C)CCOCc1ccccc1	ZINC000872349582	DD	On-Demand	Mild	PPO2	37	41
CN(CCO)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872349589	FD	On-Demand	Anodyne	PKM	42	38
CNC(=O)CNC(=S)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872349590	ED	On-Demand	Mild	PDE10A	17	45
CNC(=O)CNC(=S)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872349592	ED	On-Demand	Mild	MPO	15	40
CNC(=O)CNC(=S)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872349592	ED	On-Demand	Mild	GRPR	51	33
O=C(CCc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349616	GE	On-Demand	Reactive	ESR1	57	35
O=C(CCc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349616	GE	On-Demand	Reactive	LTA4H	41	44
O=C(CCc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872349616	GE	On-Demand	Reactive	EPHX2	16	48
CC(CCOCc1ccccc1)=NNC(=S)N(C)C	ZINC000872349655	CE	On-Demand	Mild	PPO2	42	46
CC(CCc1c[nH]c2ccccc12)=NNC(=S)N(C)C	ZINC000872349670	CF	On-Demand	Mild	MPO	29	43
CNC(=O)CNC(=S)NN=C1CCCCc2ccccc2C1	ZINC000872349675	DD	On-Demand	Mild	ABAT	16	50
CCOc1ccc(OC)cc1NS(=O)(=O)N=S(=O)(CC)CC	ZINC000872349756	FE	On-Demand	Anodyne	MTNR1B	15	41
CC(=NNC(=S)N(C)C)c1ccc(C2CCC2)cc1	ZINC000872349766	CG	On-Demand	Mild	PPO2	29	44
C=CCC1(C=NNC(=O)c2ccccc2OC)CCOCC1	ZINC000872349769	DF	On-Demand	Reactive	KCNA3	49	41
COc1ccc(Cn2cc(C=NNC(=S)N(C)C)nn2)cc1	ZINC000872349785	DD	On-Demand	Mild	PROKR1	57	34
CNc1ccccc1C=NNC(=S)N(C)C	ZINC000872349793	BD	On-Demand	Mild	UREA_CANEN	17	41
COc1ccc(Cn2cc(C=NNC(=S)NCCCN(C)C)nn2)cc1	ZINC000872349810	GD	On-Demand	Mild	PROKR1	57	34
C[C@H](O)CN(C)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872349835	GE	On-Demand	Anodyne	PKM	48	40
C[C@H](O)CN(C)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872349835	GE	On-Demand	Anodyne	ADAMTS4	48	32
CC(=O)Nc1cccc(C=NNC(=S)N(C)C)c1	ZINC000872349858	CD	On-Demand	Mild	UREA_CANEN	27	42
CCC(=NNC(=O)c1ccccc1OC)[C@@H]1CCCOC1	ZINC000872349920	CF	On-Demand	Reactive	KCNA3	42	39
CCC(=NNC(=O)c1ccccc1OC)[C@@H]1CCCOC1	ZINC000872349920	CF	On-Demand	Reactive	HCN1	43	35
Cn1nc(C(=O)OC(C)(C)C)cc1C=NNC(=O)Cc1ccccc1F	ZINC000872349925	FE	On-Demand	Reactive	MT-CYB	40	31
CC(C)(C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1	ZINC000872349936	FG	On-Demand	Reactive	NPY2R	36	47
CC(C)(C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1	ZINC000872349936	FG	On-Demand	Reactive	MLYCD	17	40
CC(C)(C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1	ZINC000872349936	FG	On-Demand	Reactive	L3MBTL3	54	35
CCC(=NNC(=O)c1ccccc1OC)[C@H]1CCCOC1	ZINC000872349958	CF	On-Demand	Reactive	KCNA3	42	39
CCC(=NNC(=O)c1ccccc1OC)[C@H]1CCCOC1	ZINC000872349958	CF	On-Demand	Reactive	HCN1	43	35
O=C(CCc1ccccc1O)NN=C1CCCc2ncccc21	ZINC000872350022	DF	On-Demand	Reactive	ABAT	15	48
O=C(Cc1cccnc1)NNS(=O)(=O)CCC1CCCCC1	ZINC000872350025	ED	On-Demand	Reactive	TBXAS1	25	43
O=C(Cc1cccnc1)NNS(=O)(=O)CCC1CCCCC1	ZINC000872350025	ED	On-Demand	Reactive	BMP1	82	49
O=C(Cc1cccnc1)NNS(=O)(=O)CCC1CCCCC1	ZINC000872350025	ED	On-Demand	Reactive	C3AR1	36	40
O=C(Cc1cccnc1)NNS(=O)(=O)CCC1CCCCC1	ZINC000872350025	ED	On-Demand	Reactive	NAMPT	48	40
CC(CCc1cccnc1)=NNC(=O)CCc1ccccc1O	ZINC000872350028	DF	On-Demand	Reactive	TBXAS1	32	40
CC(CCc1cccnc1)=NNC(=S)N(C)C	ZINC000872350032	CD	On-Demand	Mild	PPO2	40	42
O=C(Cc1ccccc1F)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872350075	FF	On-Demand	Reactive	L3MBTL3	48	34
O=C(CCc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872350122	FF	On-Demand	Reactive	L3MBTL3	49	33
COC1(CS(=O)(=O)NNC(=O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000872350126	FD	On-Demand	Reactive	CCR2	76	41
COc1cncc(C=NNC(=O)c2ccnc(N(C)C)c2)c1C	ZINC000872350134	DD	On-Demand	Reactive	ADCYAP1R1	42	36
Fc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872350205	EE	On-Demand	Mild	LTA4H	32	43
CNC(=O)CNC(=S)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872350302	FC	On-Demand	Mild	PDE10A	15	40
CC(CCOCc1ccccc1)=NNC(=S)NCC(N)=O	ZINC000872350306	DC	On-Demand	Mild	PPO2	53	47
CNC(=O)CNC(=S)NN=C1CCc2cc(OC)ccc21	ZINC000872350323	DC	On-Demand	Mild	NQO2	23	40
CC(CCc1c[nH]c2ccccc12)=NNC(=S)NCC(N)=O	ZINC000872350332	DD	On-Demand	Mild	NMBR	18	40
CC(CCc1c[nH]c2ccccc12)=NNC(=S)NCC(N)=O	ZINC000872350332	DD	On-Demand	Mild	MC5R	49	36
CC(CCc1c[nH]c2ccccc12)=NNC(=S)NCC(N)=O	ZINC000872350332	DD	On-Demand	Mild	GHSR	52	39
CC(CCc1c[nH]c2ccccc12)=NNC(=S)NCC(N)=O	ZINC000872350332	DD	On-Demand	Mild	MC1R	63	37
CC(CCc1c[nH]c2ccccc12)=NNC(=S)NCC(N)=O	ZINC000872350332	DD	On-Demand	Mild	PPO2	41	39
CN1CCC(C=NNC(=O)C(C)(C)c2ccccc2)CC1	ZINC000872350366	CE	On-Demand	Reactive	CHRM3	17	40
CN1CCC(C=NNC(=O)C(C)(C)c2ccccc2)CC1	ZINC000872350366	CE	On-Demand	Reactive	NPY2R	28	40
CCOc1cc(NS(=O)(=O)c2cn(C)nc2Br)ccc1C	ZINC000872350381	FF	On-Demand	Anodyne	NR1I2	47	38
CCOc1cc(NS(=O)(=O)c2cn(C)nc2Br)ccc1C	ZINC000872350381	FF	On-Demand	Anodyne	ALPL	21	43
O=C(CCCc1ccccc1)NN=C1CCCC2(C1)OCCO2	ZINC000872350382	DF	On-Demand	Reactive	ABAT	19	40
O=C(NNS(=O)(=O)CCOCC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000872350396	GE	On-Demand	Reactive	CCR2	76	41
CC(=O)Nc1cccc(C=NNC(=O)CC(C)(C)C)c1	ZINC000872350468	CF	On-Demand	Reactive	ABAT	19	43
CNC(=O)CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350478	GB	On-Demand	Mild	LTA4H	25	42
CNC(=O)CNC(=S)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350478	GB	On-Demand	Mild	EPHX2	16	42
CCOc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1C(C)C	ZINC000872350492	GE	On-Demand	Reactive	TBXAS1	36	40
CCOc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1C(C)C	ZINC000872350492	GE	On-Demand	Reactive	NAMPT	48	38
O=C(Cc1ccccn1)NNS(=O)(=O)CCC1CCCCC1	ZINC000872350509	ED	On-Demand	Reactive	BMP1	70	45
CCOc1cc(NS(=O)(=O)c2cnn(C)c2Br)ccc1C	ZINC000872350537	FF	On-Demand	Anodyne	ALPL	22	43
CC(C)(C)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350548	EE	On-Demand	Reactive	LTA4H	37	43
CC(C)(C)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350548	EE	On-Demand	Reactive	HRH3	15	41
CC(C)(C)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350548	EE	On-Demand	Reactive	EPHX2	21	45
CC(C)(C)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872350548	EE	On-Demand	Reactive	PSMB1	40	38
CC(CCOCc1ccccc1)=NNC(=S)NCCCN(C)C	ZINC000872350594	EE	On-Demand	Mild	PPO2	32	40
NC(=O)CNC(=S)NN=C1CCCCc2ccccc2C1	ZINC000872350622	DD	On-Demand	Mild	ABAT	16	49
Cn1cc([C@@H]2CCCN2S(=O)(=O)c2ccc(F)c(C(F)F)c2)cn1	ZINC000872350623	FG	On-Demand	Anodyne	CASP7	46	34
CCC(CCC(F)(F)F)=NNC(=O)c1ccccc1OC	ZINC000872350636	DH	On-Demand	Reactive	KCNA3	40	39
CCC(CCC(F)(F)F)=NNC(=O)c1ccccc1OC	ZINC000872350636	DH	On-Demand	Reactive	KCNK3	55	43
CCC(CCC(F)(F)F)=NNC(=O)c1ccccc1OC	ZINC000872350636	DH	On-Demand	Reactive	KCNK9	51	43
CC(=NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1cn(C)cn1	ZINC000872350677	GD	On-Demand	Mild	F13A1	45	34
O=C(CCCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872350695	CF	On-Demand	Reactive	PREP	33	42
CN1CCC(C=NNC(=O)c2c(Cl)cccc2Cl)CC1	ZINC000872350710	DG	On-Demand	Reactive	HTR1F	43	38
CN1CCC(C=NNC(=O)c2c(Cl)cccc2Cl)CC1	ZINC000872350710	DG	On-Demand	Reactive	TYK2	44	37
COC1(CS(=O)(=O)NNC(=O)Cc2cccnc2)CCC1	ZINC000872350762	DC	On-Demand	Reactive	NAMPT	43	38
COc1cc(C=NNC(=O)CC(C)(C)C)c(Cl)cc1O	ZINC000872350782	CF	On-Demand	Reactive	GCGR	25	44
COc1cc(C=NNC(=O)CC(C)(C)C)c(Cl)cc1O	ZINC000872350782	CF	On-Demand	Reactive	ADCYAP1R1	49	36
O=C(CCCc1ccccc1)NN=Cc1cn(C2CC2)cn1	ZINC000872350786	CF	On-Demand	Reactive	PREP	42	40
CC(CCc1cccnc1)=NNC(=O)CC(C)(C)C	ZINC000872350810	CF	On-Demand	Reactive	TBXAS1	37	43
CC(CCc1cccnc1)=NNC(=O)CC(C)(C)C	ZINC000872350810	CF	On-Demand	Reactive	NAMPT	21	45
COc1cncc(C=NNC(=O)CCCc2ccccc2)c1C	ZINC000872350825	DF	On-Demand	Reactive	ABAT	19	40
COc1cncc(C=NNC(=O)CCCc2ccccc2)c1C	ZINC000872350825	DF	On-Demand	Reactive	FAAH	43	36
COc1cncc(C=NNC(=O)CCCc2ccccc2)c1C	ZINC000872350825	DF	On-Demand	Reactive	CES1	49	36
CCC(=NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)[C@H]1CCCOC1	ZINC000872350851	GE	On-Demand	Mild	F13A1	46	38
CCC(=NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)[C@@H]1CCCOC1	ZINC000872350853	GE	On-Demand	Mild	F13A1	46	38
NC(=O)CNC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872350883	EC	On-Demand	Mild	L3MBTL3	44	35
CC(=NNC(=S)NCC(N)=O)c1ccc(C2CCC2)cc1	ZINC000872350897	DD	On-Demand	Mild	PPO2	34	43
CC(CCc1cccnc1)=NNC(=S)NCC(N)=O	ZINC000872350903	CC	On-Demand	Mild	PPO2	51	43
Cn1ncc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1C(F)(F)F	ZINC000872350949	GD	On-Demand	Reactive	FAAH	48	38
Cn1ncc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1C(F)(F)F	ZINC000872350949	GD	On-Demand	Reactive	CES1	40	38
Cn1ncc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1C(F)(F)F	ZINC000872350949	GD	On-Demand	Reactive	CES1D	54	33
Cc1c(C=NNC(=O)CC(C)(C)C)cccc1[N+](=O)[O-]	ZINC000872350952	CF	On-Demand	Reactive	COLA	62	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1cccc(OC(F)F)c1	ZINC000872350955	GG	On-Demand	Reactive	GCGR	28	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1cccc(OC(F)F)c1	ZINC000872350955	GG	On-Demand	Reactive	TAAR1	15	44
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1cccc(OC(F)F)c1	ZINC000872350955	GG	On-Demand	Reactive	ADCYAP1R1	74	39
CN1CCC(C=NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1	ZINC000872350980	GD	On-Demand	Mild	TGM2	67	40
CN1CCC(C=NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1	ZINC000872350980	GD	On-Demand	Mild	F13A1	75	40
CCOc1cc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)ccc1C	ZINC000872350999	FF	On-Demand	Anodyne	ALPL	18	41
c1cc(NN=C(C2CCC2)[C@@H]2CCCO2)c2ccncc2c1	ZINC000872351001	CH	On-Demand	Mild	CDK5	25	42
c1cc(NN=C(C2CCC2)[C@H]2CCCO2)c2ccncc2c1	ZINC000872351002	CH	On-Demand	Mild	CDK5	25	42
COc1nscc1C=NNC(=O)CCCc1ccccc1	ZINC000872351009	DF	On-Demand	Reactive	ABAT	19	40
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cccnc1OCC(F)F	ZINC000872351020	GE	On-Demand	Reactive	FAAH	44	37
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cccnc1OCC(F)F	ZINC000872351020	GE	On-Demand	Reactive	CES1	55	35
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cccnc1OCC(F)F	ZINC000872351020	GE	On-Demand	Reactive	CES1D	44	31
Cn1ncc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2F)c1C(F)(F)F	ZINC000872351039	GG	On-Demand	Mild	SGK1	26	40
CN1CCC(C=NNC(=O)CCCc2ccccc2)CC1	ZINC000872351042	CE	On-Demand	Reactive	SIGMAR1	41	44
CN1CCC(C=NNC(=O)CCCc2ccccc2)CC1	ZINC000872351042	CE	On-Demand	Reactive	PREP	49	43
CN1CCC(C=NNC(=O)CCCc2ccccc2)CC1	ZINC000872351042	CE	On-Demand	Reactive	CYP2J2	47	36
CC(C)(C)CC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872351048	DF	On-Demand	Reactive	L3MBTL3	62	37
Cn1nc2c(c1S(=O)(=O)NNC(=O)CCCc1ccccc1)CCCC2	ZINC000872351069	GD	On-Demand	Reactive	CES1D	53	32
O=C(CCCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872351073	FG	On-Demand	Reactive	PREP	55	49
O=C(CCCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872351073	FG	On-Demand	Reactive	L3MBTL3	53	35
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	ESR1	42	39
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	DRD4	42	32
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	LTA4H	28	41
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	EPHX2	22	43
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	FLT3	15	41
N#Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872351074	GE	On-Demand	Reactive	ADCYAP1R1	48	41
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(CCSC)cc1	ZINC000872351096	FF	On-Demand	Anodyne	PTPRB	49	35
CCNc1ccccc1C=NNC(=O)[C@H](C)NS(C)(=O)=O	ZINC000872351100	DC	On-Demand	Reactive	CAPN2	46	33
CCNc1ccccc1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000872351101	DC	On-Demand	Reactive	CAPN2	46	33
O=C(CCCc1ccccc1)NN=Cc1ccnn1CC1CCC1	ZINC000872351105	DG	On-Demand	Reactive	PREP	40	36
O=C(CCCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872351117	CG	On-Demand	Reactive	PREP	39	40
O=C(CCCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872351118	CG	On-Demand	Reactive	PREP	39	40
O=C(NN=CCCCC1CC1)c1c(Cl)cccc1Cl	ZINC000872351119	CI	On-Demand	Reactive	TYK2	26	40
Cn1nnc2cc(S(=O)(=O)Nc3ccc(N4CCOCC4)c(F)c3)ccc21	ZINC000872351202	GD	On-Demand	Anodyne	CREBBP	43	38
Cn1nnc2cc(S(=O)(=O)Nc3ccc(N4CCOCC4)c(F)c3)ccc21	ZINC000872351202	GD	On-Demand	Anodyne	BRD9	43	38
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000872351210	ED	On-Demand	Reactive	CTSB	24	45
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000872351210	ED	On-Demand	Reactive	CAPNS1	51	31
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000872351210	ED	On-Demand	Reactive	CAPN1	55	45
CC(CCOCc1ccccc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000872351210	ED	On-Demand	Reactive	CAPN2	69	45
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)NS(C)(=O)=O	ZINC000872351211	ED	On-Demand	Reactive	CTSB	24	45
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)NS(C)(=O)=O	ZINC000872351211	ED	On-Demand	Reactive	CAPNS1	51	31
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)NS(C)(=O)=O	ZINC000872351211	ED	On-Demand	Reactive	CAPN1	55	45
CC(CCOCc1ccccc1)=NNC(=O)[C@H](C)NS(C)(=O)=O	ZINC000872351211	ED	On-Demand	Reactive	CAPN2	69	45
CC[C@H](C(=O)NN=CC1CC2(C1)OCCO2)c1ccccc1	ZINC000872351240	DE	On-Demand	Reactive	KCNQ2	39	40
CC[C@@H](C(=O)NN=CC1CC2(C1)OCCO2)c1ccccc1	ZINC000872351241	DE	On-Demand	Reactive	KCNQ2	39	40
CC[C@@H](C(=O)NN=Cc1cncc(OC)c1C)c1ccccc1	ZINC000872351252	DG	On-Demand	Reactive	PDE10A	25	44
CC(C)(C(=O)NNS(=O)(=O)CCOCC1CCC1)c1ccccc1	ZINC000872351255	FD	On-Demand	Reactive	AMY2	46	31
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cnn(C2CCCC2)c1	ZINC000872351263	GE	On-Demand	Reactive	FKBP1A	40	42
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cnn(C2CCCC2)c1	ZINC000872351263	GE	On-Demand	Reactive	PREP	76	40
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)CCCc1ccccc1	ZINC000872351287	GD	On-Demand	Reactive	FAAH	48	38
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)CCCc1ccccc1	ZINC000872351287	GD	On-Demand	Reactive	CES1	42	38
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)CCCc1ccccc1	ZINC000872351287	GD	On-Demand	Reactive	SFRP1	42	32
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)CCCc1ccccc1	ZINC000872351287	GD	On-Demand	Reactive	CES1D	54	33
O=C(CCCc1ccccc1)NN=CCCCCCO	ZINC000872351299	CF	On-Demand	Reactive	HDAC8	17	42
O=C(CCCc1ccccc1)NN=CCCCCCO	ZINC000872351299	CF	On-Demand	Reactive	HDAC2	15	40
O=C(CCCc1ccccc1)NN=CCCCCCO	ZINC000872351299	CF	On-Demand	Reactive	FAAH	51	40
O=C(CCCc1ccccc1)NN=CCCCCCO	ZINC000872351299	CF	On-Demand	Reactive	CES1	57	38
O=C(CCCc1cccs1)NN=Cc1nc(C2OCCO2)cs1	ZINC000872351300	FF	On-Demand	Reactive	PTPRF	18	41
N#Cc1cccc(C(=O)NN=Cc2ccnn2CC2CCC2)c1	ZINC000872351313	DE	On-Demand	Reactive	GCGR	20	41
O=C(CCCc1ccccc1)NN=Cc1nc(C2OCCO2)cs1	ZINC000872351318	EF	On-Demand	Reactive	CES1	44	34
COCCc1ncc(C=NNC(=O)c2cccc(OC(F)F)c2)s1	ZINC000872351326	FF	On-Demand	Reactive	GCGR	31	41
COCCc1ncc(C=NNC(=O)c2cccc(OC(F)F)c2)s1	ZINC000872351326	FF	On-Demand	Reactive	ADCYAP1R1	77	34
CC[C@H](C(=O)NN=CC1CCN(C)CC1)c1ccccc1	ZINC000872351330	CF	On-Demand	Reactive	KCNQ2	50	46
CC[C@@H](C(=O)NN=CC1CCN(C)CC1)c1ccccc1	ZINC000872351332	CF	On-Demand	Reactive	KCNQ2	50	46
COc1ccc(Cn2cc(C=NNC(=O)CC(C)(C)C)nn2)cc1	ZINC000872351337	EE	On-Demand	Reactive	PROKR1	67	37
CC[C@@H](C(=O)NN=C[C@H]1CCN(c2cnn(C)c2)C1)c1ccccc1	ZINC000872351351	EF	On-Demand	Reactive	KCNQ2	41	43
CC[C@@H](C(=O)NN=C[C@@H]1CCN(c2cnn(C)c2)C1)c1ccccc1	ZINC000872351353	EF	On-Demand	Reactive	KCNQ2	41	43
CC[C@H](C(=O)NN=C[C@H]1CCN(c2cnn(C)c2)C1)c1ccccc1	ZINC000872351355	EF	On-Demand	Reactive	KCNQ2	41	43
CC[C@H](C(=O)NN=C[C@@H]1CCN(c2cnn(C)c2)C1)c1ccccc1	ZINC000872351357	EF	On-Demand	Reactive	KCNQ2	41	43
CS(=O)(=O)c1ccccc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872351380	FF	On-Demand	Mild	L3MBTL3	76	36
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)C(C)(C)c1ccccc1	ZINC000872351386	GD	On-Demand	Reactive	SFRP1	49	31
F[C@@H]1CCCC1=NNc1cccc2cnccc12	ZINC000872351391	BH	On-Demand	Mild	TRPV1	17	40
F[C@@H]1CCCC1=NNc1cccc2cnccc12	ZINC000872351391	BH	On-Demand	Mild	CDK5	23	40
F[C@H]1CCCC1=NNc1cccc2cnccc12	ZINC000872351393	BH	On-Demand	Mild	TRPV1	17	40
F[C@H]1CCCC1=NNc1cccc2cnccc12	ZINC000872351393	BH	On-Demand	Mild	CDK5	23	40
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000872351400	GG	On-Demand	Anodyne	NPY2R	42	36
Cn1nc2c(c1C=NNC(=O)c1cccc(OC(F)F)c1)CCCC2	ZINC000872351414	EF	On-Demand	Reactive	DRD4	40	30
Cn1nc2c(c1C=NNC(=O)c1cccc(OC(F)F)c1)CCCC2	ZINC000872351414	EF	On-Demand	Reactive	GCGR	17	40
O=C(NN=Cc1ccnn1CC1CCC1)c1cccc(OC(F)F)c1	ZINC000872351417	EG	On-Demand	Reactive	GCGR	19	40
O=C(NN=Cc1ccnn1CC1CCC1)c1cccc(OC(F)F)c1	ZINC000872351417	EG	On-Demand	Reactive	ADCYAP1R1	48	32
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(C(F)F)o1	ZINC000872351421	FF	On-Demand	Reactive	FAAH	56	36
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(C(F)F)o1	ZINC000872351421	FF	On-Demand	Reactive	CES1	57	34
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(C(F)F)o1	ZINC000872351421	FF	On-Demand	Reactive	CES1D	56	34
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000872351439	GD	On-Demand	Anodyne	NPY2R	48	34
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000872351439	GD	On-Demand	Anodyne	SLC6A9	19	43
C=CCC1(C=NNC(=O)[C@@H](CC)c2ccccc2)CCOCC1	ZINC000872351452	DH	On-Demand	Reactive	KCNQ2	27	40
C=CCC1(C=NNC(=O)[C@H](CC)c2ccccc2)CCOCC1	ZINC000872351453	DH	On-Demand	Reactive	KCNQ2	27	40
COc1ccc(Cn2cc(C=NNC(=O)C3CCC3)nn2)cc1	ZINC000872351459	DD	On-Demand	Reactive	GHSR	21	40
COc1ccc(Cn2cc(C=NNC(=O)C3CCC3)nn2)cc1	ZINC000872351459	DD	On-Demand	Reactive	PROKR1	65	36
CCC(=NNC(=O)C1CCC1)c1cccc(OC)c1OC	ZINC000872351464	CF	On-Demand	Reactive	DRD2	32	43
COCCc1ncc(C=NNC(=O)CCCc2ccccc2)s1	ZINC000872351470	EF	On-Demand	Reactive	FAAH	45	38
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	TBXAS1	85	51
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	PTAFR	38	47
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	FAAH	58	39
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	CES1	65	39
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	PPO2	38	45
CC(CCc1cccnc1)=NNC(=O)CCCc1ccccc1	ZINC000872351486	DH	On-Demand	Reactive	NAMPT	18	48
CN1CCC(C=NNC(=O)c2cccc(OC(F)F)c2)CC1	ZINC000872351499	DE	On-Demand	Reactive	DRD4	43	32
CCC(CCC(F)(F)F)=NNC(=O)c1cccc(C#N)c1	ZINC000872351523	CG	On-Demand	Reactive	KCNJ11	17	44
CCOc1cc(NS(=O)(=O)c2cccc(F)c2OC)ccc1C	ZINC000872351544	EG	On-Demand	Anodyne	ALPL	27	41
COc1nscc1C=NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000872351549	GD	On-Demand	Mild	F13A1	42	36
Cn1nc2c(c1C=NNC(=O)CCCc1ccccc1)CCCC2	ZINC000872351572	DF	On-Demand	Reactive	BCHE	48	36
CC(CCc1cccnc1)=NNc1ccccc1S(C)(=O)=O	ZINC000872351631	DF	On-Demand	Mild	NAMPT	18	44
CC[C@@H](C(=O)NN=Cc1cn(C2CC2)cn1)c1ccccc1	ZINC000872351655	CF	On-Demand	Reactive	KCNQ2	44	45
CC(CCOCc1ccccc1)=NNC(=O)C1CCC1	ZINC000872351659	CF	On-Demand	Reactive	PPO2	34	41
CC[C@@H](C(=O)NN=Cc1ccnn1CC1CCC1)c1ccccc1	ZINC000872351667	DG	On-Demand	Reactive	KCNQ2	39	40
COCCc1ncc(C=NNC(=O)c2ccc(OC)c(Br)c2)s1	ZINC000872351681	GF	On-Demand	Reactive	ADCYAP1R1	69	38
CN1CCC(C=NNC(=O)CCCc2cccs2)CC1	ZINC000872351720	CF	On-Demand	Reactive	PTPRF	19	43
CC[C@@H](C(=O)NN=Cc1c(OC)cc(F)cc1OC)c1ccccc1	ZINC000872351729	EG	On-Demand	Reactive	KCNQ2	45	38
CC[C@@H](C(=O)NN=Cc1c(OC)cc(F)cc1OC)c1ccccc1	ZINC000872351729	EG	On-Demand	Reactive	PDE10A	26	47
COc1ccc(Cn2cc(C=NNC(=O)CCCc3cccs3)nn2)cc1	ZINC000872351732	GF	On-Demand	Reactive	PROKR1	55	33
O=C(CCCc1cccs1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872351746	DH	On-Demand	Reactive	PTPRF	18	40
O=C(CCCc1cccs1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872351747	DH	On-Demand	Reactive	PTPRF	18	40
O=C(CCCc1cccs1)NN=C1CCCc2ncccc21	ZINC000872351749	DG	On-Demand	Reactive	ABAT	15	48
CC[C@H](C(=O)NN=C1CCCC2(C1)OCCO2)c1ccccc1	ZINC000872351773	DF	On-Demand	Reactive	KCNQ2	40	39
CC[C@@H](C(=O)NN=C1CCCC2(C1)OCCO2)c1ccccc1	ZINC000872351774	DF	On-Demand	Reactive	KCNQ2	40	39
O=C(CCCc1cccs1)NN=CCCCCCO	ZINC000872351777	CF	On-Demand	Reactive	PTPRF	18	40
O=C(CCCc1cccs1)NN=Cc1cn(C2CC2)cn1	ZINC000872351788	DF	On-Demand	Reactive	PTPRF	19	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	ESR1	86	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	ESR2	59	37
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	LTA4H	54	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	HRH3	42	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	EPHX2	21	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	FLT3	15	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	PSMB2	41	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C1CCC1	ZINC000872351816	ED	On-Demand	Reactive	PSMB1	45	40
CC[C@H](C(=O)NN=CCCCCCO)c1ccccc1	ZINC000872351820	CF	On-Demand	Reactive	KCNQ2	39	41
CC[C@@H](C(=O)NN=CCCCCCO)c1ccccc1	ZINC000872351821	CF	On-Demand	Reactive	KCNQ2	39	41
COc1cc(C=NNC(=O)C2CCC2)c(Cl)cc1O	ZINC000872351840	CE	On-Demand	Reactive	GCGR	20	43
Cc1nocc1S(=O)(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000872351844	EG	On-Demand	Anodyne	PKM	22	42
COCCc1ncc(C=NNC(=O)NCc2ccc(Cl)cc2)s1	ZINC000872351856	FF	On-Demand	Reactive	UL54	52	34
CC(CCc1cccnc1)=NNC(=O)C1CCC1	ZINC000872351860	BE	On-Demand	Reactive	TBXAS1	31	40
CC(CCc1cccnc1)=NNC(=O)C1CCC1	ZINC000872351860	BE	On-Demand	Reactive	CHRNA7	44	35
CC(CCc1cccnc1)=NNC(=O)C1CCC1	ZINC000872351860	BE	On-Demand	Reactive	C3AR1	41	42
CC(CCc1cccnc1)=NNC(=O)C1CCC1	ZINC000872351860	BE	On-Demand	Reactive	NAMPT	37	42
CC[C@@H](C(=O)NN=Cc1csnc1OC)c1ccccc1	ZINC000872351864	DF	On-Demand	Reactive	PDE10A	15	40
CN1CCC(C=NNC(=O)NCc2ccc(Cl)cc2)CC1	ZINC000872351894	DE	On-Demand	Reactive	SLC6A3	22	44
CN1CCC(C=NNC(=O)NCc2ccc(Cl)cc2)CC1	ZINC000872351894	DE	On-Demand	Reactive	P2RX7	21	41
CC[C@@H](C(=O)NN=Cc1c2c(nn1C)CCCC2)c1ccccc1	ZINC000872351904	DF	On-Demand	Reactive	KCNQ2	41	42
O=C(CCCc1cccs1)NN=C1CCC[C@H]1F	ZINC000872351916	CG	On-Demand	Reactive	PTPRF	18	40
O=C(CCCc1cccs1)NN=C1CCC[C@@H]1F	ZINC000872351917	CG	On-Demand	Reactive	PTPRF	18	40
CC[C@@H](C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1	ZINC000872351933	FH	On-Demand	Reactive	KCNQ2	55	48
CC[C@@H](C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1	ZINC000872351933	FH	On-Demand	Reactive	L3MBTL3	53	33
O=C(CCCc1cccs1)NN=CC1CC2(C1)OCCO2	ZINC000872351942	DE	On-Demand	Reactive	PTPRF	18	41
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CCC1	ZINC000872351943	CE	On-Demand	Reactive	L3MBTL3	95	45
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C1CCC1	ZINC000872351959	DF	On-Demand	Reactive	SIGMAR1	26	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	CCKAR	43	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	NMBR	50	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	MC5R	34	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	SSTR3	17	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	CCKBR	53	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C1CCC1	ZINC000872351970	CG	On-Demand	Reactive	GHSR	56	43
O=C(CCCc1cccs1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872351976	CF	On-Demand	Reactive	PTPRF	18	40
O=C(NN=Cc1ccc(F)c2ccccc12)C1CCC1	ZINC000872351982	CG	On-Demand	Reactive	GCGR	23	48
O=C(NN=C1CC[C@@H]2C[C@H]12)c1ccc(O)c(Cl)c1	ZINC000872352037	CF	On-Demand	Reactive	GCGR	32	40
O=C(NN=C1CC[C@@H]2C[C@H]12)c1ccc(O)c(Cl)c1	ZINC000872352037	CF	On-Demand	Reactive	ADCYAP1R1	74	37
Cn1nc2c(c1C=NNC(=O)c1ccc(O)c(Cl)c1)CCCC2	ZINC000872352045	EE	On-Demand	Reactive	GCGR	48	47
Cn1nc2c(c1C=NNC(=O)c1ccc(O)c(Cl)c1)CCCC2	ZINC000872352045	EE	On-Demand	Reactive	ADCYAP1R1	96	43
CCC(CC)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872352054	CD	On-Demand	Mild	CA2	30	42
CCC(CC)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872352054	CD	On-Demand	Mild	CA1	24	42
CCC(CC)NN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872352054	CD	On-Demand	Mild	CA4	22	40
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1C(C)C	ZINC000872352067	GF	On-Demand	Reactive	HCN1	66	34
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1C(C)C	ZINC000872352067	GF	On-Demand	Reactive	HCN4	51	34
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1C(C)C	ZINC000872352067	GF	On-Demand	Reactive	KCNK3	57	49
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1C(C)C	ZINC000872352067	GF	On-Demand	Reactive	KCNK9	49	49
C=CCC1(C=NNC(=O)c2ccc(O)c(Cl)c2)CCOCC1	ZINC000872352086	DG	On-Demand	Reactive	GCGR	38	43
C=CCC1(C=NNC(=O)c2ccc(O)c(Cl)c2)CCOCC1	ZINC000872352086	DG	On-Demand	Reactive	ADCYAP1R1	83	41
CC(C)(C)[C@@H]1CC(=NNC(=O)c2ccc(O)c(Cl)c2)CCO1	ZINC000872352121	DG	On-Demand	Reactive	ADCYAP1R1	72	34
O=C(NN=C1CCCN2CCSC[C@H]12)c1ccc(O)c(Cl)c1	ZINC000872352175	EE	On-Demand	Reactive	ADCYAP1R1	72	35
O=C(NN=C1CCCN2CCSC[C@@H]12)c1ccc(O)c(Cl)c1	ZINC000872352176	EE	On-Demand	Reactive	ADCYAP1R1	72	35
CC(CCc1cccnc1)=NNC(=O)Cc1ccsc1	ZINC000872352182	CF	On-Demand	Reactive	C3AR1	31	40
CC(CCc1c[nH]c2ccccc12)=NNCCS(C)(=O)=O	ZINC000872352197	DE	On-Demand	Mild	HTR1D	15	41
CC(CCc1c[nH]c2ccccc12)=NNCCS(C)(=O)=O	ZINC000872352197	DE	On-Demand	Mild	MPO	46	41
CC(CCc1c[nH]c2ccccc12)=NNCCS(C)(=O)=O	ZINC000872352197	DE	On-Demand	Mild	ALOX15	17	47
CCC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@@H]1CCCOC1	ZINC000872352201	DF	On-Demand	Reactive	GCGR	31	41
CCC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@@H]1CCCOC1	ZINC000872352201	DF	On-Demand	Reactive	ADCYAP1R1	72	35
CCC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@H]1CCCOC1	ZINC000872352202	DF	On-Demand	Reactive	GCGR	31	41
CCC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@H]1CCCOC1	ZINC000872352202	DF	On-Demand	Reactive	ADCYAP1R1	72	35
O=C(NN=C1CCCC2(C1)OCCO2)c1ccc(O)c(Cl)c1	ZINC000872352204	DE	On-Demand	Reactive	ADCYAP1R1	69	34
O=C(NN=CC1CC2(C1)OCCO2)c1ccc(O)c(Cl)c1	ZINC000872352206	DD	On-Demand	Reactive	GCGR	37	44
O=C(NN=CC1CC2(C1)OCCO2)c1ccc(O)c(Cl)c1	ZINC000872352206	DD	On-Demand	Reactive	ADCYAP1R1	83	42
O=C(c1ccc(C=NNc2nccnc2Cl)cc1)N1CCCC1	ZINC000872352209	EF	On-Demand	Mild	L3MBTL3	45	35
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCC1	ZINC000872352217	DD	On-Demand	Reactive	LEF	23	41
O=C(NN=CCCOCC(F)F)c1ccc(O)c(Cl)c1	ZINC000872352224	DE	On-Demand	Reactive	GCGR	46	46
O=C(NN=CCCOCC(F)F)c1ccc(O)c(Cl)c1	ZINC000872352224	DE	On-Demand	Reactive	ADCYAP1R1	100	46
O=C(NN=CCCCCCO)c1ccc(O)c(Cl)c1	ZINC000872352248	CE	On-Demand	Reactive	GCGR	46	52
O=C(NN=CCCCCCO)c1ccc(O)c(Cl)c1	ZINC000872352248	CE	On-Demand	Reactive	ADCYAP1R1	98	47
CN1CCC(C=NNC(=O)c2ccc(O)c(Cl)c2)CC1	ZINC000872352251	CE	On-Demand	Reactive	DRD1	46	34
CN1CCC(C=NNC(=O)c2ccc(O)c(Cl)c2)CC1	ZINC000872352251	CE	On-Demand	Reactive	GCGR	45	52
CN1CCC(C=NNC(=O)c2ccc(O)c(Cl)c2)CC1	ZINC000872352251	CE	On-Demand	Reactive	DRD5	51	33
CN1CCC(C=NNC(=O)c2ccc(O)c(Cl)c2)CC1	ZINC000872352251	CE	On-Demand	Reactive	ADCYAP1R1	94	42
Cn1ncc(S(=O)(=O)NNC(=O)C2CCC2)c1C(F)(F)F	ZINC000872352277	EC	On-Demand	Reactive	SFRP1	61	32
Cn1ncc(S(=O)(=O)NNC(=O)C2CCC2)c1C(F)(F)F	ZINC000872352277	EC	On-Demand	Reactive	WNT3	53	32
O=C(NN=C1CCC[C@H]1F)c1ccc(O)c(Cl)c1	ZINC000872352343	CF	On-Demand	Reactive	GCGR	33	44
O=C(NN=C1CCC[C@H]1F)c1ccc(O)c(Cl)c1	ZINC000872352343	CF	On-Demand	Reactive	ADCYAP1R1	76	37
O=C(NN=C1CCC[C@@H]1F)c1ccc(O)c(Cl)c1	ZINC000872352344	CF	On-Demand	Reactive	GCGR	33	44
O=C(NN=C1CCC[C@@H]1F)c1ccc(O)c(Cl)c1	ZINC000872352344	CF	On-Demand	Reactive	ADCYAP1R1	76	37
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(O)c(Cl)c1	ZINC000872352349	DG	On-Demand	Reactive	GCGR	39	46
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(O)c(Cl)c1	ZINC000872352349	DG	On-Demand	Reactive	ADCYAP1R1	85	41
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(O)c(Cl)c1	ZINC000872352350	DG	On-Demand	Reactive	GCGR	39	46
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(O)c(Cl)c1	ZINC000872352350	DG	On-Demand	Reactive	ADCYAP1R1	85	41
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)C1CCC1	ZINC000872352354	EC	On-Demand	Reactive	SFRP1	91	34
Cn1ncc(C(F)(F)F)c1S(=O)(=O)NNC(=O)C1CCC1	ZINC000872352354	EC	On-Demand	Reactive	WNT3	70	34
O=C(NNS(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)C1CCC1	ZINC000872352360	FE	On-Demand	Reactive	SFRP1	48	31
CCC(CC)NN=Cc1cccc(NC(C)=O)c1	ZINC000872352430	BF	On-Demand	Mild	KCNK3	67	33
CCC(CC)NN=Cc1cccc(NC(C)=O)c1	ZINC000872352430	BF	On-Demand	Mild	KCNK9	52	33
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1ccc(O)c(Cl)c1	ZINC000872352457	DG	On-Demand	Reactive	GCGR	33	48
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1ccc(O)c(Cl)c1	ZINC000872352457	DG	On-Demand	Reactive	ADCYAP1R1	74	37
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1ccc(O)c(Cl)c1	ZINC000872352458	DG	On-Demand	Reactive	GCGR	33	48
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1ccc(O)c(Cl)c1	ZINC000872352458	DG	On-Demand	Reactive	ADCYAP1R1	74	37
O=C(NN=Cc1ccnn1CC1CCC1)c1ccc(O)c(Cl)c1	ZINC000872352472	EF	On-Demand	Reactive	GCGR	46	46
O=C(NN=Cc1ccnn1CC1CCC1)c1ccc(O)c(Cl)c1	ZINC000872352472	EF	On-Demand	Reactive	ADCYAP1R1	95	43
O=C(Cc1ccsc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872352481	FE	On-Demand	Reactive	ESR1	50	37
O=C(Cc1ccsc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872352481	FE	On-Demand	Reactive	LTA4H	34	46
O=C(Cc1ccsc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872352481	FE	On-Demand	Reactive	EPHX2	18	47
CCC(CC)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872352482	DE	On-Demand	Mild	PROKR1	61	33
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(O)c(Cl)c1	ZINC000872352523	DH	On-Demand	Reactive	GCGR	37	42
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(O)c(Cl)c1	ZINC000872352523	DH	On-Demand	Reactive	ADCYAP1R1	86	41
COc1ccc(Cn2cc(C=NNCCS(C)(=O)=O)nn2)cc1	ZINC000872352541	EC	On-Demand	Mild	PROKR1	65	35
CCC(CC)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872352543	CG	On-Demand	Mild	L3MBTL3	70	38
CC(CCc1cccnc1)=NNCCS(C)(=O)=O	ZINC000872352563	CD	On-Demand	Mild	TBXA2R	16	40
CC(CCc1cccnc1)=NNCCS(C)(=O)=O	ZINC000872352563	CD	On-Demand	Mild	TBXAS1	57	46
CC(CCc1cccnc1)=NNCCS(C)(=O)=O	ZINC000872352563	CD	On-Demand	Mild	NAMPT	33	46
CCC(CC)NN=C(C)CCc1cccnc1	ZINC000872352569	BG	On-Demand	Mild	TBXAS1	26	40
O=C(NN=C1CCOC2(CCCC2)C1)c1ccc(O)c(Cl)c1	ZINC000872352591	DG	On-Demand	Reactive	ADCYAP1R1	69	34
Cn1ncc(S(=O)(=O)Nc2ccc(OCCO)cc2)c1C(F)(F)F	ZINC000872352617	FD	On-Demand	Anodyne	SGK1	65	37
O=C(Cc1ccsc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872352620	EF	On-Demand	Reactive	L3MBTL3	40	34
COC(=O)c1ccoc1S(=O)(=O)Nc1ccccc1OC(C)(C)C	ZINC000872352731	FG	On-Demand	Anodyne	PRTN3	54	34
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=Cc2cnc(Cl)c(F)c2)CC1	ZINC000872352733	GF	On-Demand	Reactive	GPR119	47	38
CCC(CCC(F)(F)F)=NNCCc1ccc(OC)cc1	ZINC000872352741	DH	On-Demand	Mild	PPO2	27	42
CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1C(C)C	ZINC000872352840	FH	On-Demand	Anodyne	PKM	44	49
CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1C(C)C	ZINC000872352840	FH	On-Demand	Anodyne	MGAT1	61	37
O=C(c1ccc(C=NNc2cccnn2)cc1)N1CCCC1	ZINC000872352895	CE	On-Demand	Mild	L3MBTL3	49	35
C(=NNc1cccnn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872352953	ED	On-Demand	Mild	LTA4H	43	46
O=C(CCCc1cccs1)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872352969	GG	On-Demand	Reactive	CA5B	30	41
O=C(CCCc1cccs1)NNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872352969	GG	On-Demand	Reactive	CA5A	30	41
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=Cc2ccc(C(F)F)nc2)CC1	ZINC000872353007	GG	On-Demand	Reactive	GPR119	47	38
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1cccnn1)C2	ZINC000872353072	EG	On-Demand	Mild	GPR119	16	44
Cn1cccc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)c1=O	ZINC000872353085	EF	On-Demand	Anodyne	PRTN3	51	32
CCC(=NNC(=O)c1c[nH]nc1C)c1cccc(OC)c1OC	ZINC000872353176	DE	On-Demand	Reactive	KCNK3	44	37
CC(CCc1cccnc1)=NNC(=O)c1cnn(C)c1	ZINC000872353178	CD	On-Demand	Reactive	CHRNA7	41	36
CC(CCc1cccnc1)=NNC(=O)c1cnn(C)c1	ZINC000872353178	CD	On-Demand	Reactive	NAMPT	33	40
CCC(CCC(F)(F)F)=NNC(=O)c1cc(Br)ccc1O	ZINC000872353213	FH	On-Demand	Reactive	PYK	136	52
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=C2CC[C@@H]3C[C@H]23)CC1	ZINC000872353221	EE	On-Demand	Reactive	GPR119	26	41
Cn1cccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1=O	ZINC000872353268	GE	On-Demand	Anodyne	PKM	45	52
O=C(NN=C1CC[C@@H]2C[C@H]12)c1cc(Br)ccc1O	ZINC000872353280	DF	On-Demand	Reactive	PYK	95	42
CC(CCc1cccnc1)=NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000872353325	GF	On-Demand	Mild	NAMPT	31	45
C[C@@H]1COCCN1c1ccc(NS(=O)(=O)c2cnn(C3CCCC3)c2)cc1	ZINC000872353347	GG	On-Demand	Anodyne	MTOR	45	39
O=C(NN=C1CC[C@@H]2C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872353374	CE	On-Demand	Reactive	EPHX2	29	41
CN1CCC(C=NNC(=O)c2cc(Br)ccc2O)CC1	ZINC000872353433	EE	On-Demand	Reactive	PYK	113	47
CC(CCc1cccnc1)=NNS(=O)(=O)CCc1ccccc1	ZINC000872353491	EF	On-Demand	Mild	TBXAS1	62	47
CC(CCc1cccnc1)=NNS(=O)(=O)CCc1ccccc1	ZINC000872353491	EF	On-Demand	Mild	NAMPT	25	48
O=C(NN=C1CCCC2(C1)OCCO2)c1cc(Br)ccc1O	ZINC000872353575	FF	On-Demand	Reactive	PYK	89	39
O=C(NN=C1CCC[C@@H]1F)Nc1ccc(C(=O)O)cc1	ZINC000872353580	CE	On-Demand	Reactive	EPHX2	31	44
O=C(NN=C1CCC[C@@H]1F)Nc1ccc(C(=O)O)cc1	ZINC000872353580	CE	On-Demand	Reactive	DGAT1	15	40
O=C(NN=C1CCC[C@H]1F)Nc1ccc(C(=O)O)cc1	ZINC000872353581	CE	On-Demand	Reactive	EPHX2	31	44
O=C(NN=C1CCC[C@H]1F)Nc1ccc(C(=O)O)cc1	ZINC000872353581	CE	On-Demand	Reactive	DGAT1	15	40
CN1CCC(C=NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872353647	ED	On-Demand	Reactive	F13A1	42	34
CN1CCC(C=NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000872353647	ED	On-Demand	Reactive	P96878_MYCTU	44	36
CS(=O)(=O)c1ccc(NC(=O)NN=C2CCC[C@H]2F)cc1	ZINC000872353664	DE	On-Demand	Reactive	P96878_MYCTU	46	39
CS(=O)(=O)c1ccc(NC(=O)NN=C2CCC[C@@H]2F)cc1	ZINC000872353665	DE	On-Demand	Reactive	P96878_MYCTU	46	39
FC(F)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872353666	CF	On-Demand	Mild	SIGMAR1	22	44
CCC(CCC(F)(F)F)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353701	FG	On-Demand	Reactive	P96878_MYCTU	46	37
CC(CCOCc1ccccc1)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353752	GG	On-Demand	Reactive	PPIA	18	40
CC(CCOCc1ccccc1)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353752	GG	On-Demand	Reactive	CA12	18	40
CC(CCOCc1ccccc1)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353752	GG	On-Demand	Reactive	CA9	17	40
CC(CCOCc1ccccc1)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353752	GG	On-Demand	Reactive	MTCA1	27	40
CC(CCOCc1ccccc1)=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000872353752	GG	On-Demand	Reactive	P96878_MYCTU	37	40
COC1(CS(=O)(=O)NNC(=O)COCc2ccccc2)CCC1	ZINC000872353803	EC	On-Demand	Reactive	SLC12A5	43	38
C[C@@H]1COCCN1c1ccc(NS(=O)(=O)c2c3c(nn2C)CCCC3)cc1	ZINC000872353838	GE	On-Demand	Anodyne	MTOR	45	40
FC(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872353867	DD	On-Demand	Mild	LTA4H	42	49
FC(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872353867	DD	On-Demand	Mild	HRH3	20	42
FC(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872353867	DD	On-Demand	Mild	EPHX2	15	43
FC(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872353867	DD	On-Demand	Mild	PSMB1	42	38
COC(=O)N(C)Cc1ccc(NS(=O)(=O)CC2(OC)CCC2)cc1	ZINC000872353908	FE	On-Demand	Anodyne	PTPRB	55	36
O=C(NN=C1CCCN2CCSC[C@H]12)c1cc(Br)ccc1O	ZINC000872353909	GE	On-Demand	Reactive	PYK	83	38
O=C(NN=C1CCCN2CCSC[C@@H]12)c1cc(Br)ccc1O	ZINC000872353911	GE	On-Demand	Reactive	PYK	83	38
CC(CCc1cccnc1)=NNCC(F)F	ZINC000872353923	BE	On-Demand	Mild	TBXAS1	32	40
CN1CCC(C=NNC(=O)Nc2ccc(C(=O)O)cc2)CC1	ZINC000872353925	DD	On-Demand	Reactive	EPHX2	35	44
CS(=O)(=O)c1ccc(NC(=O)NN=CCCOCC(F)F)cc1	ZINC000872353930	ED	On-Demand	Reactive	P96878_MYCTU	40	35
COC(=O)NCc1ccc(NS(=O)(=O)CC2(OC)CCC2)cc1	ZINC000872353943	ED	On-Demand	Anodyne	PTPRB	57	35
COCCc1nnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872354005	GD	On-Demand	Mild	LTA4H	20	40
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2cnn(C3CCCC3)c2)cc1	ZINC000872354029	GF	On-Demand	Anodyne	PTPRB	41	32
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2cnn(C3CCCC3)c2)cc1	ZINC000872354029	GF	On-Demand	Anodyne	LIMK2	27	40
CS(=O)(=O)c1ccc(NC(=O)NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872354036	FE	On-Demand	Reactive	CA1	17	42
CS(=O)(=O)c1ccc(NC(=O)NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872354036	FE	On-Demand	Reactive	CA9	18	42
CS(=O)(=O)c1ccc(NC(=O)NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872354036	FE	On-Demand	Reactive	IDO1	32	41
CS(=O)(=O)c1ccc(NC(=O)NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872354036	FE	On-Demand	Reactive	MTCA1	44	42
CS(=O)(=O)c1ccc(NC(=O)NN=CC(F)(F)C(F)(F)F)cc1	ZINC000872354036	FE	On-Demand	Reactive	P96878_MYCTU	55	42
CC(=O)N(Cc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1)C(C)C	ZINC000872354058	GG	On-Demand	Clean	LIMK2	21	40
O=C(c1ccc(C=Nn2c(S)nnc2[C@@H]2CCCCO2)cc1)N1CCCC1	ZINC000872354064	GF	On-Demand	Mild	L3MBTL3	45	35
O=C(c1ccc(C=Nn2c(S)nnc2[C@H]2CCCCO2)cc1)N1CCCC1	ZINC000872354065	GF	On-Demand	Mild	L3MBTL3	45	35
CCC(=NNC(=O)c1cc(Br)ccc1O)[C@H]1CCCOC1	ZINC000872354076	FG	On-Demand	Reactive	PYK	116	49
CCC(=NNC(=O)c1cc(Br)ccc1O)[C@@H]1CCCOC1	ZINC000872354077	FG	On-Demand	Reactive	PYK	116	49
CC(=O)N(Cc1ccc(NS(=O)(=O)c2ccc(C)cc2C#N)cc1)C1CC1	ZINC000872354087	GG	On-Demand	Mild	CSNK2A1	52	33
CC(=O)N(Cc1ccc(NS(=O)(=O)c2ccc(C)cc2C#N)cc1)C1CC1	ZINC000872354087	GG	On-Demand	Mild	HIPK2	46	33
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1COCCO1	ZINC000872354090	DE	On-Demand	Reactive	GHSR	40	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1COCCO1	ZINC000872354092	DE	On-Demand	Reactive	GHSR	40	35
COC(=O)CN(c1ccccc1)S(=O)(=O)CCOCC1CCC1	ZINC000872354095	ED	On-Demand	Anodyne	AMY2	45	31
CC(=NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cnccn1	ZINC000872354101	FE	On-Demand	Mild	LTA4H	26	41
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872354137	GG	On-Demand	Reactive	DRD4	21	46
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872354137	GG	On-Demand	Reactive	ACHE	26	44
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872354137	GG	On-Demand	Reactive	LTA4H	28	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872354137	GG	On-Demand	Reactive	SIGMAR1	28	42
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)Nc1ccc(C(=O)O)cc1	ZINC000872354137	GG	On-Demand	Reactive	NOD2	43	36
Cn1ncc(S(=O)(=O)Nc2ccc(OCC(C)(C)O)cc2)c1C(F)(F)F	ZINC000872354140	GE	On-Demand	Anodyne	SGK1	63	37
O=C(NN=C1CCC[C@H]1F)c1cc(Br)ccc1O	ZINC000872354163	DF	On-Demand	Reactive	PYK	94	40
O=C(NN=C1CCC[C@@H]1F)c1cc(Br)ccc1O	ZINC000872354165	DF	On-Demand	Reactive	PYK	94	40
O=C(c1ccc(C=NNS(=O)(=O)CCc2ccccc2)cc1)N1CCCC1	ZINC000872354175	GE	On-Demand	Mild	L3MBTL3	49	36
COC(=O)NCc1ccc(NS(=O)(=O)CCOCC2CCC2)cc1	ZINC000872354198	FE	On-Demand	Anodyne	PTPRB	47	32
CS(=O)(=O)c1ccc(NC(=O)NN=CCCCC2CC2)cc1	ZINC000872354203	DF	On-Demand	Reactive	P96878_MYCTU	46	36
O=C(NN=CC1CC2(C1)OCCO2)c1cc(Br)ccc1O	ZINC000872354223	FE	On-Demand	Reactive	PYK	102	45
CC(C)(C)OC(=O)NCc1cccc(C=NNCC(F)F)c1	ZINC000872354284	DF	On-Demand	Mild	PDS	62	35
COc1ccc(Cn2cc(C=NNCC(F)F)nn2)cc1	ZINC000872354314	CD	On-Demand	Mild	PROKR1	56	33
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2cc(C)ns2)cc1	ZINC000872354319	FE	On-Demand	Anodyne	PTPRB	75	35
CC(=O)N(Cc1ccc(NS(=O)(=O)c2cc(F)cc(C#N)c2)cc1)C(C)C	ZINC000872354320	GG	On-Demand	Mild	LIMK2	26	42
CN1CCC(C=NNC(=O)c2cccc3ccccc23)CC1	ZINC000872354341	CF	On-Demand	Reactive	CNR1	15	41
CN1CCC(C=NNC(=O)c2cccc3ccccc23)CC1	ZINC000872354341	CF	On-Demand	Reactive	CNR2	15	40
CN1CCC(C=NNC(=O)c2cccc3ccccc23)CC1	ZINC000872354341	CF	On-Demand	Reactive	HTR1F	52	33
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2c3c(nn2C)CCCC3)cc1	ZINC000872354349	GE	On-Demand	Anodyne	PTPRB	41	34
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2c3c(nn2C)CCCC3)cc1	ZINC000872354349	GE	On-Demand	Anodyne	LIMK2	31	42
CCC(CCC(F)(F)F)=NNC(=O)c1cccc2ccccc12	ZINC000872354365	DJ	On-Demand	Reactive	KCNJ11	71	35
CCC(CCC(F)(F)F)=NNC(=O)c1cccc2ccccc12	ZINC000872354365	DJ	On-Demand	Reactive	PYK	49	35
COc1cc(C)nc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1	ZINC000872354370	EE	On-Demand	Mild	L3MBTL3	52	34
COCCO[C@H](C)C(=O)NN=Cc1cccc(Cl)c1C	ZINC000872354376	CE	On-Demand	Reactive	ADCYAP1R1	48	35
COCCO[C@@H](C)C(=O)NN=Cc1cccc(Cl)c1C	ZINC000872354377	CE	On-Demand	Reactive	ADCYAP1R1	48	35
O=C(NNS(=O)(=O)c1cnn(C2CCCC2)c1)c1cccc2ccccc12	ZINC000872354380	GF	On-Demand	Reactive	CCR8	44	33
CS(=O)(=O)c1ccc(NC(=O)NN=C2CC[C@@H]3C[C@H]23)cc1	ZINC000872354411	DD	On-Demand	Reactive	P96878_MYCTU	45	36
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)cc1	ZINC000872354427	GF	On-Demand	Anodyne	PTPRB	66	36
CC(CCc1c[nH]c2ccccc12)=NNCC(F)F	ZINC000872354429	CG	On-Demand	Mild	MPO	73	35
Cn1ccnc(NN=CC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354458	GF	On-Demand	Mild	PGC	56	37
Cn1ccnc(NN=CC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354458	GF	On-Demand	Mild	PAPA1_CARPA	29	40
Cn1ccnc(NN=CC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354458	GF	On-Demand	Mild	CTSL	18	40
Cn1ccnc(NN=CC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354458	GF	On-Demand	Mild	REN	70	41
Cn1ccnc(NN=CC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354458	GF	On-Demand	Mild	FPR1	47	36
Cn1ccnc(NN=CC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354460	GF	On-Demand	Mild	PGC	56	37
Cn1ccnc(NN=CC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354460	GF	On-Demand	Mild	PAPA1_CARPA	29	40
Cn1ccnc(NN=CC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354460	GF	On-Demand	Mild	CTSL	18	40
Cn1ccnc(NN=CC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354460	GF	On-Demand	Mild	REN	70	41
Cn1ccnc(NN=CC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1=O	ZINC000872354460	GF	On-Demand	Mild	FPR1	47	36
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1COCCO1	ZINC000872354478	EC	On-Demand	Reactive	L3MBTL3	47	36
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1COCCO1	ZINC000872354485	EC	On-Demand	Reactive	L3MBTL3	47	36
Cn1nc2c(c1C=NNC(=O)c1cccc3ccccc13)CCCC2	ZINC000872354511	EG	On-Demand	Reactive	BCHE	44	32
COC(=O)N(C)Cc1ccc(NS(=O)(=O)CCOCC2CCC2)cc1	ZINC000872354521	FE	On-Demand	Anodyne	PTPRB	51	34
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3COCCO3)nn2)cc1	ZINC000872354641	EC	On-Demand	Reactive	PROKR1	61	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3COCCO3)nn2)cc1	ZINC000872354647	EC	On-Demand	Reactive	PROKR1	61	33
COCCO[C@H](C)C(=O)NN=Cc1cccc2ncccc12	ZINC000872354654	DD	On-Demand	Reactive	PDE10A	17	46
COCCO[C@@H](C)C(=O)NN=Cc1cccc2ncccc12	ZINC000872354656	DD	On-Demand	Reactive	PDE10A	17	46
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2ccc(C(F)F)o2)cc1	ZINC000872354712	FG	On-Demand	Anodyne	PTPRB	58	38
COC(=O)N(C)Cc1ccc(NS(=O)(=O)c2ccc(C(F)F)o2)cc1	ZINC000872354712	FG	On-Demand	Anodyne	LIMK2	29	42
O=C(c1ccc(C=NNCC(F)F)cc1)N1CCCC1	ZINC000872354734	CE	On-Demand	Mild	MLYCD	19	43
O=C(c1ccc(C=NNCC(F)F)cc1)N1CCCC1	ZINC000872354734	CE	On-Demand	Mild	L3MBTL3	71	40
O=C(Cc1ccncc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872354792	EE	On-Demand	Reactive	L3MBTL3	53	35
O=C(Cc1ccncc1)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872354809	EF	On-Demand	Reactive	SIGMAR1	22	42
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354825	ED	On-Demand	Reactive	GCGR	27	44
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354825	ED	On-Demand	Reactive	PDE10A	15	41
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354825	ED	On-Demand	Reactive	ADCYAP1R1	50	40
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354826	ED	On-Demand	Reactive	GCGR	27	44
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354826	ED	On-Demand	Reactive	PDE10A	15	41
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872354826	ED	On-Demand	Reactive	ADCYAP1R1	50	40
Cn1nc2c(c1C=NNC(=O)c1ccc(Cl)cc1F)CCCC2	ZINC000872354834	EF	On-Demand	Reactive	CNR1	50	31
CC(CCc1cccnc1)=NNC(=O)Cc1ccncc1	ZINC000872354863	CE	On-Demand	Reactive	TBXAS1	34	43
CC(CCc1cccnc1)=NNC(=O)Cc1ccncc1	ZINC000872354863	CE	On-Demand	Reactive	PPO2	37	40
CC(CCc1cccnc1)=NNC(=O)Cc1ccncc1	ZINC000872354863	CE	On-Demand	Reactive	NAMPT	22	45
COCCO[C@@H](C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872354874	ED	On-Demand	Reactive	L3MBTL3	46	33
COCCO[C@H](C)C(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872354875	ED	On-Demand	Reactive	L3MBTL3	46	33
O=C(Cc1ccncc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872354925	FD	On-Demand	Reactive	LTA4H	42	45
O=C(Cc1ccncc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872354925	FD	On-Demand	Reactive	EPHX2	20	51
O=C(Cc1ccncc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872354925	FD	On-Demand	Reactive	FLT3	15	42
O=C(Cc1ccncc1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872354925	FD	On-Demand	Reactive	EPHA2	19	42
COc1cc(C)nc(NN=C2CCc3cccc(C(=O)O)c32)n1	ZINC000872354951	DE	On-Demand	Mild	ALS	91	34
COCCO[C@H](C)C(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872354966	DE	On-Demand	Reactive	ADCYAP1R1	49	36
COCCO[C@@H](C)C(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872354968	DE	On-Demand	Reactive	ADCYAP1R1	49	36
COCCO[C@H](C)C(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872354997	EE	On-Demand	Reactive	PDE10A	26	47
COCCO[C@@H](C)C(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872354999	EE	On-Demand	Reactive	PDE10A	26	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1COCCO1	ZINC000872355035	FC	On-Demand	Reactive	LTA4H	28	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1COCCO1	ZINC000872355035	FC	On-Demand	Reactive	EPHX2	20	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1COCCO1	ZINC000872355036	FC	On-Demand	Reactive	LTA4H	28	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1COCCO1	ZINC000872355036	FC	On-Demand	Reactive	EPHX2	20	45
CC(=NN[C@H](C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872355048	CD	On-Demand	Mild	COLA	99	34
CC(=NN[C@@H](C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872355049	CD	On-Demand	Mild	COLA	99	34
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872355066	GE	On-Demand	Reactive	PDE10A	17	40
CCSCc1cccc(NS(=O)(=O)c2cn(C)nc2Br)c1	ZINC000872355068	GG	On-Demand	Anodyne	NR1I2	44	36
COCCO[C@@H](C)C(=O)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872355074	GD	On-Demand	Reactive	PDE10A	19	40
COCCO[C@H](C)C(=O)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872355075	GD	On-Demand	Reactive	PDE10A	19	40
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872355112	GE	On-Demand	Reactive	PDE10A	17	40
COCCO[C@@H](C)C(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872355147	FD	On-Demand	Reactive	PDE10A	25	45
COCCO[C@H](C)C(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872355149	FD	On-Demand	Reactive	PDE10A	25	45
COCCO[C@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872355310	CD	On-Demand	Reactive	PPO2	31	40
COCCO[C@@H](C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872355311	CD	On-Demand	Reactive	PPO2	31	40
Cn1ccnc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c1=O	ZINC000872355353	FC	On-Demand	Mild	LTA4H	26	41
C[C@@H](NC(=S)NN=Cc1cccc(S(N)(=O)=O)c1)C1CC1	ZINC000872355437	EC	On-Demand	Mild	UREA_CANEN	36	40
C[C@H](NC(=S)NN=Cc1cccc(S(N)(=O)=O)c1)C1CC1	ZINC000872355438	EC	On-Demand	Mild	UREA_CANEN	36	40
COCCO[C@@H](C)C(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872355455	DF	On-Demand	Reactive	ADCYAP1R1	49	33
COCCO[C@H](C)C(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872355456	DF	On-Demand	Reactive	ADCYAP1R1	49	33
COCCO[C@H](C)C(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872355466	FC	On-Demand	Reactive	PROKR1	56	33
COCCO[C@@H](C)C(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872355469	FC	On-Demand	Reactive	PROKR1	56	33
CC(CCOCc1ccccc1)=NNC(=O)Cc1ccncc1	ZINC000872355475	DF	On-Demand	Reactive	PPO2	29	40
CN1CCC(C=NNC(=O)Cc2ccncc2)CC1	ZINC000872355477	CD	On-Demand	Reactive	HTR1F	40	35
O=C(NN=C1CCCCc2ccccc2C1)[C@@H]1COCCO1	ZINC000872355508	DD	On-Demand	Reactive	ABAT	15	47
O=C(NN=C1CCCCc2ccccc2C1)[C@H]1COCCO1	ZINC000872355509	DD	On-Demand	Reactive	ABAT	15	47
CN1CCC(C=NNC(=O)c2ccc(Cl)cc2F)CC1	ZINC000872355524	CF	On-Demand	Reactive	HTR1F	40	37
CCC(=NNC(=O)Cc1ccncc1)c1cccc(OC)c1OC	ZINC000872355640	EF	On-Demand	Reactive	KCNK3	48	37
COCCO[C@H](C)C(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872355673	DE	On-Demand	Reactive	GCGR	28	44
COCCO[C@@H](C)C(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872355675	DE	On-Demand	Reactive	GCGR	28	44
Cn1nc2c(c1S(=O)(=O)NNC(=O)c1cccc3ccccc13)CCCC2	ZINC000872355690	GE	On-Demand	Reactive	BCHE	40	32
CC(=NN[C@H](C)CO)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872355739	DE	On-Demand	Mild	COLA	40	33
CC(=NN[C@@H](C)CO)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872355740	DE	On-Demand	Mild	COLA	40	33
COc1ccc(Cn2cc(C=NN[C@H](C)CO)nn2)cc1	ZINC000872355766	CC	On-Demand	Mild	PROKR1	57	34
COc1ccc(Cn2cc(C=NN[C@@H](C)CO)nn2)cc1	ZINC000872355767	CC	On-Demand	Mild	PROKR1	57	34
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	MME	22	41
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	EDNRB	22	40
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	EDNRA	31	40
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	TACR1	26	41
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	CTSL	23	40
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	NMBR	30	43
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	MC5R	48	35
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	GRPR	49	34
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	ECE1	50	40
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	MMP11	60	34
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	CCKBR	43	35
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	GHSR	50	38
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	MMP1	18	41
COCCO[C@@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355784	EF	On-Demand	Reactive	NPR	26	40
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	MME	22	41
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	EDNRB	22	40
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	EDNRA	31	40
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	TACR1	26	41
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	CTSL	23	40
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	NMBR	30	43
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	MC5R	48	35
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	GRPR	49	34
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	ECE1	50	40
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	MMP11	60	34
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	CCKBR	43	35
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	GHSR	50	38
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	MMP1	18	41
COCCO[C@H](C)C(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872355785	EF	On-Demand	Reactive	NPR	26	40
C[C@@H](NC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CC1	ZINC000872355904	EF	On-Demand	Mild	L3MBTL3	73	38
C[C@H](NC(=S)NN=Cc1ccc(C(=O)N2CCCC2)cc1)C1CC1	ZINC000872355905	EF	On-Demand	Mild	L3MBTL3	73	38
Cc1c(C=NN[C@H](C)CO)cccc1[N+](=O)[O-]	ZINC000872355959	BD	On-Demand	Mild	COLA	104	33
Cc1c(C=NN[C@@H](C)CO)cccc1[N+](=O)[O-]	ZINC000872355960	BD	On-Demand	Mild	COLA	104	33
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)CC3)c1C(F)(F)F	ZINC000872355969	FE	On-Demand	Anodyne	PKM	54	53
Cc1ccc([N+](=O)[O-])c(C)c1C=NN[C@H](C)CO	ZINC000872355988	CD	On-Demand	Mild	COLA	47	37
Cc1ccc([N+](=O)[O-])c(C)c1C=NN[C@@H](C)CO	ZINC000872355989	CD	On-Demand	Mild	COLA	47	37
COCCO[C@@H](C)C(=O)NN=C(CCc1ccccc1)c1ccccn1	ZINC000872355990	FF	On-Demand	Reactive	PLM1_PLAFA	44	36
COCCO[C@H](C)C(=O)NN=C(CCc1ccccc1)c1ccccn1	ZINC000872355991	FF	On-Demand	Reactive	PLM1_PLAFA	44	36
COCCO[C@H](C)C(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872356035	DD	On-Demand	Reactive	ADCYAP1R1	43	30
COCCO[C@@H](C)C(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872356036	DD	On-Demand	Reactive	ADCYAP1R1	43	30
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356038	ED	On-Demand	Reactive	GCGR	20	41
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356038	ED	On-Demand	Reactive	PDE10A	18	47
COCCO[C@@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356038	ED	On-Demand	Reactive	ADCYAP1R1	43	38
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356039	ED	On-Demand	Reactive	GCGR	20	41
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356039	ED	On-Demand	Reactive	PDE10A	18	47
COCCO[C@H](C)C(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872356039	ED	On-Demand	Reactive	ADCYAP1R1	43	38
COCCO[C@H](C)C(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872356092	EE	On-Demand	Reactive	ADCYAP1R1	55	33
COCCO[C@@H](C)C(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872356093	EE	On-Demand	Reactive	ADCYAP1R1	55	33
CC(CCOCc1ccccc1)=NNC(=O)c1ccc(C)o1	ZINC000872356146	DG	On-Demand	Reactive	PPO2	39	42
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	ESR1	71	39
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	ESR2	46	39
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	LTA4H	48	48
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	HRH3	26	41
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	EPHX2	15	46
C(=NNC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872356147	ED	On-Demand	Mild	PSMB1	41	37
c1ccc(CN2C[C@H]3C(=NNC4CCOCC4)CC[C@H]3C2)cc1	ZINC000872356192	DF	On-Demand	Mild	SIGMAR1	21	43
O=C(c1ccc(C=NNC2CCOCC2)cc1)N1CCCC1	ZINC000872356199	DE	On-Demand	Mild	L3MBTL3	91	42
Cn1ncc(S(=O)(=O)Nc2cccc(CC(F)(F)F)c2)c1C(F)(F)F	ZINC000872356226	GG	On-Demand	Anodyne	NR1I2	44	34
O=C(c1ccc(C=NNCc2cccc(Cl)c2)cc1)N1CCCC1	ZINC000872356299	EH	On-Demand	Mild	DPP7	25	46
O=C(c1ccc(C=NNCc2cccc(Cl)c2)cc1)N1CCCC1	ZINC000872356299	EH	On-Demand	Mild	L3MBTL3	54	35
O=C(c1ccc(C=NNCc2cccc(Cl)c2)cc1)N1CCCC1	ZINC000872356299	EH	On-Demand	Mild	HPGD	21	44
CCC(=NNC(=O)c1ccc(C)o1)c1cccc(OC)c1OC	ZINC000872356344	DG	On-Demand	Reactive	KCNK3	43	37
COc1ccc(Cn2cc(C=NNC3CCOCC3)nn2)cc1	ZINC000872356412	DD	On-Demand	Mild	PROKR1	48	31
CN1CCC(C=NNc2ccc(C(N)=O)nn2)CC1	ZINC000872356437	CC	On-Demand	Mild	HTR1F	64	34
CC(CCc1c[nH]c2ccccc12)=NNC1CCOCC1	ZINC000872356501	CG	On-Demand	Mild	MPO	39	40
F[C@@H]1CCCC1=NNc1nc(C(F)(F)F)cs1	ZINC000872356509	CG	On-Demand	Mild	MAOB	22	46
F[C@H]1CCCC1=NNc1nc(C(F)(F)F)cs1	ZINC000872356510	CG	On-Demand	Mild	MAOB	22	46
Oc1nc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc2ccccc12	ZINC000872356542	GE	On-Demand	Mild	ESR1	76	38
Oc1nc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc2ccccc12	ZINC000872356542	GE	On-Demand	Mild	ESR2	50	42
Oc1nc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc2ccccc12	ZINC000872356542	GE	On-Demand	Mild	LTA4H	55	48
Oc1nc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc2ccccc12	ZINC000872356542	GE	On-Demand	Mild	HRH3	15	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1nc(O)c3ccccc3n1)C2	ZINC000872356543	GH	On-Demand	Mild	TNKS	41	31
Cn1ncc(S(=O)(=O)Nc2cccc(CC(F)(F)F)c2)c1Br	ZINC000872356566	GG	On-Demand	Anodyne	NR1I2	44	36
Oc1nc(NN=Cc2ccnn2CC2CCC2)nc2ccccc12	ZINC000872356567	DF	On-Demand	Mild	TNKS	56	35
CC(CCc1cccnc1)=NNC(=O)c1ccc(C)o1	ZINC000872356593	CF	On-Demand	Reactive	TBXAS1	33	40
CC(CCc1cccnc1)=NNC(=O)c1ccc(C)o1	ZINC000872356593	CF	On-Demand	Reactive	PPO2	36	40
CC(CCc1cccnc1)=NNC(=O)c1ccc(C)o1	ZINC000872356593	CF	On-Demand	Reactive	NAMPT	18	42
Cn1nc2c(c1C=NNc1nc(O)c3ccccc3n1)CCCC2	ZINC000872356622	DE	On-Demand	Mild	BCHE	49	35
Oc1nc(NN=CCCCC2CC2)nc2ccccc12	ZINC000872356674	CG	On-Demand	Mild	TNKS	40	31
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3cnn(CC4CC4)c3)cc2N1	ZINC000872356706	GG	On-Demand	Anodyne	PKM	40	48
Oc1nc(NN=C2CCC[C@H]2F)nc2ccccc12	ZINC000872356724	CF	On-Demand	Mild	TNKS	52	33
Oc1nc(NN=C2CCC[C@@H]2F)nc2ccccc12	ZINC000872356725	CF	On-Demand	Mild	TNKS	52	33
CC(CCc1cccnc1)=NNc1nccc(N2CCOCC2)n1	ZINC000872356729	EE	On-Demand	Mild	PIK3CA	20	51
CC(CCc1cccnc1)=NNc1nccc(N2CCOCC2)n1	ZINC000872356729	EE	On-Demand	Mild	EPHB4	80	37
COCC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872356749	BC	On-Demand	Reactive	MTNR1B	15	43
COCC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872356749	BC	On-Demand	Reactive	UREA_CANEN	17	40
CNc1ccccc1C=NNc1nccc(N2CCOCC2)n1	ZINC000872356759	DD	On-Demand	Mild	EPHB4	42	33
Oc1c(C=NNc2nccc(N3CCOCC3)n2)ccc(F)c1F	ZINC000872356777	ED	On-Demand	Mild	SMG1	27	40
COCC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872356784	CE	On-Demand	Reactive	PDE10A	26	49
COCC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872356784	CE	On-Demand	Reactive	UREA_CANEN	17	40
c1ccc(CCC(=NNc2nccc(N3CCOCC3)n2)c2ccccn2)cc1	ZINC000872356787	GG	On-Demand	Mild	PIK3CA	25	44
c1ccc(CCC(=NNc2nccc(N3CCOCC3)n2)c2ccccn2)cc1	ZINC000872356787	GG	On-Demand	Mild	EPHB4	55	34
C(=NNc1nccc(N2CCOCC2)n1)c1cnsc1	ZINC000872356789	CD	On-Demand	Mild	SMG1	31	42
CCC(=NNc1nccc(N2CCOCC2)n1)c1cccc(OC)c1OC	ZINC000872356792	FF	On-Demand	Mild	EPHB4	73	36
CCC(=NNc1nccc(N2CCOCC2)n1)c1cccc(OC)c1OC	ZINC000872356792	FF	On-Demand	Mild	ALK	15	44
CCOC(=O)/C=C/c1ccc(C=NNc2nccc(N3CCOCC3)n2)n1C	ZINC000872356795	GD	On-Demand	Mild	EPHB4	45	34
COCCc1ncc(C=NNc2nccc(N3CCOCC3)n2)s1	ZINC000872356811	ED	On-Demand	Mild	EPHB4	61	34
COCC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872356815	CD	On-Demand	Reactive	ADCYAP1R1	49	33
COCC(=O)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872356819	DD	On-Demand	Reactive	ADCYAP1R1	40	34
COCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872356820	CD	On-Demand	Reactive	GCGR	27	45
COCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872356820	CD	On-Demand	Reactive	ADCYAP1R1	49	37
Cn1ncc2cc(C=NNc3nccc(N4CCOCC4)n3)cnc21	ZINC000872356835	ED	On-Demand	Mild	EPHB4	55	35
COCC(=O)NN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872356844	ED	On-Demand	Reactive	TAAR1	18	47
C(=NNc1nccc(N2CCOCC2)n1)c1nc(C2OCCO2)cs1	ZINC000872356849	FD	On-Demand	Mild	SMG1	31	42
COCC(=O)NN=C(C)CCOCc1ccccc1	ZINC000872356854	CD	On-Demand	Reactive	PPO2	36	40
CCOc1cc(F)cc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356855	EE	On-Demand	Mild	EPHB4	65	34
COCC(=O)NN=C1CCCCc2ccccc2C1	ZINC000872356861	CE	On-Demand	Reactive	ABAT	18	55
CC(CCOCc1ccccc1)=NNc1ncccc1[N+](=O)[O-]	ZINC000872356862	DG	On-Demand	Mild	PPIA	35	40
CC(CCc1cncc2ccccc12)=NNc1nccc(N2CCOCC2)n1	ZINC000872356876	GG	On-Demand	Mild	EPHB4	48	34
O=C(NC1CC1)c1cc(F)c(NN=C2CCC[C@@H]2F)c(F)c1	ZINC000872356881	DG	On-Demand	Mild	MAPK13	68	35
O=C(NC1CC1)c1cc(F)c(NN=C2CCC[C@H]2F)c(F)c1	ZINC000872356882	DG	On-Demand	Mild	MAPK13	68	35
COCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872356886	BD	On-Demand	Reactive	NQO2	24	42
COCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872356886	BD	On-Demand	Reactive	MTNR1A	43	41
COCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872356886	BD	On-Demand	Reactive	MTNR1B	37	41
CC(=NNc1nccc(N2CCOCC2)n1)c1cc2c(Cl)nccc2o1	ZINC000872356888	FF	On-Demand	Mild	EPHB4	81	37
CC(=NNc1nccc(N2CCOCC2)n1)c1cccc(O)c1F	ZINC000872356903	ED	On-Demand	Mild	EPHB4	68	35
CC(=NNc1nccc(N2CCOCC2)n1)c1cccc(O)c1F	ZINC000872356903	ED	On-Demand	Mild	STAT6	43	33
CC(=NNc1nccc(N2CCOCC2)n1)c1cccc(O)c1F	ZINC000872356903	ED	On-Demand	Mild	SMG1	37	41
FC(F)(F)C(F)(F)C=NNc1nccc(N2CCOCC2)n1	ZINC000872356923	ED	On-Demand	Mild	SMG1	30	43
CCC(CCC(F)(F)F)=NNc1nccc(N2CCOCC2)n1	ZINC000872356965	EF	On-Demand	Mild	EPHB4	67	35
CCC(CCC(F)(F)F)=NNc1nccc(N2CCOCC2)n1	ZINC000872356965	EF	On-Demand	Mild	SMG1	30	45
C=CCC1(C=NNc2c(F)cc(C(=O)NC3CC3)cc2F)CCOCC1	ZINC000872356969	FH	On-Demand	Mild	MAPK13	54	33
COCC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872356971	DD	On-Demand	Reactive	PDE10A	24	44
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	PIK3CA	33	41
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	JAK2	21	54
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	PIK3CD	28	41
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	PIK3CB	46	41
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	EPHB4	72	35
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	STAT6	51	37
CC(=O)Nc1cccc(C=NNc2nccc(N3CCOCC3)n2)c1	ZINC000872356974	ED	On-Demand	Mild	SMG1	56	46
COCC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872356975	DD	On-Demand	Reactive	SIGMAR1	28	40
Fc1cc(C=NNc2nccc(N3CCOCC3)n2)cnc1Cl	ZINC000872356980	ED	On-Demand	Mild	STAT6	61	33
Fc1cc(C=NNc2nccc(N3CCOCC3)n2)cnc1Cl	ZINC000872356980	ED	On-Demand	Mild	SMG1	29	44
CCOc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2F)cc1C(C)C	ZINC000872356982	GG	On-Demand	Anodyne	TRPV1	68	35
CCOc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2F)cc1C(C)C	ZINC000872356982	GG	On-Demand	Anodyne	MOGAT2	41	34
CC(=NNc1nccc(N2CCOCC2)n1)c1cc(O)ccc1F	ZINC000872356983	ED	On-Demand	Mild	EPHB4	67	35
CC(=NNc1nccc(N2CCOCC2)n1)c1cc(O)ccc1F	ZINC000872356983	ED	On-Demand	Mild	SMG1	29	41
Cc1scc(C=NNc2nccc(N3CCOCC3)n2)c1C	ZINC000872357000	DE	On-Demand	Mild	EPHB4	60	34
Cc1scc(C=NNc2nccc(N3CCOCC3)n2)c1C	ZINC000872357000	DE	On-Demand	Mild	SMG1	29	40
COCC(=O)NN=C(C)CCc1cccnc1	ZINC000872357002	BD	On-Demand	Reactive	TBXAS1	35	42
COCC(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872357006	DC	On-Demand	Reactive	PROKR1	65	36
CCC(=NNC(=O)COC)c1cccc(OC)c1OC	ZINC000872357014	CD	On-Demand	Reactive	KCNK3	43	38
COc1cncc(C=NNc2nccc(N3CCOCC3)n2)c1C	ZINC000872357036	ED	On-Demand	Mild	EPHB4	76	39
O=C(c1ccc(C=NNc2nccc(N3CCOCC3)n2)cc1)N1CCCC1	ZINC000872357067	GD	On-Demand	Mild	PIK3CA	15	41
O=C(c1ccc(C=NNc2nccc(N3CCOCC3)n2)cc1)N1CCCC1	ZINC000872357067	GD	On-Demand	Mild	MTOR	21	41
CN1CCC(C=NNc2nccc(N3CCOCC3)n2)CC1	ZINC000872357079	DD	On-Demand	Mild	EPHB4	53	33
CC(CCOCc1ccccc1)=NNc1nccc(N2CCOCC2)n1	ZINC000872357081	FF	On-Demand	Mild	EPHB4	77	37
O=C(NC1CC1)c1cc(F)c(NN=Cc2cn(C[C@@H]3CCCO3)nn2)c(F)c1	ZINC000872357101	GE	On-Demand	Mild	MAPK13	65	34
O=C(NC1CC1)c1cc(F)c(NN=Cc2cn(C[C@H]3CCCO3)nn2)c(F)c1	ZINC000872357102	GE	On-Demand	Mild	MAPK13	65	34
COCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357116	DC	On-Demand	Reactive	LTA4H	42	44
COCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357116	DC	On-Demand	Reactive	HRH3	17	42
COCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357116	DC	On-Demand	Reactive	EPHX2	20	46
COCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357116	DC	On-Demand	Reactive	FLT3	15	43
COCC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357116	DC	On-Demand	Reactive	PSMB1	41	36
COc1nscc1C=NNc1nccc(N2CCOCC2)n1	ZINC000872357124	DD	On-Demand	Mild	EPHB4	40	32
C(=NNc1nccc(N2CCOCC2)n1)c1cn(C2CC2)cn1	ZINC000872357128	DD	On-Demand	Mild	EPHB4	44	31
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	TACR1	25	41
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	NMBR	24	40
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	MC5R	46	38
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	CCKBR	51	36
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	GHSR	51	37
COCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872357131	CE	On-Demand	Reactive	MMP9	17	44
COCC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872357157	CD	On-Demand	Reactive	UREA_CANEN	17	47
COCC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872357157	CD	On-Demand	Reactive	ADCYAP1R1	40	36
COc1nscc1C=NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000872357163	FF	On-Demand	Mild	MAPK13	69	35
CCC(=NNc1c(F)cc(C(=O)NC2CC2)cc1F)[C@@H]1CCCOC1	ZINC000872357166	FG	On-Demand	Mild	MAPK13	59	32
CCC(=NNc1c(F)cc(C(=O)NC2CC2)cc1F)[C@H]1CCCOC1	ZINC000872357167	FG	On-Demand	Mild	MAPK13	59	32
COCC(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872357189	DD	On-Demand	Reactive	PDE10A	17	45
CC(=NNc1nccc(N2CCOCC2)n1)c1cn(C)cn1	ZINC000872357201	DC	On-Demand	Mild	EPHB4	81	38
COCC(=O)NN=C(C)c1cccc(SC(F)(F)F)c1	ZINC000872357219	DF	On-Demand	Reactive	ABAT	20	41
COCC(=O)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872357225	ED	On-Demand	Reactive	PDE10A	20	40
O=C(NC1CC1)c1cc(F)c(NN=C2CC[C@@H]3C[C@H]23)c(F)c1	ZINC000872357231	DG	On-Demand	Mild	MAPK13	68	34
COCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872357233	CD	On-Demand	Reactive	GCGR	19	42
COCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872357233	CD	On-Demand	Reactive	PDE10A	15	53
COCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872357233	CD	On-Demand	Reactive	ADCYAP1R1	42	35
O=C(NC1CC1)c1cc(F)c(NN=Cc2nc(C3OCCO3)cs2)c(F)c1	ZINC000872357248	GF	On-Demand	Mild	MAPK13	67	34
FC(F)(F)Cc1ccccc1C=NNc1nccc(N2CCOCC2)n1	ZINC000872357256	FF	On-Demand	Mild	SMG1	27	40
COCC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872357260	CD	On-Demand	Reactive	L3MBTL3	62	37
C(=NNc1nccc(N2CCOCC2)n1)c1nncn1Cc1ccccc1	ZINC000872357273	FD	On-Demand	Mild	PIK3CB	15	40
C(=NNc1nccc(N2CCOCC2)n1)c1nncn1Cc1ccccc1	ZINC000872357273	FD	On-Demand	Mild	STAT6	23	42
CCC(=NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCOC1	ZINC000872357284	DD	On-Demand	Mild	EPHB4	64	34
CCC(=NNc1nccc(N2CCOCC2)n1)[C@H]1CCCOC1	ZINC000872357285	DD	On-Demand	Mild	EPHB4	64	34
O=C(NC1CC1)c1cc(F)c(NN=Cc2cn(C3CC3)cn2)c(F)c1	ZINC000872357286	EF	On-Demand	Mild	MAPK13	73	37
c1cc(N2CCOCC2)nc(NN=C(C2CCC2)[C@@H]2CCCO2)n1	ZINC000872357287	EE	On-Demand	Mild	EPHB4	51	33
c1cc(N2CCOCC2)nc(NN=C(C2CCC2)[C@H]2CCCO2)n1	ZINC000872357288	EE	On-Demand	Mild	EPHB4	51	33
CN1CCC(C=NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1	ZINC000872357307	EF	On-Demand	Mild	MAPK13	89	39
CCc1noc(C)c1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872357369	DE	On-Demand	Anodyne	EDNRA	31	45
C[C@H](C#N)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872357378	CE	On-Demand	Mild	L3MBTL3	47	35
N#Cc1ccc(CNN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872357392	EF	On-Demand	Mild	HRH3	15	40
N#Cc1ccc(CNN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872357392	EF	On-Demand	Mild	L3MBTL3	48	35
FC(F)(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357477	EE	On-Demand	Mild	ESR1	41	37
FC(F)(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357477	EE	On-Demand	Mild	LTA4H	40	48
FC(F)(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357477	EE	On-Demand	Mild	HRH3	15	42
FC(F)(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357477	EE	On-Demand	Mild	PSMB1	41	37
COc1ccc(Cn2cc(C=NNC[C@H](C)C#N)nn2)cc1	ZINC000872357523	CD	On-Demand	Mild	PROKR1	56	33
CC(=O)Nc1cccc(C=NOCC(F)(F)F)c1	ZINC000872357531	CF	On-Demand	Mild	KCNK9	40	35
COc1ccc(Cn2cc(C=NNC[C@@H](C)C#N)nn2)cc1	ZINC000872357536	CD	On-Demand	Mild	PROKR1	56	33
C[C@@H](CC#N)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357577	DD	On-Demand	Mild	LTA4H	27	43
C[C@H](C#N)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872357638	DD	On-Demand	Mild	LTA4H	29	44
C[C@@H](CC#N)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872357650	CE	On-Demand	Mild	L3MBTL3	45	35
CCC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000872357716	GD	On-Demand	Reactive	L3MBTL3	41	32
CCC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCOC1	ZINC000872357717	GD	On-Demand	Reactive	L3MBTL3	41	32
CC(=O)Nc1cncc(C(=O)NN=Cc2cccc(OC(C)(C)C)c2)c1	ZINC000872357759	FF	On-Demand	Reactive	ADCYAP1R1	41	37
S=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)Nc1ccccn1	ZINC000872357787	GE	On-Demand	Mild	LTA4H	41	44
COc1ccc(Cn2cc(C=NN[C@H](C)CC#N)nn2)cc1	ZINC000872357839	CD	On-Demand	Mild	PROKR1	64	35
COc1ccc(Cn2cc(C=NN[C@@H](C)CC#N)nn2)cc1	ZINC000872357842	CD	On-Demand	Mild	PROKR1	64	35
CCOc1ccc(S(=O)(=O)Nc2c(F)cccc2CO)cc1C(C)C	ZINC000872357866	FH	On-Demand	Anodyne	LEF	24	44
CC(=O)N[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872357868	GG	On-Demand	Anodyne	CA7	15	40
CC(=O)N[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872357870	GG	On-Demand	Anodyne	CA7	15	40
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CCC[C@@H]1F	ZINC000872357999	ED	On-Demand	Reactive	L3MBTL3	50	33
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CCC[C@H]1F	ZINC000872358000	ED	On-Demand	Reactive	L3MBTL3	50	33
CCc1noc(C)c1NS(=O)(=O)c1ccc2c3c(cccc13)CC2	ZINC000872358028	EH	On-Demand	Anodyne	EDNRA	17	44
O=C(c1ccc(C=NOCC(F)(F)F)cc1)N1CCCC1	ZINC000872358208	DF	On-Demand	Mild	MLYCD	21	48
O=C(c1ccc(C=NOCC(F)(F)F)cc1)N1CCCC1	ZINC000872358208	DF	On-Demand	Mild	L3MBTL3	62	39
C[C@@H](CC#N)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872358256	DF	On-Demand	Mild	PAPA1_CARPA	36	40
Cc1ncc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)s1	ZINC000872358295	FG	On-Demand	Anodyne	PKM	43	53
Cn1ncc(S(=O)(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c1C(F)(F)F	ZINC000872358352	GG	On-Demand	Anodyne	SGK1	40	34
Cc1cccc(CNN=Cc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872358373	DG	On-Demand	Mild	L3MBTL3	52	35
Cc1cccc(CNN=Cc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872358373	DG	On-Demand	Mild	HPGD	41	42
COCCc1ncc(C=NNc2c(F)cc(C(=O)NC3CC3)cc2F)s1	ZINC000872358379	GF	On-Demand	Mild	MAPK13	73	34
O=C(NC1CC1)c1cc(F)c(NN=C[C@@H]2CCC(F)(F)C2)c(F)c1	ZINC000872358390	EH	On-Demand	Mild	MAPK13	65	35
O=C(NC1CC1)c1cc(F)c(NN=C[C@H]2CCC(F)(F)C2)c(F)c1	ZINC000872358392	EH	On-Demand	Mild	MAPK13	65	35
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000872358406	GG	On-Demand	Anodyne	PTPRB	67	37
CC(C)(C)OC(=O)NCc1cccc(C=NOCC(F)(F)F)c1	ZINC000872358413	EH	On-Demand	Mild	PDS	50	37
CC(CCc1c[nH]c2ccccc12)=NOCC(F)(F)F	ZINC000872358423	CI	On-Demand	Mild	TACR1	18	41
CC(CCc1c[nH]c2ccccc12)=NOCC(F)(F)F	ZINC000872358423	CI	On-Demand	Mild	MPO	48	43
COC(=O)c1ccoc1S(=O)(=O)Nc1ccccc1SC(C)C	ZINC000872358433	FG	On-Demand	Anodyne	PRTN3	51	32
Cc1cscc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872358467	FH	On-Demand	Anodyne	PKM	47	57
CCOc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872358470	GF	On-Demand	Mild	PTGDR2	21	41
CS(=O)(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872358471	EC	On-Demand	Mild	LTA4H	42	47
CS(=O)(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872358471	EC	On-Demand	Mild	HRH3	22	48
CS(=O)(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872358471	EC	On-Demand	Mild	EPHX2	17	44
CS(=O)(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872358471	EC	On-Demand	Mild	PSMB1	41	36
O=C(NC1CC1)c1cc(F)c(NN=CCCCCCO)c(F)c1	ZINC000872358474	EF	On-Demand	Mild	MAPK13	66	34
Cc1ccccc1CC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872358476	EF	On-Demand	Reactive	L3MBTL3	56	34
O=C(NC1CC1)c1cc(F)c(NN=C2CCCc3ncccc32)c(F)c1	ZINC000872358481	FG	On-Demand	Mild	MAPK13	76	35
FC(F)(F)CON=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872358574	DG	On-Demand	Mild	SIGMAR1	20	44
CCC(=NNC(=O)c1cc(C)[nH]n1)c1cccc(OC)c1OC	ZINC000872358681	DE	On-Demand	Reactive	KCNK3	44	38
CC(CCc1cccnc1)=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000872358686	GD	On-Demand	Reactive	PTAFR	25	40
CC(CCc1cccnc1)=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000872358686	GD	On-Demand	Reactive	NAMPT	15	40
CC(CCc1cccnc1)=NNC(=O)Cc1ccccc1C	ZINC000872358740	CG	On-Demand	Reactive	TBXAS1	31	40
CC(CCc1cccnc1)=NNC(=O)Cc1ccccc1C	ZINC000872358740	CG	On-Demand	Reactive	NAMPT	26	44
Cc1ccccc1CC(=O)NN=C1CCC[C@H]1F	ZINC000872358831	BF	On-Demand	Reactive	P2RX7	17	43
Cc1ccccc1CC(=O)NN=C1CCC[C@@H]1F	ZINC000872358833	BF	On-Demand	Reactive	P2RX7	17	43
CCn1nc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1C1CC1	ZINC000872358852	EF	On-Demand	Clean	CCR5	58	35
O=C(c1ccc(C=NNCc2ccc(Cl)cc2)cc1)N1CCCC1	ZINC000872358876	EH	On-Demand	Mild	LSS	16	43
O=C(c1ccc(C=NNCc2ccc(Cl)cc2)cc1)N1CCCC1	ZINC000872358876	EH	On-Demand	Mild	DPP7	43	41
O=C(c1ccc(C=NNCc2ccc(Cl)cc2)cc1)N1CCCC1	ZINC000872358876	EH	On-Demand	Mild	L3MBTL3	54	39
CC(CCc1cccnc1)=NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000872358954	FH	On-Demand	Mild	CHRNA7	44	43
CC(CCc1cccnc1)=NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000872358954	FH	On-Demand	Mild	C3AR1	41	43
CC(CCc1cccnc1)=NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000872358954	FH	On-Demand	Mild	MAPK13	77	36
O=C(c1ccc(C=NNCCc2ccccc2F)cc1)N1CCCC1	ZINC000872358955	EG	On-Demand	Mild	SLC6A1	28	41
O=C(c1ccc(C=NNCCc2ccccc2F)cc1)N1CCCC1	ZINC000872358955	EG	On-Demand	Mild	L3MBTL3	48	34
CCOc1ccc(S(=O)(=O)Nc2cc(C(N)=O)ccc2F)cc1C(C)C	ZINC000872358961	GG	On-Demand	Anodyne	CCR2	16	40
CCOc1ccc(S(=O)(=O)Nc2cc(C(N)=O)ccc2F)cc1C(C)C	ZINC000872358961	GG	On-Demand	Anodyne	PTGDR2	34	42
Cn1nc2c(c1C=NNc1c(F)cc(C(=O)NC3CC3)cc1F)CCCC2	ZINC000872359001	FF	On-Demand	Mild	MAPK13	93	37
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(COC(C)(C)C)cc1	ZINC000872359010	FG	On-Demand	Anodyne	PTPRB	68	37
Cn1nc2c(c1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F)CCCC2	ZINC000872359014	GD	On-Demand	Reactive	CNR1	54	34
COC(=O)c1ccoc1S(=O)(=O)Nc1ccccc1CCC(F)(F)F	ZINC000872359022	GG	On-Demand	Anodyne	PRTN3	50	31
O=C(NC1CC1)c1cc(F)c(NN=Cc2cn(C[C@H]3CCOC3)nn2)c(F)c1	ZINC000872359037	GD	On-Demand	Mild	MAPK13	60	34
O=C(NC1CC1)c1cc(F)c(NN=Cc2cn(C[C@@H]3CCOC3)nn2)c(F)c1	ZINC000872359038	GD	On-Demand	Mild	MAPK13	60	34
CCn1nc(NS(=O)(=O)c2cccc(F)c2OC)cc1C1CC1	ZINC000872359059	EF	On-Demand	Anodyne	CCR5	57	35
CC(CCOCc1ccccc1)=NNC(=O)CNC(=O)c1cccnc1	ZINC000872359091	FD	On-Demand	Reactive	TBXAS1	39	40
O=C(NC1CC1)c1cc(F)c(NN=C2CCCC3(C2)OCCO3)c(F)c1	ZINC000872359132	FF	On-Demand	Mild	MAPK13	57	32
O=C(NC1CC1)c1cc(F)c(NN=CCCOCC(F)F)c(F)c1	ZINC000872359135	EF	On-Demand	Mild	MAPK13	67	34
COC1(CS(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)CCC1	ZINC000872359144	FD	On-Demand	Reactive	SLC6A9	42	33
O=C(NC1CC1)c1cc(F)c(NN=CC2CC3(C2)OCCO3)c(F)c1	ZINC000872359147	FE	On-Demand	Mild	MAPK13	59	33
COc1cncc(C=NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C	ZINC000872359198	FG	On-Demand	Mild	MAPK14	26	40
COc1cncc(C=NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C	ZINC000872359198	FG	On-Demand	Mild	MAPK13	75	37
Cn1ncc(S(=O)(=O)Nc2ccc(OC3CCC3)c(F)c2)c1C(F)(F)F	ZINC000872359199	GG	On-Demand	Anodyne	SGK1	41	38
O=C(CNC(=O)c1cccnc1)NN=CCCCC1CC1	ZINC000872359212	CD	On-Demand	Reactive	TBXA2R	24	42
O=C(CNC(=O)c1cccnc1)NN=CCCCC1CC1	ZINC000872359212	CD	On-Demand	Reactive	TBXAS1	54	42
CC(=NNc1c(F)cc(C(=O)NC2CC2)cc1F)c1cn(C)cn1	ZINC000872359216	EE	On-Demand	Mild	MAPK13	95	38
CCOc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872359264	GF	On-Demand	Anodyne	PTGDR	28	40
CCOc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872359264	GF	On-Demand	Anodyne	PTGDR2	23	40
O=C(NC1CC1)c1cc(F)c(NN=C2CCCN3CCSC[C@@H]23)c(F)c1	ZINC000872359269	GF	On-Demand	Mild	MAPK13	58	32
O=C(NC1CC1)c1cc(F)c(NN=C2CCCN3CCSC[C@H]23)c(F)c1	ZINC000872359270	GF	On-Demand	Mild	MAPK13	58	32
CCn1nc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1C1CC1	ZINC000872359271	FH	On-Demand	Anodyne	CCR5	51	34
CC(CCc1c[nH]c2ccccc12)=NNS(C)(=O)=O	ZINC000872359297	CE	On-Demand	Mild	MPO	47	35
CC(CCc1c[nH]c2ccccc12)=NNS(C)(=O)=O	ZINC000872359297	CE	On-Demand	Mild	ALOX15	15	45
CC(CCc1c[nH]c2ccccc12)=NNS(C)(=O)=O	ZINC000872359297	CE	On-Demand	Mild	MMP9	15	44
CCn1nc(NS(=O)(=O)c2cc(F)cc(C#N)c2)cc1C1CC1	ZINC000872359303	EF	On-Demand	Mild	CCR5	52	36
CC(CCc1cccnc1)=NNC(=O)c1ncccc1C	ZINC000872359349	CF	On-Demand	Reactive	TBXAS1	29	40
CCC(=NNC(=O)c1ncccc1C)c1cccc(OC)c1OC	ZINC000872359419	EF	On-Demand	Reactive	KCNK3	43	38
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NOCc1cccnc1)C2	ZINC000872359516	EH	On-Demand	Mild	GPR119	17	41
O=C(c1ccc(C=NNc2ccc(C(F)(F)F)nn2)cc1)N1CCCC1	ZINC000872359529	FG	On-Demand	Mild	MLYCD	18	41
O=C(c1ccc(C=NNc2ccc(C(F)(F)F)nn2)cc1)N1CCCC1	ZINC000872359529	FG	On-Demand	Mild	L3MBTL3	42	33
Brc1cnn(N=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872359535	GE	On-Demand	Mild	LTA4H	40	46
Brc1cnn(N=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872359535	GE	On-Demand	Mild	EPHA2	16	44
Brc1cnn(N=Cc2ccc(OCCN3CCOCC3)cc2)c1	ZINC000872359535	GE	On-Demand	Mild	MKNK1	23	43
C(=NOCc1cccnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359553	EE	On-Demand	Mild	ESR1	40	35
C(=NOCc1cccnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359553	EE	On-Demand	Mild	LTA4H	51	52
C(=NNC1=N[C@@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359560	FD	On-Demand	Mild	LTA4H	44	43
C(=NNC1=N[C@@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359560	FD	On-Demand	Mild	HRH3	20	40
C(=NNC1=N[C@@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359560	FD	On-Demand	Mild	TBK1	15	41
C(=NNC1=N[C@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359561	FD	On-Demand	Mild	LTA4H	44	43
C(=NNC1=N[C@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359561	FD	On-Demand	Mild	HRH3	20	40
C(=NNC1=N[C@H]2CCCC[C@@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359561	FD	On-Demand	Mild	TBK1	15	41
C(=NNC1=N[C@@H]2CCCC[C@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359562	FD	On-Demand	Mild	LTA4H	44	43
C(=NNC1=N[C@@H]2CCCC[C@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359562	FD	On-Demand	Mild	HRH3	20	40
C(=NNC1=N[C@@H]2CCCC[C@H]2N1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872359562	FD	On-Demand	Mild	TBK1	15	41
CN1CCC(C=NOCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872359564	DH	On-Demand	Mild	SLC6A5	30	42
CC(CCc1cccnc1)=NOCc1cccnc1	ZINC000872359671	CG	On-Demand	Mild	TBXAS1	24	42
O=C(c1ccc(C=NOCc2cccnc2)cc1)N1CCCC1	ZINC000872359720	DF	On-Demand	Mild	L3MBTL3	42	33
O=C(c1ccc(C=NOCc2cccnc2)cc1)N1CCCC1	ZINC000872359720	DF	On-Demand	Mild	NAMPT	21	52
O=C(c1ccc(C=NNC2=N[C@@H]3CCCC[C@@H]3N2)cc1)N1CCCC1	ZINC000872359725	EE	On-Demand	Mild	L3MBTL3	73	39
O=C(c1ccc(C=NNC2=N[C@@H]3CCCC[C@H]3N2)cc1)N1CCCC1	ZINC000872359726	EE	On-Demand	Mild	L3MBTL3	73	39
O=C(c1ccc(C=NNC2=N[C@H]3CCCC[C@@H]3N2)cc1)N1CCCC1	ZINC000872359727	EE	On-Demand	Mild	L3MBTL3	73	39
COCCc1ncc(C=NNC(=O)c2ncccc2C)s1	ZINC000872359780	DD	On-Demand	Reactive	MAP1	41	35
O=C(c1ccc(C=Nn2cc(Br)cn2)cc1)N1CCCC1	ZINC000872359987	EF	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=Nn2cc(Br)cn2)cc1)N1CCCC1	ZINC000872359987	EF	On-Demand	Mild	L3MBTL3	55	37
O=C(c1ccc(C=NNc2ncc(F)cn2)cc1)N1CCCC1	ZINC000872360137	DE	On-Demand	Mild	L3MBTL3	77	42
Fc1cnc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360167	ED	On-Demand	Mild	LTA4H	42	48
Fc1cnc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360167	ED	On-Demand	Mild	HRH3	15	41
Fc1cnc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360167	ED	On-Demand	Mild	STAT6	52	34
CC(C)(C)OC(=O)NCc1cccc(C=NNc2ncc(F)cn2)c1	ZINC000872360205	EG	On-Demand	Mild	PDS	56	35
O=C(c1ccc(C=NOc2ccccc2C(F)(F)F)cc1)N1CCCC1	ZINC000872360215	FI	On-Demand	Mild	MLYCD	19	42
O=C(c1ccc(C=NOc2ccccc2C(F)(F)F)cc1)N1CCCC1	ZINC000872360215	FI	On-Demand	Mild	L3MBTL3	68	37
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	LTA4H	43	43
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	HRH3	26	46
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	EPHX2	23	48
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	FLT3	18	42
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	PSMB1	42	38
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)nc1	ZINC000872360226	FD	On-Demand	Mild	TBK1	15	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3scnc3C3CC3)cc2N1	ZINC000872360237	GH	On-Demand	Anodyne	PKM	38	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3ccc4c(c3)COC4)cc2N1	ZINC000872360265	GG	On-Demand	Anodyne	PKM	54	63
COC1(CS(=O)(=O)Nc2cccc(-c3cn[nH]c3)c2)CCC1	ZINC000872360378	DE	On-Demand	Anodyne	ROCK2	70	37
O=C(c1ccc(C=NO[C@H]2CCCCO2)cc1)N1CCCC1	ZINC000872360381	DF	On-Demand	Mild	L3MBTL3	94	45
O=C(c1ccc(C=NO[C@@H]2CCCCO2)cc1)N1CCCC1	ZINC000872360382	DF	On-Demand	Mild	L3MBTL3	94	45
CC(CCc1c[nH]c2ccccc12)=NO[C@H]1CCCCO1	ZINC000872360425	CI	On-Demand	Mild	CCKAR	17	40
CC(CCc1c[nH]c2ccccc12)=NO[C@H]1CCCCO1	ZINC000872360425	CI	On-Demand	Mild	MC5R	27	40
CC(CCc1c[nH]c2ccccc12)=NO[C@H]1CCCCO1	ZINC000872360425	CI	On-Demand	Mild	CCKBR	33	40
CC(CCc1c[nH]c2ccccc12)=NO[C@@H]1CCCCO1	ZINC000872360426	CI	On-Demand	Mild	CCKAR	17	40
CC(CCc1c[nH]c2ccccc12)=NO[C@@H]1CCCCO1	ZINC000872360426	CI	On-Demand	Mild	MC5R	27	40
CC(CCc1c[nH]c2ccccc12)=NO[C@@H]1CCCCO1	ZINC000872360426	CI	On-Demand	Mild	CCKBR	33	40
O=S(=O)(Nc1cccc(-c2cn[nH]c2)c1)c1cnn(C2CCCC2)c1	ZINC000872360631	FG	On-Demand	Anodyne	MTNN	40	30
COc1ccc(Cn2cc(C=NNCCOCC(F)(F)F)nn2)cc1	ZINC000872360684	FD	On-Demand	Mild	PROKR1	54	32
C(=NO[C@@H]1CCCCO1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872360778	CD	On-Demand	Mild	PDE8B	45	33
C(=NO[C@H]1CCCCO1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872360780	CD	On-Demand	Mild	PDE8B	45	33
C(=NO[C@@H]1CCCCO1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872360782	CD	On-Demand	Mild	PDE8B	45	33
C(=NO[C@H]1CCCCO1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872360783	CD	On-Demand	Mild	PDE8B	45	33
C=CCC1(C=NNc2ccc(C(=O)O)cn2)CCOCC1	ZINC000872360864	CF	On-Demand	Mild	HCAR3	15	51
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)nc1	ZINC000872360900	FG	On-Demand	Mild	SIGMAR1	26	40
COc1ccc(Cn2cc(C=NN3CC(=O)N(C)C3=O)nn2)cc1	ZINC000872360959	EC	On-Demand	Mild	PROKR1	48	31
COCCc1ncc(C=NNC(=O)CSc2ccccc2OC)s1	ZINC000872360971	FF	On-Demand	Reactive	PDE10A	23	56
CCCOc1ccc(NS(=O)(=O)N=S(=O)(CC)CC)cc1	ZINC000872360997	EF	On-Demand	Anodyne	FAAH	20	40
C=CCC1(C=NNC(=O)CSc2ccccc2OC)CCOCC1	ZINC000872361027	EG	On-Demand	Reactive	PDE10A	15	52
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CELA1	17	41
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	PGC	57	38
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CMA1	31	41
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CTRA_BOVIN	17	41
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	PAPA1_CARPA	43	44
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CCKAR	40	45
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CTSK	25	48
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	CTSL	33	44
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	REN	70	42
CC(C)(C)OC(=O)N[C@H](CC=NN1CCCC1=O)Cc1ccccc1	ZINC000872361040	EG	On-Demand	Mild	FPR1	52	42
C(=NO[C@@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361067	EE	On-Demand	Mild	ESR1	65	35
C(=NO[C@@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361067	EE	On-Demand	Mild	ESR2	41	35
C(=NO[C@@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361067	EE	On-Demand	Mild	LTA4H	46	45
C(=NO[C@@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361067	EE	On-Demand	Mild	HRH3	26	43
C(=NO[C@@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361067	EE	On-Demand	Mild	PSMB1	44	38
C(=NO[C@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361069	EE	On-Demand	Mild	ESR1	65	35
C(=NO[C@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361069	EE	On-Demand	Mild	ESR2	41	35
C(=NO[C@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361069	EE	On-Demand	Mild	LTA4H	46	45
C(=NO[C@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361069	EE	On-Demand	Mild	HRH3	26	43
C(=NO[C@H]1CCCCO1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872361069	EE	On-Demand	Mild	PSMB1	44	38
O=C(c1ccc(C=NNCCOCC(F)(F)F)cc1)N1CCCC1	ZINC000872361111	EE	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=NNCCOCC(F)(F)F)cc1)N1CCCC1	ZINC000872361111	EE	On-Demand	Mild	L3MBTL3	42	34
CN(C)CCOc1ccc(NS(=O)(=O)N=[S@](C)(=O)c2ccccc2)cc1	ZINC000872361155	GE	On-Demand	Anodyne	ESRRG	50	38
CN(C)CCOc1ccc(NS(=O)(=O)N=[S@@](C)(=O)c2ccccc2)cc1	ZINC000872361156	GE	On-Demand	Anodyne	ESRRG	50	38
COC(=O)c1ccoc1S(=O)(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000872361164	FD	On-Demand	Anodyne	ESRRG	44	33
CC(CCc1cccnc1)=NN(C)C(N)=O	ZINC000872361211	BD	On-Demand	Reactive	TBXAS1	30	45
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	HTR1D	25	47
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	HTR1B	16	47
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	TACR1	23	41
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	MPO	51	42
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	NMBR	18	40
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	MC5R	54	36
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	MMP11	50	33
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	GHSR	49	38
CC(CCc1c[nH]c2ccccc12)=NN(C)C(N)=O	ZINC000872361213	CE	On-Demand	Reactive	MC1R	45	40
CC(CCc1cccnc1)=NNC(=O)CCCNC(=O)OC(C)(C)C	ZINC000872361218	EF	On-Demand	Reactive	PTAFR	30	42
O=C(c1ccc(C=NN2CCCC2=O)cc1)N1CCCC1	ZINC000872361306	CD	On-Demand	Mild	MLYCD	20	46
O=C(c1ccc(C=NN2CCCC2=O)cc1)N1CCCC1	ZINC000872361306	CD	On-Demand	Mild	L3MBTL3	59	40
O=C1CCCN1N=Cc1cn(C[C@H]2CCCO2)nn1	ZINC000872361399	CC	On-Demand	Mild	PDE8B	43	34
O=C1CCCN1N=Cc1cn(C[C@@H]2CCCO2)nn1	ZINC000872361400	CC	On-Demand	Mild	PDE8B	43	34
O=C(c1ccc(C=NN2CCc3ccccc3C2=O)cc1)N1CCCC1	ZINC000872361468	EF	On-Demand	Mild	L3MBTL3	55	35
COCCc1ncc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)s1	ZINC000872361473	GD	On-Demand	Reactive	UL54	44	34
O=C(c1ccc(C=NN2C(=O)CNC2=O)cc1)N1CCCC1	ZINC000872361503	DC	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=NN2C(=O)CNC2=O)cc1)N1CCCC1	ZINC000872361503	DC	On-Demand	Mild	L3MBTL3	59	39
COc1ccc(Cn2cc(C=NN3CCCC3=O)nn2)cc1	ZINC000872361567	CD	On-Demand	Mild	PROKR1	58	32
COc1cccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c1O	ZINC000872361595	EE	On-Demand	Anodyne	CCR4	23	40
O=C1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361611	DD	On-Demand	Mild	ESR1	60	36
O=C1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361611	DD	On-Demand	Mild	ESR2	41	36
O=C1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361611	DD	On-Demand	Mild	LTA4H	43	46
O=C1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361611	DD	On-Demand	Mild	HRH3	25	42
O=C1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361611	DD	On-Demand	Mild	PSMB1	43	38
O=C(c1ccc(C=Nn2cnnc2O)cc1)N1CCCC1	ZINC000872361654	CD	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=Nn2cnnc2O)cc1)N1CCCC1	ZINC000872361654	CD	On-Demand	Mild	L3MBTL3	55	37
NC(=O)CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872361773	CC	On-Demand	Mild	L3MBTL3	66	39
Oc1nncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361777	DC	On-Demand	Mild	ESR1	67	38
Oc1nncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361777	DC	On-Demand	Mild	ESR2	44	38
Oc1nncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361777	DC	On-Demand	Mild	LTA4H	42	45
Oc1nncn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872361777	DC	On-Demand	Mild	PSMB1	41	38
COc1ccc(Cn2cc(C=NNC(=S)NCCSC)nn2)cc1	ZINC000872361965	FD	On-Demand	Mild	PROKR1	58	35
O=C(CO)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872362042	CC	On-Demand	Reactive	SIGMAR1	31	43
O=C(CO)NN=C1CCCc2c(F)cccc21	ZINC000872362060	BC	On-Demand	Reactive	ABAT	15	49
O=C(CO)NN=C1CCCCc2ccccc2C1	ZINC000872362075	BD	On-Demand	Reactive	ABAT	25	60
CCC(C)(C)OCc1ccccc1NS(=O)(=O)c1occc1C(=O)OC	ZINC000872362105	GH	On-Demand	Anodyne	PRTN3	52	33
CC(CCOCc1ccccc1)=NNC(=O)CO	ZINC000872362113	CD	On-Demand	Reactive	PPO2	38	42
CCC(=NNc1cccc(S(C)(=O)=O)c1)c1cccc(OC)c1OC	ZINC000872362114	FG	On-Demand	Mild	KCNK3	45	39
O=C(c1ccc(C=NN[C@@H]2C[C@H]3CC[C@H]2C3)cc1)N1CCCC1	ZINC000872362158	DG	On-Demand	Mild	L3MBTL3	77	40
O=C(c1ccc(C=NN[C@H]2C[C@H]3CC[C@H]2C3)cc1)N1CCCC1	ZINC000872362159	DG	On-Demand	Mild	L3MBTL3	77	40
COC1(CS(=O)(=O)Nc2ccc3sc(C)nc3c2)CCC1	ZINC000872362181	EF	On-Demand	Anodyne	ACOX1	45	33
C(=NOC1CCCC1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872362184	CD	On-Demand	Mild	PDE8B	47	34
C(=NOC1CCCC1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872362185	CD	On-Demand	Mild	PDE8B	47	34
O=C(CO)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872362202	CC	On-Demand	Reactive	MLYCD	17	40
O=C(CO)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872362202	CC	On-Demand	Reactive	L3MBTL3	75	40
CS(=O)(=O)c1cccc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000872362222	FF	On-Demand	Mild	L3MBTL3	48	33
NC(=O)CON=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872362251	CD	On-Demand	Mild	SIGMAR1	27	42
CC(CCc1cccnc1)=NNc1cccc(S(C)(=O)=O)c1	ZINC000872362261	DF	On-Demand	Mild	NAMPT	37	47
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	TACR1	25	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	NMBR	38	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	MC5R	45	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	CCKBR	42	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	GHSR	52	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CO	ZINC000872362280	CD	On-Demand	Reactive	MMP9	18	46
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	HTR1D	20	46
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	TACR1	21	40
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MPO	28	43
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	NMBR	16	41
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MC3R	52	37
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MC5R	72	37
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MMP11	67	33
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	CCKBR	40	36
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	GHSR	50	39
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MMP9	15	43
CC(CCc1c[nH]c2ccccc12)=NOCC(N)=O	ZINC000872362341	CD	On-Demand	Mild	MC1R	66	37
CC(CCc1cccnc1)=NOC1CCCC1	ZINC000872362357	BG	On-Demand	Mild	FKBP1A	15	42
CC(CCc1cccnc1)=NOC1CCCC1	ZINC000872362357	BG	On-Demand	Mild	TBXAS1	16	41
CC(CCc1cccnc1)=NOC1CCCC1	ZINC000872362357	BG	On-Demand	Mild	C3AR1	39	40
O=C(c1ccc(C=NOC2CCCC2)cc1)N1CCCC1	ZINC000872362379	CG	On-Demand	Mild	PREP	15	40
O=C(c1ccc(C=NOC2CCCC2)cc1)N1CCCC1	ZINC000872362379	CG	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NOC2CCCC2)cc1)N1CCCC1	ZINC000872362379	CG	On-Demand	Mild	L3MBTL3	97	47
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	ESR1	56	36
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	LTA4H	47	46
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	HRH3	20	44
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	EPHX2	22	48
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	FLT3	15	45
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	EPHA2	17	42
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	PSMB1	41	36
O=C(CO)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362390	DB	On-Demand	Reactive	MKNK1	23	42
CC(C)(C)OC(=O)NCc1cccc(C=Nn2ccccc2=O)c1	ZINC000872362424	EF	On-Demand	Mild	PDS	41	31
O=c1ccccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362444	ED	On-Demand	Mild	ESR1	55	37
O=c1ccccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362444	ED	On-Demand	Mild	KCNH2	19	43
O=c1ccccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362444	ED	On-Demand	Mild	LTA4H	54	51
O=c1ccccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362444	ED	On-Demand	Mild	HRH3	25	47
O=c1ccccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362444	ED	On-Demand	Mild	PSMB1	41	38
Cn1cnc(-c2ccc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)cc2)n1	ZINC000872362458	FE	On-Demand	Anodyne	SGK1	59	48
CCC(=NNC(=O)CO)c1cccc(OC)c1OC	ZINC000872362493	CC	On-Demand	Reactive	KCNK3	44	39
CC(CCc1cccnc1)=NOCC(N)=O	ZINC000872362510	BC	On-Demand	Mild	TBXAS1	39	45
COc1ccc(Cn2cc(C=NN3CCCNC3=O)nn2)cc1	ZINC000872362513	DD	On-Demand	Mild	PROKR1	42	31
COC[C@@H](C)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872362604	DF	On-Demand	Mild	PDS	63	34
COC[C@H](C)NN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872362606	DF	On-Demand	Mild	PDS	63	34
CC(CCc1cccnc1)=NNC(=O)CO	ZINC000872362646	BC	On-Demand	Reactive	TBXAS1	42	45
CC(CCc1cccnc1)=NNC(=O)CO	ZINC000872362646	BC	On-Demand	Reactive	NAMPT	25	46
NC(=O)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362664	DC	On-Demand	Mild	ESR1	54	36
NC(=O)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362664	DC	On-Demand	Mild	LTA4H	46	46
NC(=O)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362664	DC	On-Demand	Mild	HRH3	28	47
NC(=O)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362664	DC	On-Demand	Mild	EPHX2	16	46
NC(=O)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872362664	DC	On-Demand	Mild	PSMB1	41	36
COCCc1ncc(C=NNc2ccccc2C(=O)OC)s1	ZINC000872362722	DF	On-Demand	Mild	FAS	20	42
COC[C@@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362768	CG	On-Demand	Mild	TACR1	19	42
COC[C@@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362768	CG	On-Demand	Mild	MPO	16	42
COC[C@@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362768	CG	On-Demand	Mild	NMBR	22	41
COC[C@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362769	CG	On-Demand	Mild	TACR1	19	42
COC[C@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362769	CG	On-Demand	Mild	MPO	16	42
COC[C@H](C)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872362769	CG	On-Demand	Mild	NMBR	22	41
COC[C@H](C)NN=Cc1cccc(NC(C)=O)c1	ZINC000872362809	BD	On-Demand	Mild	MTNR1B	15	42
COC[C@@H](C)NN=Cc1cccc(NC(C)=O)c1	ZINC000872362810	BD	On-Demand	Mild	MTNR1B	15	42
CN1CCC(C=NNc2cc(Cl)ccn2)CC1	ZINC000872362916	CE	On-Demand	Mild	HRH4	19	40
COc1ccc(Cn2cc(C=NNC3CCS(=O)(=O)CC3)nn2)cc1	ZINC000872362918	FC	On-Demand	Mild	PROKR1	54	32
C[S@](=O)Cc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)c(F)c1	ZINC000872362945	GH	On-Demand	Anodyne	PRTN3	54	33
C[S@@](=O)Cc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)c(F)c1	ZINC000872362946	GH	On-Demand	Anodyne	PRTN3	54	33
O=C(c1ccc(C=NNC2CCS(=O)(=O)CC2)cc1)N1CCCC1	ZINC000872362964	ED	On-Demand	Mild	L3MBTL3	87	41
O=S1(=O)CCC(NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872363003	GC	On-Demand	Mild	ESR1	47	39
O=S1(=O)CCC(NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872363003	GC	On-Demand	Mild	LTA4H	38	43
COC[C@@H](C)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872363101	DF	On-Demand	Mild	SIGMAR1	18	42
COC[C@H](C)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872363102	DF	On-Demand	Mild	SIGMAR1	18	42
O=C(c1ccc(C=NN2CCCNC2=O)cc1)N1CCCC1	ZINC000872363108	DD	On-Demand	Mild	MLYCD	18	41
O=C(c1ccc(C=NN2CCCNC2=O)cc1)N1CCCC1	ZINC000872363108	DD	On-Demand	Mild	L3MBTL3	59	38
Cc1noc(C2CC2)c1NS(=O)(=O)c1cc(Cl)cnc1Cl	ZINC000872363142	EG	On-Demand	Anodyne	EDNRA	22	41
O=S1(=O)CCC(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)CC1	ZINC000872363168	FE	On-Demand	Mild	SIGMAR1	15	41
Cc1cc(C)c(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cc1O	ZINC000872363226	GH	On-Demand	Anodyne	PKM	47	56
COC[C@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363238	DD	On-Demand	Mild	LTA4H	37	46
COC[C@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363238	DD	On-Demand	Mild	HRH3	17	40
COC[C@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363238	DD	On-Demand	Mild	PSMB1	41	41
COC[C@@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363239	DD	On-Demand	Mild	LTA4H	37	46
COC[C@@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363239	DD	On-Demand	Mild	HRH3	17	40
COC[C@@H](C)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363239	DD	On-Demand	Mild	PSMB1	41	41
O=C(c1ccc(C=NN2Cc3ccccc3C2=O)cc1)N1CCCC1	ZINC000872363257	EF	On-Demand	Mild	L3MBTL3	55	35
O=C1c2ccccc2CN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363281	FE	On-Demand	Mild	LTA4H	44	47
COC[C@@H](C)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872363368	DD	On-Demand	Mild	PROKR1	55	33
COC[C@H](C)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872363369	DD	On-Demand	Mild	PROKR1	55	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3cnn(C(F)F)c3)cc2N1	ZINC000872363376	GG	On-Demand	Anodyne	PKM	43	50
CC(C)(C)OC(=O)NCC(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872363387	EF	On-Demand	Reactive	GCGR	20	40
COC[C@@H](C)NN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872363404	EF	On-Demand	Mild	TAAR1	16	43
COC[C@H](C)NN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872363405	EF	On-Demand	Mild	TAAR1	16	43
COC[C@@H](C)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872363416	CD	On-Demand	Mild	L3MBTL3	55	36
COC[C@H](C)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872363419	CD	On-Demand	Mild	L3MBTL3	55	36
O=C1NCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363425	ED	On-Demand	Mild	LTA4H	40	45
O=C1NCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363425	ED	On-Demand	Mild	HRH3	19	41
O=C1NCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872363425	ED	On-Demand	Mild	PSMB1	41	36
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)C(F)F)c1	ZINC000872363541	EE	On-Demand	Reactive	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)C(F)F)c1	ZINC000872363541	EE	On-Demand	Reactive	ADCYAP1R1	41	36
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)C(F)F)c1	ZINC000872363541	EE	On-Demand	Reactive	PDS	62	35
C(=NN=c1cc[nH]cc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872363604	ED	On-Demand	Mild	ESR1	49	37
C(=NN=c1cc[nH]cc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872363604	ED	On-Demand	Mild	LTA4H	44	49
C(=NN=c1cc[nH]cc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872363604	ED	On-Demand	Mild	HRH3	18	42
C(=NN=c1cc[nH]cc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872363604	ED	On-Demand	Mild	PSMB1	41	37
COCC(=O)N1CCc2cc(NS(=O)(=O)c3cccc(F)c3OC)ccc21	ZINC000872363628	GE	On-Demand	Anodyne	EIF2AK3	49	43
c1ccc(CN2C[C@H]3C(=NN=c4cc[nH]cc4)CC[C@H]3C2)cc1	ZINC000872363646	DF	On-Demand	Mild	SIGMAR1	21	45
CCC(=NNC(=O)C(F)F)c1cccc(OC)c1OC	ZINC000872363700	CE	On-Demand	Reactive	KCNK3	55	38
CCC(=NNC(=O)C(F)F)c1cccc(OC)c1OC	ZINC000872363700	CE	On-Demand	Reactive	KCNK9	42	38
CN1Cc2cc(NS(=O)(=O)c3cnn(C)c3C(F)(F)F)ccc2NC1=O	ZINC000872363703	GE	On-Demand	Anodyne	BRD4	20	68
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	MME	22	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	TACR1	28	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	CCKAR	42	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	MPO	74	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	BRS3	26	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	NMBR	36	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	MC5R	58	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	ECE1	43	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	MMP11	44	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	CCKBR	52	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	GHSR	57	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	MC1R	55	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(F)F	ZINC000872363773	CF	On-Demand	Reactive	NPR	26	40
COC(=O)c1cccc(NN=C2CCN(C)[C@H]2C)c1	ZINC000872363911	CD	On-Demand	Mild	DRD4	41	32
COC(=O)c1cccc(NN=C2CCN(C)[C@@H]2C)c1	ZINC000872363912	CD	On-Demand	Mild	DRD4	41	32
Fc1cc(NN=Cc2ccc(OCCN3CCOCC3)cc2)ccn1	ZINC000872363920	EE	On-Demand	Mild	LTA4H	31	42
Fc1cc(NN=Cc2ccc(OCCN3CCOCC3)cc2)ccn1	ZINC000872363920	EE	On-Demand	Mild	EPHX2	15	40
Fc1cc(NN=Cc2ccc(OCCN3CCOCC3)cc2)ccn1	ZINC000872363920	EE	On-Demand	Mild	EPHA2	16	40
CN1Cc2cc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)ccc2NC1=O	ZINC000872363945	GE	On-Demand	Anodyne	BRD4	20	63
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ccnc(F)c1)C2	ZINC000872363977	EH	On-Demand	Mild	GPR119	24	41
COc1cccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c1F	ZINC000872364141	EF	On-Demand	Anodyne	CCR4	26	42
COc1ccc(Cn2cc(C=NN[C@@H]3CCO[C@@H](C)C3)nn2)cc1	ZINC000872364295	ED	On-Demand	Mild	PROKR1	47	31
COc1ccc(Cn2cc(C=NN[C@H]3CCO[C@H](C)C3)nn2)cc1	ZINC000872364296	ED	On-Demand	Mild	PROKR1	47	31
COc1ccc(Cn2cc(C=NN[C@@H]3CCO[C@H](C)C3)nn2)cc1	ZINC000872364297	ED	On-Demand	Mild	PROKR1	47	31
COc1ccc(Cn2cc(C=NN[C@H]3CCO[C@@H](C)C3)nn2)cc1	ZINC000872364298	ED	On-Demand	Mild	PROKR1	47	31
C[C@H]1C[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)CCO1	ZINC000872364376	ED	On-Demand	Mild	ESR1	57	38
C[C@H]1C[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)CCO1	ZINC000872364376	ED	On-Demand	Mild	LTA4H	29	42
C[C@@H]1C[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)CCO1	ZINC000872364377	ED	On-Demand	Mild	ESR1	57	38
C[C@@H]1C[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)CCO1	ZINC000872364377	ED	On-Demand	Mild	LTA4H	29	42
COc1ccc(Cn2cc(C=NNCCOC(C)C)nn2)cc1	ZINC000872364581	DD	On-Demand	Mild	PROKR1	62	34
Cn1ncc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1C1CC1	ZINC000872364685	GG	On-Demand	Anodyne	PKM	38	46
CC(CCc1c[nH]c2ccccc12)=NNCCOC(C)C	ZINC000872364756	CG	On-Demand	Mild	MPO	28	40
CC(CCc1c[nH]c2ccccc12)=NNCCOC(C)C	ZINC000872364756	CG	On-Demand	Mild	NMBR	24	42
CC(CCc1c[nH]c2ccccc12)=NNCCOC(C)C	ZINC000872364756	CG	On-Demand	Mild	GHSR	41	36
CC(CCc1c[nH]c2ccccc12)=NNCCOC(C)C	ZINC000872364756	CG	On-Demand	Mild	MMP9	15	40
C[C@@H]1C[C@H](NN=Cc2ccc(C(=O)N3CCCC3)cc2)CCO1	ZINC000872364928	DE	On-Demand	Mild	L3MBTL3	67	38
C[C@H]1C[C@H](NN=Cc2ccc(C(=O)N3CCCC3)cc2)CCO1	ZINC000872364929	DE	On-Demand	Mild	L3MBTL3	67	38
Cn1ncc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)c1C1CC1	ZINC000872364978	FH	On-Demand	Anodyne	SFRP1	41	34
CC(C)(C)CCNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872365046	CD	On-Demand	Mild	CA2	18	40
CC(CCc1cccnc1)=NNC(=O)C(F)F	ZINC000872365073	BD	On-Demand	Reactive	TBXAS1	37	43
CC(CCc1cccnc1)=NNC(=O)C(F)F	ZINC000872365073	BD	On-Demand	Reactive	PTAFR	29	40
CC(CCc1cccnc1)=NNC(=O)C(F)F	ZINC000872365073	BD	On-Demand	Reactive	C3AR1	39	40
CC(CCc1cccnc1)=NNC(=O)C(F)F	ZINC000872365073	BD	On-Demand	Reactive	PPO2	31	40
CC(CCc1cccnc1)=NNC(=O)C(F)F	ZINC000872365073	BD	On-Demand	Reactive	NAMPT	27	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(F)F	ZINC000872365082	CD	On-Demand	Reactive	MLYCD	18	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(F)F	ZINC000872365082	CD	On-Demand	Reactive	L3MBTL3	62	39
CC(CCc1cccnc1)=NNCCC(C)(C)C	ZINC000872365099	BG	On-Demand	Mild	TBXAS1	32	40
Cn1ncc(S(=O)(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1C(F)(F)F	ZINC000872365136	GE	On-Demand	Anodyne	PKM	41	48
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	ESR1	66	38
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	ESR2	43	38
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	LTA4H	45	46
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	HRH3	20	45
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	EPHX2	21	48
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	FLT3	15	47
NC(=O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872365142	DB	On-Demand	Mild	PSMB1	41	36
CC(CCc1cccnc1)=NNC1CC1	ZINC000872365158	BE	On-Demand	Mild	TBXAS1	23	40
CC(CCc1cccnc1)=NNC1CC1	ZINC000872365158	BE	On-Demand	Mild	CHRNA7	41	36
CC(CCc1cccnc1)=NNC1CC1	ZINC000872365158	BE	On-Demand	Mild	C3AR1	40	42
CC(C)(C)OC(=O)CCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872365160	EF	On-Demand	Mild	L3MBTL3	40	33
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)F	ZINC000872365183	ED	On-Demand	Reactive	ESR1	45	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)F	ZINC000872365183	ED	On-Demand	Reactive	LTA4H	40	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)F	ZINC000872365183	ED	On-Demand	Reactive	HRH3	21	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)F	ZINC000872365183	ED	On-Demand	Reactive	EPHX2	23	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)F	ZINC000872365183	ED	On-Demand	Reactive	PSMB1	41	35
O=C(c1ccc(C=NOCc2ccc(F)cc2)cc1)N1CCCC1	ZINC000872365214	EH	On-Demand	Mild	L3MBTL3	52	37
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	HTR1D	15	47
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MME	16	40
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	TACR1	23	41
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	CCKAR	38	40
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MPO	51	44
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	BRS3	24	41
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	NMBR	31	42
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MC3R	52	38
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MC5R	72	38
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	ECE1	34	40
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MMP11	56	35
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	CCKBR	54	35
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	GHSR	56	41
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	MC1R	77	38
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	NPR	26	40
CC(CCc1c[nH]c2ccccc12)=NNCC(N)=O	ZINC000872365222	CD	On-Demand	Mild	KISS1R	41	30
CCC(=NNCC(N)=O)c1cccc(OC)c1OC	ZINC000872365255	CC	On-Demand	Mild	KCNK3	43	38
O=C(c1ccc(C=NNC2CC2)cc1)N1CCCC1	ZINC000872365272	CE	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NNC2CC2)cc1)N1CCCC1	ZINC000872365272	CE	On-Demand	Mild	L3MBTL3	101	47
N#Cc1ccc(NN=Cc2cn(C[C@H]3CCOC3)nn2)cc1Cl	ZINC000872365278	EE	On-Demand	Mild	MAP3K8	49	34
N#Cc1ccc(NN=Cc2cn(C[C@@H]3CCOC3)nn2)cc1Cl	ZINC000872365279	EE	On-Demand	Mild	MAP3K8	49	34
COc1ccc(Cn2cc(C=NNCCC(=O)OC(C)(C)C)nn2)cc1	ZINC000872365337	FD	On-Demand	Mild	PROKR1	67	37
CC(CCc1c[nH]c2ccccc12)=NNC1CC1	ZINC000872365355	BG	On-Demand	Mild	HTR1B	25	44
CC(CCc1c[nH]c2ccccc12)=NNC1CC1	ZINC000872365355	BG	On-Demand	Mild	MPO	39	44
CC(CCc1c[nH]c2ccccc12)=NNC1CC1	ZINC000872365355	BG	On-Demand	Mild	MC5R	28	40
CC(CCc1c[nH]c2ccccc12)=NNC1CC1	ZINC000872365355	BG	On-Demand	Mild	CCKBR	46	37
COc1ccc(Cn2cc(C=NNC3CC3)nn2)cc1	ZINC000872365373	CD	On-Demand	Mild	PROKR1	56	33
CC(C)(C)CCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872365395	DG	On-Demand	Mild	L3MBTL3	61	37
c1ccc(CN2C[C@H]3C(=NNC4CC4)CC[C@H]3C2)cc1	ZINC000872365407	CF	On-Demand	Mild	SIGMAR1	30	47
CCC(=NNC1CC1)c1cccc(OC)c1OC	ZINC000872365411	BF	On-Demand	Mild	DRD2	18	40
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(F)F	ZINC000872365466	DE	On-Demand	Reactive	SIGMAR1	32	41
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	ESR1	73	40
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	ESR2	47	40
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	LTA4H	51	49
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	HRH3	29	42
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	EPHX2	15	47
C(=NNC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872365469	CD	On-Demand	Mild	PSMB1	42	37
CC(CCOCc1ccccc1)=NNC(=O)C(F)F	ZINC000872365508	CE	On-Demand	Reactive	CAPN2	46	33
CC(CCOCc1ccccc1)=NNC(=O)C(F)F	ZINC000872365508	CE	On-Demand	Reactive	PPO2	34	40
CC(CCc1cccnc1)=NNCCC(=O)OC(C)(C)C	ZINC000872365547	CF	On-Demand	Mild	TBXAS1	42	42
CC(CCc1cccnc1)=NNCCC(=O)OC(C)(C)C	ZINC000872365547	CF	On-Demand	Mild	NAMPT	18	42
COc1ccc(Cn2cc(C=NNCCC(C)(C)C)nn2)cc1	ZINC000872365609	DF	On-Demand	Mild	PROKR1	67	36
NS(=O)(=O)c1cccc(C=NNC2CC2)c1	ZINC000872365618	BC	On-Demand	Mild	CA2	16	44
NS(=O)(=O)c1cccc(C=NNC2CC2)c1	ZINC000872365618	BC	On-Demand	Mild	CAH_METTE	26	40
COc1cccc(C)c1NS(=O)(=O)c1cc(C)ns1	ZINC000872365653	CF	On-Demand	Anodyne	CCR4	44	36
COc1ccc(Cn2cc(C=NNCC(C)(C)S(C)(=O)=O)nn2)cc1	ZINC000872365673	FD	On-Demand	Mild	PROKR1	63	34
COc1ccc(Cn2cc(C=NN[C@H]3CCOC(C)(C)C3)nn2)cc1	ZINC000872365728	EE	On-Demand	Mild	PROKR1	47	31
COc1ccc(Cn2cc(C=NN[C@@H]3CCOC(C)(C)C3)nn2)cc1	ZINC000872365729	EE	On-Demand	Mild	PROKR1	47	31
C(=NOC1CCCCC1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872365752	CE	On-Demand	Mild	PDE8B	46	34
C(=NOC1CCCCC1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872365753	CE	On-Demand	Mild	PDE8B	46	34
CC(=O)Nc1cccc(C=NOCCC(F)(F)F)c1	ZINC000872365780	CF	On-Demand	Mild	KCNK3	53	33
CC(=O)Nc1cccc(C=NOCCC(F)(F)F)c1	ZINC000872365780	CF	On-Demand	Mild	KCNK9	52	32
O=C(c1ccc(C=NN[C@H]2CCCOC2)cc1)N1CCCC1	ZINC000872365781	DE	On-Demand	Mild	L3MBTL3	79	40
O=C(c1ccc(C=NN[C@@H]2CCCOC2)cc1)N1CCCC1	ZINC000872365782	DE	On-Demand	Mild	L3MBTL3	79	40
COCCc1ncc(C=NNC(=O)c2ccc(C)c(F)c2)s1	ZINC000872365963	DF	On-Demand	Reactive	ADCYAP1R1	71	35
CC(CCc1c[nH]c2ccccc12)=NOCCC(F)(F)F	ZINC000872366014	CI	On-Demand	Mild	TACR1	15	41
CC(CCc1c[nH]c2ccccc12)=NOCCC(F)(F)F	ZINC000872366014	CI	On-Demand	Mild	MPO	27	42
O=C(c1ccc(C=NOCCC(F)(F)F)cc1)N1CCCC1	ZINC000872366069	DG	On-Demand	Mild	MLYCD	20	46
O=C(c1ccc(C=NOCCC(F)(F)F)cc1)N1CCCC1	ZINC000872366069	DG	On-Demand	Mild	L3MBTL3	57	37
C(=NN[C@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366186	ED	On-Demand	Mild	ESR1	76	37
C(=NN[C@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366186	ED	On-Demand	Mild	ESR2	49	37
C(=NN[C@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366186	ED	On-Demand	Mild	LTA4H	47	45
C(=NN[C@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366186	ED	On-Demand	Mild	HRH3	27	41
C(=NN[C@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366186	ED	On-Demand	Mild	PSMB1	41	36
C(=NN[C@@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366187	ED	On-Demand	Mild	ESR1	76	37
C(=NN[C@@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366187	ED	On-Demand	Mild	ESR2	49	37
C(=NN[C@@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366187	ED	On-Demand	Mild	LTA4H	47	45
C(=NN[C@@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366187	ED	On-Demand	Mild	HRH3	27	41
C(=NN[C@@H]1CCCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366187	ED	On-Demand	Mild	PSMB1	41	36
NC(=O)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872366230	CC	On-Demand	Mild	SIGMAR1	29	43
FC(F)CON=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872366277	CG	On-Demand	Mild	SIGMAR1	23	45
C(=NOC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366573	ED	On-Demand	Mild	ESR1	76	39
C(=NOC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366573	ED	On-Demand	Mild	ESR2	49	39
C(=NOC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366573	ED	On-Demand	Mild	LTA4H	51	49
C(=NOC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366573	ED	On-Demand	Mild	HRH3	27	45
C(=NOC1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872366573	ED	On-Demand	Mild	PSMB1	42	37
FC(F)(F)CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872366599	EF	On-Demand	Mild	LTA4H	39	48
FC(F)(F)CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872366599	EF	On-Demand	Mild	HRH3	15	42
FC(F)(F)CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872366599	EF	On-Demand	Mild	PSMB1	41	37
CC(CCc1cccnc1)=NOC1CCCCC1	ZINC000872366603	BH	On-Demand	Mild	FKBP1A	15	41
CC(CCc1cccnc1)=NOC1CCCCC1	ZINC000872366603	BH	On-Demand	Mild	TBXAS1	16	40
CC(CCc1cccnc1)=NOC1CCCCC1	ZINC000872366603	BH	On-Demand	Mild	C3AR1	40	42
O=C(c1ccc(C=NOC2CCCCC2)cc1)N1CCCC1	ZINC000872366614	DH	On-Demand	Mild	PREP	15	40
O=C(c1ccc(C=NOC2CCCCC2)cc1)N1CCCC1	ZINC000872366614	DH	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=NOC2CCCCC2)cc1)N1CCCC1	ZINC000872366614	DH	On-Demand	Mild	L3MBTL3	93	48
CC(CCc1c[nH]c2ccccc12)=NNCC(F)(F)F	ZINC000872366695	CH	On-Demand	Mild	MPO	57	43
O=C(c1ccc(C=NOC2CCOCC2)cc1)N1CCCC1	ZINC000872366701	DE	On-Demand	Mild	L3MBTL3	86	43
CC(CCc1cccnc1)=NNCC(N)=O	ZINC000872366720	BC	On-Demand	Mild	TBXAS1	52	46
CC(CCc1cccnc1)=NNCC(N)=O	ZINC000872366720	BC	On-Demand	Mild	NAMPT	34	46
c1ccc(CN2C[C@H]3C(=NOC4CCOCC4)CC[C@H]3C2)cc1	ZINC000872366760	DG	On-Demand	Mild	SIGMAR1	19	44
CC(C)(C)OC(=O)NCc1cccc(C=NNCC(F)(F)F)c1	ZINC000872366821	EG	On-Demand	Mild	PDS	51	36
COC(=O)c1ccoc1S(=O)(=O)Nc1cccc2c1OC(C)(C)C2	ZINC000872366826	FF	On-Demand	Anodyne	G2YM83_BOTF4	30	43
CC(CCOCc1ccccc1)=NNCC(N)=O	ZINC000872366832	BD	On-Demand	Mild	PPO2	37	42
O=C(c1ccc(C=NOCC(F)F)cc1)N1CCCC1	ZINC000872366904	CF	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=NOCC(F)F)cc1)N1CCCC1	ZINC000872366904	CF	On-Demand	Mild	L3MBTL3	63	39
COc1ccc(Cn2cc(C=NNCC(F)(F)F)nn2)cc1	ZINC000872367018	DD	On-Demand	Mild	PROKR1	55	33
O=C(c1ccc(C=NNCC(F)(F)F)cc1)N1CCCC1	ZINC000872367126	CE	On-Demand	Mild	MLYCD	21	48
O=C(c1ccc(C=NNCC(F)(F)F)cc1)N1CCCC1	ZINC000872367126	CE	On-Demand	Mild	L3MBTL3	70	39
CC(CCc1cccnc1)=NNCC(C)(C)S(C)(=O)=O	ZINC000872367144	CD	On-Demand	Mild	TBXAS1	41	39
CC(CCc1cccnc1)=NNCC(C)(C)S(C)(=O)=O	ZINC000872367144	CD	On-Demand	Mild	NAMPT	27	45
NC(=O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367240	CC	On-Demand	Mild	MLYCD	17	40
NC(=O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367240	CC	On-Demand	Mild	L3MBTL3	71	40
CCC(CC)CNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872367272	CD	On-Demand	Mild	CA2	21	40
CCC(CC)CNN=Cc1cccc(S(N)(=O)=O)c1	ZINC000872367272	CD	On-Demand	Mild	CA1	15	40
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H]1CCOC1	ZINC000872367308	ED	On-Demand	Reactive	LEF	19	43
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H]1CCOC1	ZINC000872367310	ED	On-Demand	Reactive	LEF	19	43
NC(=O)CNN=C1CCCCc2ccccc2C1	ZINC000872367331	BD	On-Demand	Mild	ABAT	17	50
FC(F)(F)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872367401	DG	On-Demand	Mild	SIGMAR1	20	44
CC(CCc1c[nH]c2ccccc12)=NOCC(F)F	ZINC000872367403	CH	On-Demand	Mild	MPO	57	34
CCC(CC)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367491	DG	On-Demand	Mild	L3MBTL3	61	37
FC(F)(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367517	ED	On-Demand	Mild	LTA4H	41	48
FC(F)(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367517	ED	On-Demand	Mild	HRH3	15	42
FC(F)(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367517	ED	On-Demand	Mild	EPHX2	16	47
FC(F)(F)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367517	ED	On-Demand	Mild	PSMB1	41	37
FC(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367552	DE	On-Demand	Mild	ESR1	55	37
FC(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367552	DE	On-Demand	Mild	LTA4H	39	48
FC(F)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872367552	DE	On-Demand	Mild	PSMB1	41	37
CC(CCOCc1ccccc1)=NNC(=O)C(C)(C)O	ZINC000872367624	CD	On-Demand	Reactive	PPO2	34	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	TACR1	25	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	NMBR	78	33
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	GRPR	43	32
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	CCKBR	58	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	GHSR	52	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)C(C)(C)O	ZINC000872367672	CE	On-Demand	Reactive	MMP9	15	44
CCC(=NNc1ncncc1Cl)c1cccc(OC)c1OC	ZINC000872367693	DG	On-Demand	Mild	PDE6A	42	33
O=C(NCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367723	FF	On-Demand	Reactive	PREP	22	48
O=C(NCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367723	FF	On-Demand	Reactive	L3MBTL3	63	40
O=C(NCc1ccccc1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872367723	FF	On-Demand	Reactive	NAMPT	20	51
COc1ccc(Cn2cc(C=NNC3CCCCC3)nn2)cc1	ZINC000872367725	DF	On-Demand	Mild	PROKR1	54	32
CC(CCc1cccnc1)=NNC1CCCCC1	ZINC000872367794	BG	On-Demand	Mild	FKBP1A	15	40
CC(CCc1cccnc1)=NNC1CCCCC1	ZINC000872367794	BG	On-Demand	Mild	TBXAS1	17	41
CC(CCc1cccnc1)=NNC1CCCCC1	ZINC000872367794	BG	On-Demand	Mild	C3AR1	46	47
COc1cc(C=NNC(=O)C(C)(C)O)c(Cl)cc1O	ZINC000872367806	CD	On-Demand	Reactive	GCGR	22	45
COc1cc(C=NNC(=O)C(C)(C)O)c(Cl)cc1O	ZINC000872367806	CD	On-Demand	Reactive	ADCYAP1R1	44	37
O=C(c1ccc(C=NNc2ncncc2Cl)cc1)N1CCCC1	ZINC000872367864	EF	On-Demand	Mild	L3MBTL3	40	33
CN1CCC(C=NNC(=O)NCc2ccccc2)CC1	ZINC000872367966	CD	On-Demand	Reactive	SIGMAR1	16	42
CC(CCc1cccnc1)=NNC(=O)N1CCN(C)CC1	ZINC000872367979	CD	On-Demand	Reactive	CHRNA7	43	35
CC(CCc1cccnc1)=NNC(=O)N1CCN(C)CC1	ZINC000872367979	CD	On-Demand	Reactive	C3AR1	40	41
CC(CCc1cccnc1)=NNC(=O)C(C)(C)O	ZINC000872368193	BD	On-Demand	Reactive	TBXAS1	42	44
CC(CCc1cccnc1)=NNC(=O)C(C)(C)O	ZINC000872368193	BD	On-Demand	Reactive	NAMPT	23	43
COc1cc(C=NNC(=O)[C@H]2CCO[C@@H]2c2ccccc2)c(Cl)cc1O	ZINC000872368201	FG	On-Demand	Reactive	GCGR	22	42
COc1cc(C=NNC(=O)[C@H]2CCO[C@@H]2c2ccccc2)c(Cl)cc1O	ZINC000872368201	FG	On-Demand	Reactive	ADCYAP1R1	44	35
C(=NOC[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872368305	ED	On-Demand	Mild	LTA4H	39	45
C(=NOC[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872368305	ED	On-Demand	Mild	HRH3	15	40
C(=NOC[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872368306	ED	On-Demand	Mild	LTA4H	39	45
C(=NOC[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872368306	ED	On-Demand	Mild	HRH3	15	40
O=C(c1ccc(C=NOC[C@H]2CCOC2)cc1)N1CCCC1	ZINC000872368312	DE	On-Demand	Mild	L3MBTL3	83	41
O=C(c1ccc(C=NOC[C@@H]2CCOC2)cc1)N1CCCC1	ZINC000872368313	DE	On-Demand	Mild	L3MBTL3	83	41
CN1CCN(C(=O)NN=Cc2cnc3c(F)cccc3c2)CC1	ZINC000872368353	DD	On-Demand	Reactive	HRH4	15	40
CCC(=NNC(=O)C(C)(C)O)c1cccc(OC)c1OC	ZINC000872368365	CD	On-Demand	Reactive	KCNK3	43	38
COc1ccc(Cn2cc(C=NNC[C@@H](O)C(F)(F)F)nn2)cc1	ZINC000872368431	ED	On-Demand	Mild	PROKR1	55	32
COc1ccc(Cn2cc(C=NNC[C@H](O)C(F)(F)F)nn2)cc1	ZINC000872368432	ED	On-Demand	Mild	PROKR1	55	32
O=C(NCc1ccccc1)NN=CCCOCC(F)F	ZINC000872368580	CE	On-Demand	Reactive	PDS	51	34
O=C(c1ccc(C=NNC2CCCCC2)cc1)N1CCCC1	ZINC000872368586	CG	On-Demand	Mild	EPHX2	18	49
O=C(c1ccc(C=NNC2CCCCC2)cc1)N1CCCC1	ZINC000872368586	CG	On-Demand	Mild	MLYCD	18	41
O=C(c1ccc(C=NNC2CCCCC2)cc1)N1CCCC1	ZINC000872368586	CG	On-Demand	Mild	L3MBTL3	96	47
CN1CCN(C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000872368619	ED	On-Demand	Reactive	L3MBTL3	67	45
NS(=O)(=O)c1cccc(C=NNC2CCCCC2)c1	ZINC000872368637	CD	On-Demand	Mild	CA7	18	41
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	ESR1	73	37
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	ESR2	47	37
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	LTA4H	35	43
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	HRH3	18	42
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	EPHX2	21	45
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	FLT3	16	43
CN1CCN(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CC1	ZINC000872368668	GC	On-Demand	Reactive	PSMB1	40	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCN(C)CC1	ZINC000872368683	EE	On-Demand	Reactive	HTR1D	52	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCN(C)CC1	ZINC000872368683	EE	On-Demand	Reactive	HTR1B	45	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCN(C)CC1	ZINC000872368683	EE	On-Demand	Reactive	TACR1	25	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCN(C)CC1	ZINC000872368683	EE	On-Demand	Reactive	MC5R	38	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)N1CCN(C)CC1	ZINC000872368683	EE	On-Demand	Reactive	GHSR	48	39
CC(=O)Nc1cccc(C=NNC(=O)N2CCN(C)CC2)c1	ZINC000872368708	DC	On-Demand	Reactive	HTR1B	17	41
CN1CCN(C(=O)NN=Cc2c[nH]c3c(F)cc(Cl)cc23)CC1	ZINC000872368722	EE	On-Demand	Reactive	HRH4	17	47
COc1ccc(Cn2cc(C=NNC(=O)N3CCN(C)CC3)nn2)cc1	ZINC000872368782	FC	On-Demand	Reactive	PROKR1	57	35
Cc1cccc(C(=O)NNS(=O)(=O)CCC2CCCCC2)n1	ZINC000872368882	ED	On-Demand	Reactive	BMP1	76	36
COC(=O)Cn1ncc(NS(=O)(=O)c2ccc(C(C)(C)C)c(F)c2)c1C	ZINC000872368930	GF	On-Demand	Anodyne	PRTN3	50	30
COc1cc(C=NNC(=O)N2CCN(C)CC2)c(Cl)cc1O	ZINC000872368954	ED	On-Demand	Reactive	GCGR	21	42
COc1cc(C=NNC(=O)N2CCN(C)CC2)c(Cl)cc1O	ZINC000872368954	ED	On-Demand	Reactive	ADCYAP1R1	41	35
CN1CCN(C(=O)NN=Cc2cc3c([nH]2)CCCC3)CC1	ZINC000872368978	CD	On-Demand	Reactive	HRH4	21	53
C(=NNc1nc2ccccn2n1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872369039	FD	On-Demand	Mild	LTA4H	57	51
C(=NNc1nc2ccccn2n1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872369039	FD	On-Demand	Mild	PSMB1	40	36
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCOC1	ZINC000872369112	DD	On-Demand	Reactive	L3MBTL3	77	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCOC1	ZINC000872369113	DD	On-Demand	Reactive	L3MBTL3	77	40
CC(CCc1c[nH]c2ccccc12)=NNC[C@H](O)C(F)(F)F	ZINC000872369190	DF	On-Demand	Mild	TACR1	15	43
CC(CCc1c[nH]c2ccccc12)=NNC[C@H](O)C(F)(F)F	ZINC000872369190	DF	On-Demand	Mild	MPO	37	40
CC(CCc1c[nH]c2ccccc12)=NNC[C@@H](O)C(F)(F)F	ZINC000872369191	DF	On-Demand	Mild	TACR1	15	43
CC(CCc1c[nH]c2ccccc12)=NNC[C@@H](O)C(F)(F)F	ZINC000872369191	DF	On-Demand	Mild	MPO	37	40
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCO[C@@H]3C(C)(C)C)nn2)cc1	ZINC000872369218	GE	On-Demand	Reactive	PROKR1	56	33
CC(C)n1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872369258	GG	On-Demand	Anodyne	PKM	41	50
COc1cc(F)ccc1NN=C1CCCc2ncccc21	ZINC000872369305	CG	On-Demand	Mild	GRIN2B	20	40
COc1cc(C=NNC(=O)[C@@H]2CCOC2)c(Cl)cc1O	ZINC000872369326	CD	On-Demand	Reactive	GCGR	15	40
COc1cc(C=NNC(=O)[C@H]2CCOC2)c(Cl)cc1O	ZINC000872369327	CD	On-Demand	Reactive	GCGR	15	40
O[C@@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369365	FD	On-Demand	Mild	LTA4H	32	44
O[C@@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369365	FD	On-Demand	Mild	EPHX2	17	48
O[C@@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369365	FD	On-Demand	Mild	PSMB1	40	36
O[C@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369366	FD	On-Demand	Mild	LTA4H	32	44
O[C@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369366	FD	On-Demand	Mild	EPHX2	17	48
O[C@H](CNN=Cc1ccc(OCCN2CCOCC2)cc1)C(F)(F)F	ZINC000872369366	FD	On-Demand	Mild	PSMB1	40	36
O=C(NN=Cc1ccnn1CC1CCC1)c1ccc(O)c(O)c1	ZINC000872369382	DD	On-Demand	Reactive	GCGR	39	40
O=C(NN=Cc1ccnn1CC1CCC1)c1ccc(O)c(O)c1	ZINC000872369382	DD	On-Demand	Reactive	ADCYAP1R1	78	35
Cn1ccnc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872369404	ED	On-Demand	Mild	LTA4H	35	44
COCCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872369410	DD	On-Demand	Mild	LTA4H	33	45
COCCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872369410	DD	On-Demand	Mild	HRH3	24	42
COCCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872369410	DD	On-Demand	Mild	EPHX2	15	43
Cn1nc2c(c1C=NNC(=O)c1ccc(O)c(O)c1)CCCC2	ZINC000872369421	DD	On-Demand	Reactive	ADCYAP1R1	75	34
O=C(NN=Cc1cc2c([nH]1)CCCC2)c1ccc(O)c(O)c1	ZINC000872369428	CE	On-Demand	Reactive	ADCYAP1R1	74	34
O=C(c1ccc(C=NNCCC(F)(F)F)cc1)N1CCCC1	ZINC000872369429	DF	On-Demand	Mild	MLYCD	20	45
O=C(c1ccc(C=NNCCC(F)(F)F)cc1)N1CCCC1	ZINC000872369429	DF	On-Demand	Mild	L3MBTL3	56	37
Cc1cccc(C(=O)NN=Cc2cn(C[C@H]3CCCO3)nn2)n1	ZINC000872369439	DC	On-Demand	Reactive	PDE8B	42	34
Cc1cccc(C(=O)NN=Cc2cn(C[C@@H]3CCCO3)nn2)n1	ZINC000872369440	DC	On-Demand	Reactive	PDE8B	42	34
O=C(NN=CCCOCC(F)F)c1ccc(O)c(O)c1	ZINC000872369441	CD	On-Demand	Reactive	ADCYAP1R1	78	35
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@H]1CCCOC1	ZINC000872369448	EE	On-Demand	Reactive	PREP	15	40
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@H]1CCCOC1	ZINC000872369448	EE	On-Demand	Reactive	CAPN2	60	37
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@H]1CCCOC1	ZINC000872369448	EE	On-Demand	Reactive	NPR	61	34
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@@H]1CCCOC1	ZINC000872369450	EE	On-Demand	Reactive	PREP	15	40
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@@H]1CCCOC1	ZINC000872369450	EE	On-Demand	Reactive	CAPN2	60	37
CCC(=NNC(=O)CNC(=O)OCc1ccccc1)[C@@H]1CCCOC1	ZINC000872369450	EE	On-Demand	Reactive	NPR	61	34
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	KLK3	49	34
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	CTSB	40	44
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	CTSK	24	44
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	CAPNS1	54	33
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	CAPN1	65	40
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	CAPN2	102	40
O=C(CNC(=O)OCc1ccccc1)NN=CC(F)(F)C(F)(F)F	ZINC000872369454	FE	On-Demand	Reactive	NPR	68	38
O=C(c1ccc(C=NNC[C@@H](O)C(F)(F)F)cc1)N1CCCC1	ZINC000872369455	ED	On-Demand	Mild	MLYCD	20	46
O=C(c1ccc(C=NNC[C@@H](O)C(F)(F)F)cc1)N1CCCC1	ZINC000872369455	ED	On-Demand	Mild	L3MBTL3	49	35
O=C(c1ccc(C=NNC[C@H](O)C(F)(F)F)cc1)N1CCCC1	ZINC000872369457	ED	On-Demand	Mild	MLYCD	20	46
O=C(c1ccc(C=NNC[C@H](O)C(F)(F)F)cc1)N1CCCC1	ZINC000872369457	ED	On-Demand	Mild	L3MBTL3	49	35
Cc1cccc(C(=O)NN=CC2CCN(C)CC2)n1	ZINC000872369460	CD	On-Demand	Reactive	HTR1F	72	35
COCCCNN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872369464	DD	On-Demand	Mild	PROKR1	63	34
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCOC1	ZINC000872369474	CD	On-Demand	Reactive	CHRNA7	42	35
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCOC1	ZINC000872369474	CD	On-Demand	Reactive	NAMPT	30	40
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCOC1	ZINC000872369475	CD	On-Demand	Reactive	CHRNA7	42	35
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCOC1	ZINC000872369475	CD	On-Demand	Reactive	NAMPT	30	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	ESR1	60	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	ESR2	40	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	LTA4H	42	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	HRH3	24	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	EPHX2	22	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCOC1	ZINC000872369544	EC	On-Demand	Reactive	PSMB1	40	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	ESR1	60	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	ESR2	40	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	LTA4H	42	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	HRH3	24	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	EPHX2	22	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000872369545	EC	On-Demand	Reactive	PSMB1	40	35
NS(=O)(=O)c1cccc(C=NNCCC(F)(F)F)c1	ZINC000872369572	CD	On-Demand	Mild	CA2	17	41
NS(=O)(=O)c1cccc(C=NNCCC(F)(F)F)c1	ZINC000872369572	CD	On-Demand	Mild	CA4	18	41
CC(C)(C)OC(=O)NCc1cccc(C=NNCCC(F)(F)F)c1	ZINC000872369580	EH	On-Demand	Mild	PDS	41	35
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(O)c(O)c1	ZINC000872369583	DF	On-Demand	Reactive	PYK	57	34
CCC(CCC(F)(F)F)=NNC(=O)c1ccc(O)c(O)c1	ZINC000872369583	DF	On-Demand	Reactive	ADCYAP1R1	43	31
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	CTSB	17	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	CTSK	19	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	CTSL	20	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	PREP	16	42
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	CAPN2	51	33
O=C(CNC(=O)OCc1ccccc1)NN=C1CC[C@@H]2C[C@H]12	ZINC000872369593	DD	On-Demand	Reactive	NPR	57	33
O=C(CNC(=O)OCc1ccccc1)NN=CC1CC2(C1)OCCO2	ZINC000872369631	ED	On-Demand	Reactive	NPR	46	32
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCOC3)nn2)cc1	ZINC000872369657	EC	On-Demand	Reactive	PROKR1	57	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCOC3)nn2)cc1	ZINC000872369659	EC	On-Demand	Reactive	PROKR1	57	33
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ccc(O)c(O)c1	ZINC000872369684	FF	On-Demand	Reactive	DRD4	21	40
O=C(CNC(=O)OCc1ccccc1)NN=Cc1ccnn1CC1CCC1	ZINC000872369694	FE	On-Demand	Reactive	PREP	19	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1OCC[C@H]1c1ccccc1	ZINC000872369698	GF	On-Demand	Reactive	L3MBTL3	59	35
COCCCNN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872369809	EF	On-Demand	Mild	TAAR1	15	45
O=C(CNC(=O)OCc1ccccc1)NN=Cc1cn(C2CC2)cn1	ZINC000872369818	ED	On-Demand	Reactive	PREP	21	41
O=C(CNC(=O)OCc1ccccc1)NN=Cc1cn(C2CC2)cn1	ZINC000872369818	ED	On-Demand	Reactive	CAPN2	56	34
O=C(CNC(=O)OCc1ccccc1)NN=Cc1cn(C2CC2)cn1	ZINC000872369818	ED	On-Demand	Reactive	NPR	51	32
CCC(CC1CCCCC1)=NNC(=O)c1ccc(O)c(O)c1	ZINC000872369824	DH	On-Demand	Reactive	PYK	59	33
CC(=O)c1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1F	ZINC000872369828	FF	On-Demand	Anodyne	SGK1	32	43
CN1CCC(C=NNC(=O)c2ccc(O)c(O)c2)CC1	ZINC000872369835	CD	On-Demand	Reactive	GCGR	29	41
CN1CCC(C=NNC(=O)c2ccc(O)c(O)c2)CC1	ZINC000872369835	CD	On-Demand	Reactive	ADCYAP1R1	67	31
CC(C)c1nn(C)cc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872369896	GG	On-Demand	Anodyne	PKM	39	47
COCCCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872369926	CD	On-Demand	Mild	L3MBTL3	54	37
CCC(=NNC(=O)c1cccc(C)n1)c1cccc(OC)c1OC	ZINC000872369940	EF	On-Demand	Reactive	KCNK3	46	39
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872369942	DD	On-Demand	Reactive	CTSB	17	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872369942	DD	On-Demand	Reactive	CTSK	20	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872369942	DD	On-Demand	Reactive	PREP	21	44
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872369942	DD	On-Demand	Reactive	CAPN2	43	36
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@H]1F	ZINC000872369942	DD	On-Demand	Reactive	NPR	54	33
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872369944	DD	On-Demand	Reactive	CTSB	17	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872369944	DD	On-Demand	Reactive	CTSK	20	40
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872369944	DD	On-Demand	Reactive	PREP	21	44
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872369944	DD	On-Demand	Reactive	CAPN2	43	36
O=C(CNC(=O)OCc1ccccc1)NN=C1CCC[C@@H]1F	ZINC000872369944	DD	On-Demand	Reactive	NPR	54	33
COc1cc(C=NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(Cl)cc1O	ZINC000872369992	FG	On-Demand	Reactive	GCGR	20	42
COc1cc(C=NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(Cl)cc1O	ZINC000872369992	FG	On-Demand	Reactive	ADCYAP1R1	43	35
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	PTAFR	21	40
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	CTSB	20	40
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	CTSL	17	40
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	CAPN2	52	31
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	NPR	57	35
CC(CCc1cccnc1)=NNC(=O)CNC(=O)OCc1ccccc1	ZINC000872369998	FE	On-Demand	Reactive	PPO2	34	43
Cc1cccc(C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1	ZINC000872370008	EE	On-Demand	Reactive	L3MBTL3	54	36
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CTSB	39	41
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CTSK	29	43
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CTSL	41	35
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	PREP	23	45
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CAPNS1	61	32
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CAPN1	56	38
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	CAPN2	82	38
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	TGM2	38	41
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	NPR	60	34
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	F13A1	29	40
CN1CCC(C=NNC(=O)CNC(=O)OCc2ccccc2)CC1	ZINC000872370034	ED	On-Demand	Reactive	SLC12A5	42	35
COc1ccc(Cn2cc(C=NNCCC(F)(F)F)nn2)cc1	ZINC000872370037	EE	On-Demand	Mild	PROKR1	62	34
O=C(CNC(=O)OCc1ccccc1)NN=CCCCC1CC1	ZINC000872370039	DF	On-Demand	Reactive	CTSB	23	40
O=C(CNC(=O)OCc1ccccc1)NN=CCCCC1CC1	ZINC000872370039	DF	On-Demand	Reactive	CTSK	20	40
O=C(CNC(=O)OCc1ccccc1)NN=CCCCC1CC1	ZINC000872370039	DF	On-Demand	Reactive	PREP	15	42
O=C(CNC(=O)OCc1ccccc1)NN=CCCCC1CC1	ZINC000872370039	DF	On-Demand	Reactive	CAPN2	63	37
O=C(CNC(=O)OCc1ccccc1)NN=CCCCC1CC1	ZINC000872370039	DF	On-Demand	Reactive	NPR	57	34
O=C(NN=CCCCC1CC1)c1ccc(O)c(O)c1	ZINC000872370043	CE	On-Demand	Reactive	ADCYAP1R1	75	34
Cn1ccnc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872370044	CE	On-Demand	Mild	L3MBTL3	47	35
O=C(CNC(=O)OCc1ccccc1)NN=C1CCCN2CCSC[C@@H]12	ZINC000872370066	GD	On-Demand	Reactive	PREP	21	41
O=C(CNC(=O)OCc1ccccc1)NN=C1CCCN2CCSC[C@H]12	ZINC000872370067	GD	On-Demand	Reactive	PREP	21	41
CC(C)(C)OC(=O)NCc1cccc(C=NNC[C@@H](O)C(F)(F)F)c1	ZINC000872370072	FF	On-Demand	Mild	PDS	51	37
CC(C)(C)OC(=O)NCc1cccc(C=NNC[C@H](O)C(F)(F)F)c1	ZINC000872370073	FF	On-Demand	Mild	PDS	51	37
COc1cc(F)ccc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872370187	EH	On-Demand	Mild	L3MBTL3	62	34
COc1cc(F)ccc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872370187	EH	On-Demand	Mild	ACKR3	59	37
O=C(CNC(=O)OCc1ccccc1)NN=C1CCCc2ncccc21	ZINC000872370199	FE	On-Demand	Reactive	NPR	58	33
Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)n1	ZINC000872370229	FD	On-Demand	Reactive	LTA4H	41	42
Cc1cccc(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)n1	ZINC000872370229	FD	On-Demand	Reactive	EPHX2	18	43
CC(CCc1c[nH]c2ccccc12)=NNCCC(F)(F)F	ZINC000872370249	CI	On-Demand	Mild	MPO	43	42
O=C(NN=C[C@@H]1CCC(F)(F)C1)c1ccc(O)c(O)c1	ZINC000872370255	CE	On-Demand	Reactive	ADCYAP1R1	46	30
O=C(NN=C[C@H]1CCC(F)(F)C1)c1ccc(O)c(O)c1	ZINC000872370256	CE	On-Demand	Reactive	ADCYAP1R1	46	30
C=CCC1(C=NNC(=O)CNC(=O)OCc2ccccc2)CCOCC1	ZINC000872370257	FE	On-Demand	Reactive	NPR	54	34
O=C(CNC(=O)OCc1ccccc1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872370300	EE	On-Demand	Reactive	CAPN2	53	35
O=C(CNC(=O)OCc1ccccc1)NN=C[C@@H]1CCC(F)(F)C1	ZINC000872370300	EE	On-Demand	Reactive	NPR	58	33
O=C(CNC(=O)OCc1ccccc1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872370303	EE	On-Demand	Reactive	CAPN2	53	35
O=C(CNC(=O)OCc1ccccc1)NN=C[C@H]1CCC(F)(F)C1	ZINC000872370303	EE	On-Demand	Reactive	NPR	58	33
O=C(CNC(=O)OCc1ccccc1)NN=C1CCCC2(C1)OCCO2	ZINC000872370308	FD	On-Demand	Reactive	SLC12A5	48	33
COCCCNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872370318	CG	On-Demand	Mild	MPO	33	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCOC1	ZINC000872370319	CF	On-Demand	Reactive	MC5R	32	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCOC1	ZINC000872370319	CF	On-Demand	Reactive	CCKBR	40	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCOC1	ZINC000872370320	CF	On-Demand	Reactive	MC5R	32	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCOC1	ZINC000872370320	CF	On-Demand	Reactive	CCKBR	40	34
Cn1nc2c(c1C=NNC(=O)CNC(=O)OCc1ccccc1)CCCC2	ZINC000872370348	FD	On-Demand	Reactive	NPR	44	31
FC(F)(F)CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872370350	EE	On-Demand	Mild	LTA4H	32	45
FC(F)(F)CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872370350	EE	On-Demand	Mild	EPHX2	15	44
COc1cc(F)ccc1NN=C(C)CCc1cccnc1	ZINC000872370381	CH	On-Demand	Mild	GRIN2B	20	40
CC1(C)CCC[C@H]1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872370521	DG	On-Demand	Mild	L3MBTL3	78	40
CCN(C)C(=O)c1cccc(NS(=O)(=O)CCC(C)(C)CC)c1	ZINC000872370614	EG	On-Demand	Anodyne	LIMK2	28	41
Cn1nc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cc1C1CC1	ZINC000872370638	GG	On-Demand	Anodyne	PKM	39	47
CC(=O)c1ccsc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872370676	GH	On-Demand	Anodyne	PKM	41	50
CCN(C)C(=O)c1cccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c1	ZINC000872370686	GF	On-Demand	Anodyne	LIMK2	23	40
COc1ccc(Cn2cc(C=NN[C@@H]3CCOC3)nn2)cc1	ZINC000872370744	DD	On-Demand	Mild	PROKR1	44	31
COc1ccc(Cn2cc(C=NN[C@H]3CCOC3)nn2)cc1	ZINC000872370747	DD	On-Demand	Mild	PROKR1	44	31
C(=NNCCCN1CCOCC1)c1cccc2ncccc12	ZINC000872370759	CD	On-Demand	Mild	HNMT	77	42
CC(CCc1cccnc1)=NNCCCN1CCOCC1	ZINC000872370764	CD	On-Demand	Mild	CHRNA7	34	47
COC(=O)c1ccoc1S(=O)(=O)Nc1cc(N2CCOCC2)ccc1C	ZINC000872370787	GE	On-Demand	Anodyne	EPHB4	42	32
O=C(c1ccc(C=NNCCc2ccncc2)cc1)N1CCCC1	ZINC000872370905	DE	On-Demand	Mild	L3MBTL3	49	35
CC(=NN[C@H](C)CCc1ccc2c(c1)OCO2)c1cn(C)cn1	ZINC000872370923	DE	On-Demand	Mild	NOS2	80	34
CC(=NN[C@@H](C)CCc1ccc2c(c1)OCO2)c1cn(C)cn1	ZINC000872370924	DE	On-Demand	Mild	NOS2	80	34
CC(C)c1scnc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872370927	GH	On-Demand	Anodyne	PKM	40	48
C[C@H](O)c1cc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)ccc1F	ZINC000872370932	FF	On-Demand	Anodyne	SGK1	31	42
C(=NNCCc1ccncc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872370988	FD	On-Demand	Mild	LTA4H	37	46
C(=NN[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371065	DD	On-Demand	Mild	ESR1	64	38
C(=NN[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371065	DD	On-Demand	Mild	ESR2	40	38
C(=NN[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371065	DD	On-Demand	Mild	LTA4H	41	45
C(=NN[C@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371065	DD	On-Demand	Mild	HRH3	20	41
C(=NN[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371066	DD	On-Demand	Mild	ESR1	64	38
C(=NN[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371066	DD	On-Demand	Mild	ESR2	40	38
C(=NN[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371066	DD	On-Demand	Mild	LTA4H	41	45
C(=NN[C@@H]1CCOC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371066	DD	On-Demand	Mild	HRH3	20	41
COc1ccc(Cn2cc(C=NNCC(C)(C)CO)nn2)cc1	ZINC000872371118	DD	On-Demand	Mild	PROKR1	64	35
COc1ccc(Cn2cc(C=NNCCCN3CCOCC3)nn2)cc1	ZINC000872371157	FC	On-Demand	Mild	PROKR1	47	31
CSCCON=Cc1cn(C[C@H]2CCCO2)nn1	ZINC000872371167	CD	On-Demand	Mild	PDE8B	47	35
CSCCON=Cc1cn(C[C@@H]2CCCO2)nn1	ZINC000872371168	CD	On-Demand	Mild	PDE8B	47	35
CSCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872371170	DE	On-Demand	Mild	ESR1	47	36
CSCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872371170	DE	On-Demand	Mild	LTA4H	37	47
CSCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872371170	DE	On-Demand	Mild	HRH3	15	41
CSCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872371170	DE	On-Demand	Mild	PSMB1	41	36
COc1ccccc1CON=C1CCC(CNC(C)=O)CC1	ZINC000872371186	DF	On-Demand	Mild	TSHR	40	30
COc1ccccc1CON=C1CCC(CNC(C)=O)CC1	ZINC000872371186	DF	On-Demand	Mild	MTNR1A	31	44
COc1ccccc1CON=C1CCC(CNC(C)=O)CC1	ZINC000872371186	DF	On-Demand	Mild	MTNR1B	30	44
COc1ccccc1CON=C1CCC(CNC(C)=O)CC1	ZINC000872371186	DF	On-Demand	Mild	MBTPS1	40	34
C(=NNCCCN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371205	GD	On-Demand	Mild	LTA4H	43	49
C(=NNCCCN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371205	GD	On-Demand	Mild	HRH3	42	50
C(=NNCCCN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371205	GD	On-Demand	Mild	EPHX2	20	48
C(=NNCCCN1CCOCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371205	GD	On-Demand	Mild	PSMB1	41	37
COC(=O)c1c(F)cccc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371222	FG	On-Demand	Mild	BDKRB1	19	43
COC(=O)c1c(F)cccc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371222	FG	On-Demand	Mild	L3MBTL3	46	34
COC(=O)N(C)N=Cc1cccc([N+](=O)[O-])c1C	ZINC000872371282	CD	On-Demand	Reactive	TLR4	20	48
CC(C)(C)OC(=O)NCc1cccc(C=NN[C@@H](CO)c2ccccc2)c1	ZINC000872371290	FG	On-Demand	Mild	PDS	62	36
CC(C)(C)OC(=O)NCc1cccc(C=NN[C@H](CO)c2ccccc2)c1	ZINC000872371292	FG	On-Demand	Mild	PDS	62	36
C[C@H](CCc1ccc2c(c1)OCO2)NN=Cc1cc2c(O)nccc2o1	ZINC000872371312	FG	On-Demand	Mild	NOS2	79	33
C[C@@H](CCc1ccc2c(c1)OCO2)NN=Cc1cc2c(O)nccc2o1	ZINC000872371314	FG	On-Demand	Mild	NOS2	79	33
COC(=O)N(C)N=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872371321	DD	On-Demand	Reactive	PROKR1	63	34
CC(C)(C)OC(=O)NCc1cccc(C=NNCCc2ccccn2)c1	ZINC000872371322	FG	On-Demand	Mild	PDS	57	32
CSCCON=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872371377	DG	On-Demand	Mild	PDS	41	32
C[C@H](O)c1cc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)ccc1F	ZINC000872371441	FE	On-Demand	Anodyne	SGK1	43	35
Fc1cccc(C=NNCCCN2CCOCC2)c1OC(F)(F)F	ZINC000872371467	EE	On-Demand	Mild	EPHX2	18	40
COc1ccccc1CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371476	EG	On-Demand	Mild	CCR8	17	41
COc1ccccc1CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371476	EG	On-Demand	Mild	MBTPS1	52	37
COc1ccccc1CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371476	EG	On-Demand	Mild	HPGD	21	41
C(=NNCCc1ccccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872371637	FD	On-Demand	Mild	LTA4H	44	47
O=C(c1ccc(C=NN[C@H]2CCOC2)cc1)N1CCCC1	ZINC000872371647	CD	On-Demand	Mild	L3MBTL3	82	40
O=C(c1ccc(C=NN[C@@H]2CCOC2)cc1)N1CCCC1	ZINC000872371649	CD	On-Demand	Mild	L3MBTL3	82	40
c1cnc2c(c1)C(=NNCCCN1CCOCC1)CCC2	ZINC000872371673	CD	On-Demand	Mild	HNMT	44	34
O=C(c1ccc(C=NN[C@@H](CO)c2ccccc2)cc1)N1CCCC1	ZINC000872371696	EF	On-Demand	Mild	L3MBTL3	56	35
O=C(c1ccc(C=NN[C@H](CO)c2ccccc2)cc1)N1CCCC1	ZINC000872371699	EF	On-Demand	Mild	L3MBTL3	56	35
NS(=O)(=O)c1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872371704	EB	On-Demand	Mild	EPHX2	17	42
c1ccc(CN2C[C@H]3C(=NN[C@@H]4CCOC4)CC[C@H]3C2)cc1	ZINC000872371727	CE	On-Demand	Mild	SIGMAR1	15	41
c1ccc(CN2C[C@H]3C(=NN[C@H]4CCOC4)CC[C@H]3C2)cc1	ZINC000872371730	CE	On-Demand	Mild	SIGMAR1	15	41
COCCc1ncc(C=NN[C@H](C)CCc2ccc3c(c2)OCO3)s1	ZINC000872371749	FG	On-Demand	Mild	NOS2	45	32
COCCc1ncc(C=NN[C@@H](C)CCc2ccc3c(c2)OCO3)s1	ZINC000872371751	FG	On-Demand	Mild	NOS2	45	32
CCOC(=O)/C=C/c1ccc(C=NOCc2ccccc2OC)n1C	ZINC000872371791	EG	On-Demand	Mild	AKR1B10	35	40
CC(CCc1c[nH]c2ccccc12)=NNCC(C)(C)CO	ZINC000872371799	CG	On-Demand	Mild	MPO	19	42
COc1ccccc1CON=Cc1cc(C(=O)OC(C)(C)C)nn1C	ZINC000872371867	EF	On-Demand	Mild	MT-CYB	49	35
O=c1cnnc(S)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872371908	FC	On-Demand	Mild	LTA4H	26	42
CSCCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872371909	CF	On-Demand	Mild	L3MBTL3	55	37
CC(=NNCCCN1CCOCC1)c1cc2c(Cl)nccc2o1	ZINC000872371976	EF	On-Demand	Mild	HRP1_PLAFA	49	35
CC(CCc1cccnc1)=NNCCc1ccncc1	ZINC000872371991	CF	On-Demand	Mild	TBXAS1	42	39
Cc1nn(C)c2cc(NS(=O)(=O)c3cn(C)nc3C(C)(C)C)ccc12	ZINC000872371992	FF	On-Demand	Anodyne	NR1I2	41	32
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3cc4n(n3)CCCC4)cc2N1	ZINC000872372046	GF	On-Demand	Anodyne	PKM	39	48
CC(CCc1c[nH]c2ccccc12)=NNCCCN1CCOCC1	ZINC000872372053	EF	On-Demand	Mild	HTR1D	65	44
CC(CCc1c[nH]c2ccccc12)=NNCCCN1CCOCC1	ZINC000872372053	EF	On-Demand	Mild	HTR1B	58	44
CC(CCc1c[nH]c2ccccc12)=NNCCCN1CCOCC1	ZINC000872372053	EF	On-Demand	Mild	SLC6A4	15	52
CCN(C)C(=O)c1cccc(NS(=O)(=O)N=S(=O)(CC)CC)c1	ZINC000872372074	FD	On-Demand	Anodyne	LIMK2	28	43
CC(CCc1cccnc1)=NN[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000872372107	EH	On-Demand	Mild	BMP1	34	42
CC(CCc1cccnc1)=NN[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000872372107	EH	On-Demand	Mild	NOS2	59	32
CC(CCc1cccnc1)=NN[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000872372108	EH	On-Demand	Mild	BMP1	34	42
CC(CCc1cccnc1)=NN[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000872372108	EH	On-Demand	Mild	NOS2	59	32
C[C@@H](Oc1cccc(Cl)c1)C(=O)NN=Cc1nc(C2OCCO2)cs1	ZINC000872372179	GF	On-Demand	Reactive	IMDH_CRYPV	25	44
CCC(=NNCCCN1CCOCC1)c1cccc(OC)c1OC	ZINC000872372188	EE	On-Demand	Mild	DRD2	25	43
CCC(=NNCCCN1CCOCC1)c1cccc(OC)c1OC	ZINC000872372188	EE	On-Demand	Mild	ADRA1D	18	40
CCC(=NNCCCN1CCOCC1)c1cccc(OC)c1OC	ZINC000872372188	EE	On-Demand	Mild	ADRA1A	17	40
CCC(=NNCCCN1CCOCC1)c1cccc(OC)c1OC	ZINC000872372188	EE	On-Demand	Mild	DRD3	38	43
CC(=O)Nc1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872372197	DD	On-Demand	Mild	CASR	45	41
CC(=O)Nc1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872372197	DD	On-Demand	Mild	CHRNA7	20	45
CC(=O)Nc1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872372197	DD	On-Demand	Mild	MET	15	40
CC(=O)Nc1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872372197	DD	On-Demand	Mild	EPHX2	32	47
CC(=O)Nc1cccc(C=NNCCCN2CCOCC2)c1	ZINC000872372197	DD	On-Demand	Mild	MCHR1	23	44
O=C(c1ccc(C=NNCCCN2CCOCC2)cc1)N1CCCC1	ZINC000872372270	ED	On-Demand	Mild	EPHX2	22	40
O=C(c1ccc(C=NNCCCN2CCOCC2)cc1)N1CCCC1	ZINC000872372270	ED	On-Demand	Mild	L3MBTL3	37	44
CC(CCOCc1ccccc1)=NNCCCN1CCOCC1	ZINC000872372295	DE	On-Demand	Mild	EPHX2	16	44
CC(CCc1c[nH]c2ccccc12)=NNCCc1ccncc1	ZINC000872372349	DH	On-Demand	Mild	MPO	28	40
CC(CCc1c[nH]c2ccccc12)=NNCCc1ccncc1	ZINC000872372349	DH	On-Demand	Mild	BRS3	26	40
C[C@H](CCc1ccc2c(c1)OCO2)NN=Cc1cn(C2CC2)cn1	ZINC000872372451	EF	On-Demand	Mild	NOS2	87	34
C[C@@H](CCc1ccc2c(c1)OCO2)NN=Cc1cn(C2CC2)cn1	ZINC000872372453	EF	On-Demand	Mild	NOS2	87	34
OC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372484	FE	On-Demand	Mild	ESR1	47	37
OC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372484	FE	On-Demand	Mild	LTA4H	48	50
OC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372484	FE	On-Demand	Mild	PSMB2	38	40
OC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372484	FE	On-Demand	Mild	PSMB1	42	40
OC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372485	FE	On-Demand	Mild	ESR1	47	37
OC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372485	FE	On-Demand	Mild	LTA4H	48	50
OC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372485	FE	On-Demand	Mild	PSMB2	38	40
OC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccccc1	ZINC000872372485	FE	On-Demand	Mild	PSMB1	42	40
COC(=O)N(C)N=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872372525	EF	On-Demand	Reactive	TAAR1	18	49
COC(=O)N(C)N=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872372573	DF	On-Demand	Reactive	PDS	49	34
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	ESR1	91	41
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	ESR2	59	41
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	LTA4H	41	45
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	HRH3	25	43
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	EPHX2	18	44
COC(=O)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372592	DD	On-Demand	Reactive	PSMB1	41	35
COC(=O)N(C)N=Cc1cc(F)ccc1N(C)C	ZINC000872372593	CD	On-Demand	Reactive	TLR4	20	43
COC(=O)N(C)N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872372603	CD	On-Demand	Reactive	L3MBTL3	64	40
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	HTR1D	22	43
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	HTR1B	16	43
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	EDNRB	19	40
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	TACR1	30	43
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	CCKAR	40	39
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	MPO	44	36
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	NMBR	28	41
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	CCKBR	63	36
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	GHSR	50	39
COC(=O)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872372623	CG	On-Demand	Reactive	MMP9	17	45
CCC(=NN(C)C(=O)OC)c1cccc(OC)c1OC	ZINC000872372635	CF	On-Demand	Reactive	KCNK3	44	39
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ncccc1F)C2	ZINC000872372701	EH	On-Demand	Mild	GPR119	22	44
C(=NNc1cncnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872372811	ED	On-Demand	Mild	LTA4H	44	46
C(=NNc1cncnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872372811	ED	On-Demand	Mild	SRC	17	44
C(=NNc1cncnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872372811	ED	On-Demand	Mild	EPHA2	15	44
C(=NNc1cncnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872372811	ED	On-Demand	Mild	MKNK1	24	44
C(=NNc1cncnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872372811	ED	On-Demand	Mild	TBK1	15	41
Fc1cccnc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872372817	EE	On-Demand	Mild	LTA4H	42	45
COC(=O)N(C)N=Cc1cccc(Cl)c1C	ZINC000872372960	BF	On-Demand	Reactive	TLR4	15	42
O=C(c1ccc(C=NNc2cncnc2)cc1)N1CCCC1	ZINC000872372969	CE	On-Demand	Mild	L3MBTL3	64	38
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	PGC	53	35
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CTSB	39	40
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	PAPA1_CARPA	68	51
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CTSK	29	53
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CTSL	29	51
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	TACR3	15	40
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CAPNS1	51	32
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	REN	67	41
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CTSS	15	51
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CAPN1	43	39
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CAPN2	44	31
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	FPR1	54	42
COC(=O)N(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372978	EG	On-Demand	Reactive	CTRB_BOVIN	58	44
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	PGC	53	35
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CTSB	39	40
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	PAPA1_CARPA	68	51
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CTSK	29	53
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CTSL	29	51
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	TACR3	15	40
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CAPNS1	51	32
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	REN	67	41
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CTSS	15	51
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CAPN1	43	39
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CAPN2	44	31
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	FPR1	54	42
COC(=O)N(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872372979	EG	On-Demand	Reactive	CTRB_BOVIN	58	44
COC(=O)N(C)N=C(C)CCc1cccnc1	ZINC000872373031	BE	On-Demand	Reactive	TBXAS1	38	44
COC(=O)N(C)N=C(C)CCc1cccnc1	ZINC000872373031	BE	On-Demand	Reactive	NAMPT	23	40
C=CCNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872373117	BG	On-Demand	Mild	MPO	37	43
CCS(=O)(=O)Cc1ccc(NS(=O)(=O)c2cccc(F)c2OC)cc1	ZINC000872373128	GF	On-Demand	Anodyne	PTPRB	57	34
COCCc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872373139	GG	On-Demand	Anodyne	LIMK2	27	42
CCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)c(C)c1	ZINC000872373185	GH	On-Demand	Anodyne	ALPL	16	41
C=C(C)CNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872373353	CH	On-Demand	Mild	MPO	42	45
C(=NNc1nc[nH]n1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872373355	DC	On-Demand	Mild	LTA4H	42	47
COc1ccc(Cn2cc(C=NNCC3CCCC3)nn2)cc1	ZINC000872373377	DE	On-Demand	Mild	PROKR1	53	32
CCCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872373390	GH	On-Demand	Anodyne	ALPL	15	45
CCCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872373390	GH	On-Demand	Anodyne	LIMK2	21	40
CC(CCc1cccnc1)=NNCC1CCCC1	ZINC000872373444	BG	On-Demand	Mild	C3AR1	39	41
CCSCc1ccc(NS(=O)(=O)c2occc2C(=O)OC)cc1	ZINC000872373573	FG	On-Demand	Anodyne	PTPRB	51	35
C=CCNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872373592	CF	On-Demand	Mild	SIGMAR1	19	44
C=CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872373606	CD	On-Demand	Mild	LTA4H	40	48
C=CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872373606	CD	On-Demand	Mild	HRH3	16	42
C=CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872373606	CD	On-Demand	Mild	EPHX2	15	45
C=CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872373606	CD	On-Demand	Mild	PSMB1	41	37
C=C(C)CNN=C(C)CCc1cccnc1	ZINC000872373629	BF	On-Demand	Mild	TBXAS1	34	43
Fc1cccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)n1	ZINC000872373704	EE	On-Demand	Mild	LTA4H	45	45
CC(C)c1ncsc1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872373723	GH	On-Demand	Anodyne	PKM	40	48
COc1ccc(Cn2cc(C=NNC(=O)C3(OC)CCOCC3)nn2)cc1	ZINC000872373766	FC	On-Demand	Reactive	PROKR1	55	32
O=C(c1ccc(C=NN[C@H]2CCSC2)cc1)N1CCCC1	ZINC000872373845	DE	On-Demand	Mild	L3MBTL3	87	41
O=C(c1ccc(C=NN[C@@H]2CCSC2)cc1)N1CCCC1	ZINC000872373846	DE	On-Demand	Mild	L3MBTL3	87	41
O=C(c1ccc(C=NNCC2CCCC2)cc1)N1CCCC1	ZINC000872373859	CG	On-Demand	Mild	L3MBTL3	95	43
CCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1C	ZINC000872373936	GH	On-Demand	Anodyne	ALPL	17	40
C=CCNN=C(C)CCc1cccnc1	ZINC000872374001	BE	On-Demand	Mild	NAMPT	19	44
C(=NN[C@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374056	ED	On-Demand	Mild	ESR1	52	37
C(=NN[C@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374056	ED	On-Demand	Mild	LTA4H	37	43
C(=NN[C@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374056	ED	On-Demand	Mild	PSMB1	40	34
C(=NN[C@@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374058	ED	On-Demand	Mild	ESR1	52	37
C(=NN[C@@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374058	ED	On-Demand	Mild	LTA4H	37	43
C(=NN[C@@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872374058	ED	On-Demand	Mild	PSMB1	40	34
C=C(C)CNN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872374060	CD	On-Demand	Mild	PROKR1	58	35
CCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872374081	FG	On-Demand	Anodyne	ALPL	19	55
Cn1ncc(S(=O)(=O)Nc2ccc3c(c2)nnn3C)c1C(F)(F)F	ZINC000872374165	FD	On-Demand	Anodyne	NR1I2	48	34
C=CCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872374207	CE	On-Demand	Mild	L3MBTL3	70	39
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	ESR1	69	38
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	ESR2	46	38
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	LTA4H	40	46
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	HRH3	17	43
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	EPHX2	15	43
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	PSMB2	40	41
C=C(C)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374222	DD	On-Demand	Mild	PSMB1	43	41
COc1ccc(Cn2cc(C=NN[C@@H]3CCSC3)nn2)cc1	ZINC000872374244	DD	On-Demand	Mild	PROKR1	54	32
COc1ccc(Cn2cc(C=NN[C@H]3CCSC3)nn2)cc1	ZINC000872374245	DD	On-Demand	Mild	PROKR1	54	32
COCCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872374292	GF	On-Demand	Anodyne	PRTN3	50	30
COCCOc1ccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cc1	ZINC000872374292	GF	On-Demand	Anodyne	LIMK2	22	50
O=C(c1ccc(C=NNc2nc[nH]n2)cc1)N1CCCC1	ZINC000872374331	CD	On-Demand	Mild	L3MBTL3	69	38
C=C(C)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872374355	CE	On-Demand	Mild	L3MBTL3	69	38
O=C(c1ccc(C=NNC[C@@H]2CCSC2)cc1)N1CCCC1	ZINC000872374403	DF	On-Demand	Mild	L3MBTL3	74	38
O=C(c1ccc(C=NNC[C@H]2CCSC2)cc1)N1CCCC1	ZINC000872374407	DF	On-Demand	Mild	L3MBTL3	74	38
O=C(c1ccc(C=NNc2nccnc2C2CCC2)cc1)N1CCCC1	ZINC000872374492	EG	On-Demand	Mild	L3MBTL3	65	38
C#CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374498	CD	On-Demand	Mild	ESR1	58	35
C#CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374498	CD	On-Demand	Mild	LTA4H	48	48
C#CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374498	CD	On-Demand	Mild	HRH3	23	44
C#CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374498	CD	On-Demand	Mild	PSMB2	40	39
C#CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374498	CD	On-Demand	Mild	PSMB1	44	39
CC[C@H](O)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872374559	DE	On-Demand	Mild	SIGMAR1	15	41
CC[C@H](O)CNN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872374610	DD	On-Demand	Mild	PROKR1	61	33
CC[C@H](O)CNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872374687	CF	On-Demand	Mild	MPO	50	42
CC[C@H](O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374732	DD	On-Demand	Mild	ESR1	49	35
CC[C@H](O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374732	DD	On-Demand	Mild	LTA4H	35	45
CC[C@H](O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374732	DD	On-Demand	Mild	HRH3	15	41
CC[C@H](O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374732	DD	On-Demand	Mild	EPHX2	15	42
CC[C@H](O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872374732	DD	On-Demand	Mild	PSMB1	42	37
CC[C@H](O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872374743	CD	On-Demand	Mild	L3MBTL3	56	36
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000872374751	EF	On-Demand	Mild	TBXAS1	39	43
CC(CCc1cccnc1)=NNc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000872374751	EF	On-Demand	Mild	NAMPT	58	50
CC[C@H](O)CNN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872374756	DE	On-Demand	Mild	PDS	69	38
C#CCON=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872374779	CF	On-Demand	Mild	SIGMAR1	18	46
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	PGC	53	36
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	PAPA1_CARPA	61	47
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	CTSK	25	52
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	CTSL	25	47
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	REN	64	42
C#CCON=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374958	DG	On-Demand	Mild	FPR1	53	44
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	PGC	53	36
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	PAPA1_CARPA	61	47
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	CTSK	25	52
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	CTSL	25	47
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	REN	64	42
C#CCON=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872374959	DG	On-Demand	Mild	FPR1	53	44
C(=NNC[C@@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872375133	EE	On-Demand	Mild	LTA4H	32	42
C(=NNC[C@H]1CCSC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872375134	EE	On-Demand	Mild	LTA4H	32	42
C#CCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872375157	CD	On-Demand	Mild	L3MBTL3	64	39
O=C(c1ccc(C=NOC/C=C/Cl)cc1)N1CCCC1	ZINC000872375172	CG	On-Demand	Mild	L3MBTL3	59	37
O=C(c1ccc(C=NOC/C=C\Cl)cc1)N1CCCC1	ZINC000872375173	CG	On-Demand	Mild	L3MBTL3	59	37
CC(CCc1cccnc1)=NN[C@@H](C)COc1ccccc1	ZINC000872375263	CG	On-Demand	Mild	PPO2	33	42
CC(CCc1cccnc1)=NN[C@@H](C)COc1ccccc1	ZINC000872375263	CG	On-Demand	Mild	PDS	47	36
CC(CCc1cccnc1)=NN[C@H](C)COc1ccccc1	ZINC000872375264	CG	On-Demand	Mild	PPO2	33	42
CC(CCc1cccnc1)=NN[C@H](C)COc1ccccc1	ZINC000872375264	CG	On-Demand	Mild	PDS	47	36
COCCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872375374	DD	On-Demand	Mild	LTA4H	38	47
COCCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872375374	DD	On-Demand	Mild	HRH3	28	43
COCCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872375374	DD	On-Demand	Mild	PSMB1	41	36
COCCCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872375386	CE	On-Demand	Mild	L3MBTL3	57	37
CCOc1cccc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)c1	ZINC000872375391	FG	On-Demand	Anodyne	ALPL	17	42
COC(=O)[C@@H](C)c1cccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c1	ZINC000872375513	GF	On-Demand	Anodyne	TRPV1	41	33
Cc1nn(C)cc1S(=O)(=O)Nc1cccc(N=S(C)(C)=O)c1	ZINC000872375518	ED	On-Demand	Anodyne	NR1I2	42	34
COc1cccc(SC)c1NS(=O)(=O)c1conc1C	ZINC000872375645	DF	On-Demand	Anodyne	EDNRA	19	40
Cc1cc2c(cc1S(=O)(=O)Nc1cccc(N=S(C)(C)=O)c1)OCO2	ZINC000872375673	GF	On-Demand	Anodyne	PKM	16	42
CCOc1ccncc1S(=O)(=O)Nc1cccc(N=S(C)(C)=O)c1	ZINC000872375687	FF	On-Demand	Anodyne	ALPL	26	54
COCCCON=Cc1cccc(NC(C)=O)c1	ZINC000872375736	CE	On-Demand	Mild	KCNK3	49	35
COCCCON=Cc1cccc(NC(C)=O)c1	ZINC000872375736	CE	On-Demand	Mild	KCNK9	47	35
COCCCON=C(C)CCc1cccnc1	ZINC000872375742	BE	On-Demand	Mild	TBXAS1	28	45
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H]1CCCOC1	ZINC000872375746	FD	On-Demand	Reactive	LEF	17	40
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H]1CCCOC1	ZINC000872375747	FD	On-Demand	Reactive	LEF	17	40
O=S(=O)(Nc1ccc(F)cc1N1CCOCC1)c1cc(F)cc(F)c1O	ZINC000872375748	GE	On-Demand	Clean	PIK3C3	23	41
COc1cccc(SC)c1NS(=O)(=O)c1cn(C)nc1Br	ZINC000872375869	GF	On-Demand	Anodyne	CCR4	18	42
COCCCON=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872375875	DF	On-Demand	Mild	SIGMAR1	20	43
CN(C)C(=O)c1ccc(NS(=O)(=O)c2cnn(C)c2C(F)(F)F)c(F)c1	ZINC000872375940	GE	On-Demand	Anodyne	TRPV1	40	33
COc1cc(C)c(C)cc1NS(=O)(=O)c1cccc(F)c1OC	ZINC000872375987	EG	On-Demand	Anodyne	CCR4	15	45
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCc2nncn2C1	ZINC000872376077	FE	On-Demand	Reactive	MC5R	40	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCc2nncn2C1	ZINC000872376077	FE	On-Demand	Reactive	GHSR	42	39
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCc2nncn2C1	ZINC000872376078	FE	On-Demand	Reactive	MC5R	40	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCc2nncn2C1	ZINC000872376078	FE	On-Demand	Reactive	GHSR	42	39
CC[C@@H](NN=C(C)CCc1cccnc1)C(=O)O	ZINC000872376115	BD	On-Demand	Mild	TBXAS1	46	45
CC[C@@H](NN=C(C)CCc1cccnc1)C(=O)O	ZINC000872376115	BD	On-Demand	Mild	NAMPT	15	43
CC[C@H](NN=C(C)CCc1cccnc1)C(=O)O	ZINC000872376116	BD	On-Demand	Mild	TBXAS1	46	45
CC[C@H](NN=C(C)CCc1cccnc1)C(=O)O	ZINC000872376116	BD	On-Demand	Mild	NAMPT	15	43
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	ACE	20	48
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MME	29	45
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	EDNRA	36	43
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	TACR1	30	43
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	CCKAR	56	42
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MPO	31	40
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	BRS3	27	41
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	NMBR	40	42
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MC3R	47	38
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MC5R	62	38
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MMP2	24	44
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	GRPR	48	32
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	ECE1	61	47
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MMP11	54	35
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	CCKBR	73	38
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	GHSR	58	39
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MMP9	22	41
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	MC1R	66	38
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	NPR	28	45
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	SSSIM	27	40
CC[C@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376178	CF	On-Demand	Mild	ERAP2	41	38
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	ACE	20	48
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MME	29	45
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	EDNRA	36	43
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	TACR1	30	43
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	CCKAR	56	42
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MPO	31	40
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	BRS3	27	41
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	NMBR	40	42
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MC3R	47	38
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MC5R	62	38
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MMP2	24	44
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	GRPR	48	32
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	ECE1	61	47
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MMP11	54	35
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	CCKBR	73	38
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	GHSR	58	39
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MMP9	22	41
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	MC1R	66	38
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	NPR	28	45
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	SSSIM	27	40
CC[C@@H](NN=C(C)CCc1c[nH]c2ccccc12)C(=O)O	ZINC000872376183	CF	On-Demand	Mild	ERAP2	41	38
CC[C@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376336	DF	On-Demand	Mild	FAAH	61	37
CC[C@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376336	DF	On-Demand	Mild	CES1	51	35
CC[C@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376336	DF	On-Demand	Mild	CAPN2	32	40
CC[C@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376336	DF	On-Demand	Mild	ACE2	41	34
CC[C@@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376337	DF	On-Demand	Mild	FAAH	61	37
CC[C@@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376337	DF	On-Demand	Mild	CES1	51	35
CC[C@@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376337	DF	On-Demand	Mild	CAPN2	32	40
CC[C@@H](NN=C(CCc1ccccc1)c1ccccn1)C(=O)O	ZINC000872376337	DF	On-Demand	Mild	ACE2	41	34
C#CCON=C(C)CCc1c[nH]c2ccccc12	ZINC000872376359	BG	On-Demand	Mild	HTR1D	15	43
C#CCON=C(C)CCc1c[nH]c2ccccc12	ZINC000872376359	BG	On-Demand	Mild	HTR1B	15	43
C#CCON=C(C)CCc1c[nH]c2ccccc12	ZINC000872376359	BG	On-Demand	Mild	MPO	48	43
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	ESR1	88	39
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	ESR2	59	39
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	LTA4H	57	51
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	HRH3	35	44
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	PSMB2	40	42
C(=NOC1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872376366	DE	On-Demand	Mild	PSMB1	44	42
CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(Cl)n2)cc1C(C)C	ZINC000872376387	GF	On-Demand	Reactive	PTGER1	15	41
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	ACE	30	43
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	MME	51	43
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	PAPA1_CARPA	43	33
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	CAPNS1	53	34
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	CAPN1	60	39
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	CAPN2	103	39
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	ACE2	64	38
CC[C@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376412	CE	On-Demand	Mild	NPR	61	37
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	ACE	30	43
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	MME	51	43
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	PAPA1_CARPA	43	33
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	CAPNS1	53	34
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	CAPN1	60	39
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	CAPN2	103	39
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	ACE2	64	38
CC[C@@H](NN=C(C)CCOCc1ccccc1)C(=O)O	ZINC000872376413	CE	On-Demand	Mild	NPR	61	37
CCn1ncn(N=Cc2cn(Cc3ccc(OC)cc3)nn2)c1=O	ZINC000872376477	EC	On-Demand	Mild	PROKR1	62	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCO1	ZINC000872376479	DD	On-Demand	Reactive	L3MBTL3	84	40
CCC(=NN[C@H](CC)C(=O)O)c1cccc(OC)c1OC	ZINC000872376494	CE	On-Demand	Mild	KCNK3	44	36
CCC(=NN[C@@H](CC)C(=O)O)c1cccc(OC)c1OC	ZINC000872376496	CE	On-Demand	Mild	KCNK3	44	36
CC[C@@H](NN=C(C)c1cn(C)cn1)C(=O)O	ZINC000872376510	BC	On-Demand	Mild	CPB2	29	43
CC[C@H](NN=C(C)c1cn(C)cn1)C(=O)O	ZINC000872376511	BC	On-Demand	Mild	CPB2	29	43
O=S(=O)(Nc1ccc2c(c1)CCOC2)c1ccc(F)c(C(F)F)c1	ZINC000872376533	FH	On-Demand	Anodyne	PKM	22	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCc2nncn2C1	ZINC000872376536	FD	On-Demand	Reactive	L3MBTL3	45	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCc2nncn2C1	ZINC000872376538	FD	On-Demand	Reactive	L3MBTL3	45	34
CC[C@H](NN=Cc1ccc(OC)c(Cn2cccn2)c1)C(=O)O	ZINC000872376546	DD	On-Demand	Mild	PDE10A	20	41
CC[C@@H](NN=Cc1ccc(OC)c(Cn2cccn2)c1)C(=O)O	ZINC000872376548	DD	On-Demand	Mild	PDE10A	20	41
CC[C@@H](NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)O	ZINC000872376648	DE	On-Demand	Mild	ACE	40	39
CC[C@@H](NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)O	ZINC000872376648	DE	On-Demand	Mild	SIGMAR1	24	40
CC[C@H](NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)O	ZINC000872376649	DE	On-Demand	Mild	ACE	40	39
CC[C@H](NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)C(=O)O	ZINC000872376649	DE	On-Demand	Mild	SIGMAR1	24	40
COc1ccc(Cn2cc(C=NN[C@H](C)C(C)(C)C)nn2)cc1	ZINC000872376657	DF	On-Demand	Mild	PROKR1	63	34
COc1ccc(Cn2cc(C=NN[C@@H](C)C(C)(C)C)nn2)cc1	ZINC000872376658	DF	On-Demand	Mild	PROKR1	63	34
CCn1ncn(N=Cc2ccc(OCCN3CCOCC3)cc2)c1=O	ZINC000872376671	EC	On-Demand	Mild	LTA4H	34	43
CC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376697	ED	On-Demand	Mild	LTA4H	37	45
CC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376697	ED	On-Demand	Mild	HRH3	16	41
CC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376697	ED	On-Demand	Mild	EPHX2	20	47
CC[C@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376697	ED	On-Demand	Mild	PSMB1	41	35
CC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376699	ED	On-Demand	Mild	LTA4H	37	45
CC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376699	ED	On-Demand	Mild	HRH3	16	41
CC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376699	ED	On-Demand	Mild	EPHX2	20	47
CC[C@@H](NN=Cc1ccc(OCCN2CCOCC2)cc1)C(=O)O	ZINC000872376699	ED	On-Demand	Mild	PSMB1	41	35
CCn1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872376769	FF	On-Demand	Anodyne	PKM	41	50
CC(CCc1cccnc1)=NOC1CCC1	ZINC000872376816	BF	On-Demand	Mild	TBXAS1	18	41
COc1cncc(C=NN(Cc2ccccc2)S(C)(=O)=O)c1C	ZINC000872376858	EE	On-Demand	Mild	G6PC	42	36
CC[C@@H](NN=Cc1cc(OC)c(O)cc1Cl)C(=O)O	ZINC000872376883	CD	On-Demand	Mild	GCGR	19	41
CC[C@@H](NN=Cc1cc(OC)c(O)cc1Cl)C(=O)O	ZINC000872376883	CD	On-Demand	Mild	ADCYAP1R1	46	36
CC[C@H](NN=Cc1cc(OC)c(O)cc1Cl)C(=O)O	ZINC000872376884	CD	On-Demand	Mild	GCGR	19	41
CC[C@H](NN=Cc1cc(OC)c(O)cc1Cl)C(=O)O	ZINC000872376884	CD	On-Demand	Mild	ADCYAP1R1	46	36
CC[C@@H](NN=Cc1ccccc1CC(F)(F)F)C(=O)O	ZINC000872376896	CF	On-Demand	Mild	ACE2	44	33
CC[C@H](NN=Cc1ccccc1CC(F)(F)F)C(=O)O	ZINC000872376897	CF	On-Demand	Mild	ACE2	44	33
O=C(c1ccc(C=NOC2CCC2)cc1)N1CCCC1	ZINC000872377009	CF	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NOC2CCC2)cc1)N1CCCC1	ZINC000872377009	CF	On-Demand	Mild	L3MBTL3	97	47
Fc1cncnc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377011	ED	On-Demand	Mild	LTA4H	28	42
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA2	65	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA1	50	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA7	36	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	PLA2G2A	40	33
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA5B	37	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA4	52	38
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA5A	39	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	CA9	41	40
CCN(Cc1ccccc1)C(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000872377062	IG	On-Demand	Anodyne	LIMK2	29	47
CC[C@H](NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)O	ZINC000872377066	DD	On-Demand	Mild	RIR1_HHV11	44	31
CC[C@H](NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)O	ZINC000872377066	DD	On-Demand	Mild	L3MBTL3	63	36
CC[C@@H](NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)O	ZINC000872377077	DD	On-Demand	Mild	RIR1_HHV11	44	31
CC[C@@H](NN=Cc1ccc(C(=O)N2CCCC2)cc1)C(=O)O	ZINC000872377077	DD	On-Demand	Mild	L3MBTL3	63	36
C#CC[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872377119	CD	On-Demand	Mild	EPHX2	17	43
C#CC[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872377120	CD	On-Demand	Mild	EPHX2	17	43
CC[C@H](C)CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377200	CG	On-Demand	Mild	L3MBTL3	54	36
CC[C@@H](C)CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377205	CG	On-Demand	Mild	L3MBTL3	54	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C[C@H]4C[C@@H]4C3)cc2N1	ZINC000872377214	EE	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C[C@H]4C[C@H]4C3)cc2N1	ZINC000872377217	EE	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C[C@@H]4C[C@H]4C3)cc2N1	ZINC000872377219	EE	On-Demand	Anodyne	PKM	26	42
C(=NOC1CCC1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872377233	CD	On-Demand	Mild	PDE8B	43	33
C(=NOC1CCC1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872377237	CD	On-Demand	Mild	PDE8B	43	33
CC(CCc1cccnc1)=NNc1ccccc1S(=O)(=O)N(C)C	ZINC000872377340	EF	On-Demand	Mild	TBXAS1	27	40
CCC(=NNC(=O)COc1ccccc1O)c1cccc(OC)c1OC	ZINC000872377416	FF	On-Demand	Reactive	KCNK3	44	40
CCC(=NNC(=O)COc1ccccc1O)c1cccc(OC)c1OC	ZINC000872377416	FF	On-Demand	Reactive	KCNK9	33	40
O=C(NNS(=O)(=O)CCC1CCCCC1)c1cccc(Cl)n1	ZINC000872377424	EE	On-Demand	Reactive	BMP1	71	35
O=C(COc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377468	GD	On-Demand	Reactive	ESR1	56	36
O=C(COc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377468	GD	On-Demand	Reactive	LTA4H	46	45
O=C(COc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377468	GD	On-Demand	Reactive	EPHX2	17	47
CCOc1ccc(S(=O)(=O)N2C[C@H]3C[C@H]3C2)cc1C(C)C	ZINC000872377496	DF	On-Demand	Anodyne	PDE5A	44	50
CCOc1ccc(S(=O)(=O)N2C[C@H]3C[C@@H]3C2)cc1C(C)C	ZINC000872377497	DF	On-Demand	Anodyne	PDE5A	44	50
CCOc1ccc(S(=O)(=O)N2C[C@@H]3C[C@H]3C2)cc1C(C)C	ZINC000872377498	DF	On-Demand	Anodyne	PDE5A	44	50
CC(CCc1c[nH]c2ccccc12)=NNC[C@@H](C)O	ZINC000872377499	CE	On-Demand	Mild	MPO	40	44
CC(CCc1c[nH]c2ccccc12)=NNC[C@@H](C)O	ZINC000872377499	CE	On-Demand	Mild	MMP9	17	42
CC(CCc1c[nH]c2ccccc12)=NNC[C@H](C)O	ZINC000872377500	CE	On-Demand	Mild	MPO	40	44
CC(CCc1c[nH]c2ccccc12)=NNC[C@H](C)O	ZINC000872377500	CE	On-Demand	Mild	MMP9	17	42
CCn1ncn(N=Cc2ccc(C(=O)N3CCCC3)cc2)c1=O	ZINC000872377548	DD	On-Demand	Mild	L3MBTL3	53	35
O=C(O)CNN=C1CCCCc2ccccc2C1	ZINC000872377627	BD	On-Demand	Mild	ABAT	16	48
O=C(CSc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377647	GF	On-Demand	Reactive	L3MBTL3	50	34
COc1cccc(NS(=O)(=O)c2cn(C)nc2Br)c1C	ZINC000872377650	FE	On-Demand	Anodyne	CCR4	17	41
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	ESR1	75	38
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	ESR2	49	38
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	LTA4H	51	50
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	HRH3	25	46
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	EPHX2	23	52
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	FLT3	15	45
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	PSMB2	40	39
O=C(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872377732	DC	On-Demand	Mild	PSMB1	43	39
Cc1ccc(S(=O)(=O)N2C[C@@H]3C[C@H]3C2)c(C#N)c1	ZINC000872377739	CD	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@H]3C2)c(C#N)c1	ZINC000872377740	CD	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@@H]3C2)c(C#N)c1	ZINC000872377741	CD	On-Demand	Mild	TRPV4	45	37
C#CC[C@@H]1CCN(S(=O)(=O)c2ccccc2NC(=O)C(F)(F)F)C1	ZINC000872377780	FE	On-Demand	Mild	EPHX2	21	40
C#CC[C@@H]1CCN(S(=O)(=O)c2ccccc2NC(=O)C(F)(F)F)C1	ZINC000872377780	FE	On-Demand	Mild	RBP4	53	33
C#CC[C@H]1CCN(S(=O)(=O)c2ccccc2NC(=O)C(F)(F)F)C1	ZINC000872377781	FE	On-Demand	Mild	EPHX2	21	40
C#CC[C@H]1CCN(S(=O)(=O)c2ccccc2NC(=O)C(F)(F)F)C1	ZINC000872377781	FE	On-Demand	Mild	RBP4	53	33
COc1ccc(Cn2cc(C=NNC[C@@H](C)O)nn2)cc1	ZINC000872377785	CC	On-Demand	Mild	PROKR1	57	34
COc1ccc(Cn2cc(C=NNC[C@H](C)O)nn2)cc1	ZINC000872377786	CC	On-Demand	Mild	PROKR1	57	34
CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)COC(=O)N3)cc1C(C)C	ZINC000872377818	GI	On-Demand	Anodyne	PKM	32	43
CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)COC(=O)N3)cc1C(C)C	ZINC000872377818	GI	On-Demand	Anodyne	MGAT1	59	35
Cc1c(C=NNC[C@@H](C)O)cccc1[N+](=O)[O-]	ZINC000872377832	BD	On-Demand	Mild	COLA	64	31
Cc1c(C=NNC[C@H](C)O)cccc1[N+](=O)[O-]	ZINC000872377833	BD	On-Demand	Mild	COLA	64	31
O=C(O)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872377859	CD	On-Demand	Mild	SIGMAR1	35	47
CC(=NNC[C@@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872377952	CD	On-Demand	Mild	COLA	49	32
CC(=NNC[C@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872377953	CD	On-Demand	Mild	COLA	49	32
CC(=O)Nc1ccccc1NS(=O)(=O)c1cn(C)nc1C(C)(C)C	ZINC000872377967	FE	On-Demand	Anodyne	PRTN3	51	34
O=C(COc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377976	FE	On-Demand	Reactive	GCGR	22	40
O=C(COc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377976	FE	On-Demand	Reactive	ADCYAP1R1	61	40
O=C(COc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872377976	FE	On-Demand	Reactive	L3MBTL3	40	33
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1C[C@H]2C[C@@H]2C1	ZINC000872378009	CE	On-Demand	Anodyne	PKM	46	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1C[C@H]2C[C@H]2C1	ZINC000872378010	CE	On-Demand	Anodyne	PKM	46	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1C[C@@H]2C[C@H]2C1	ZINC000872378011	CE	On-Demand	Anodyne	PKM	46	39
O=C(O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872378020	CC	On-Demand	Mild	MLYCD	18	40
O=C(O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872378020	CC	On-Demand	Mild	L3MBTL3	78	40
CC(CCc1cccnc1)=NNCC(=O)O	ZINC000872378023	BD	On-Demand	Mild	TBXA2R	32	40
CC(CCc1cccnc1)=NNCC(=O)O	ZINC000872378023	BD	On-Demand	Mild	TBXAS1	105	53
CC(CCc1cccnc1)=NNCC(=O)O	ZINC000872378023	BD	On-Demand	Mild	PTAFR	32	43
CC(CCc1cccnc1)=NNCC(=O)O	ZINC000872378023	BD	On-Demand	Mild	NAMPT	41	50
O=C(Cc1cc[nH]n1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378166	FC	On-Demand	Reactive	LTA4H	27	40
O=C(Cc1cc[nH]n1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378166	FC	On-Demand	Reactive	EPHX2	15	44
O=C(Cc1cc[nH]n1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378166	FC	On-Demand	Reactive	FLT3	15	41
COc1cccc(NS(=O)(=O)c2cn(C)nc2C(C)(C)C)c1C	ZINC000872378184	EF	On-Demand	Anodyne	CCR4	15	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3cnn(CCF)c3)cc2N1	ZINC000872378190	GF	On-Demand	Anodyne	PKM	41	48
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	ACE	15	42
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	TACR1	27	42
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	CCKAR	51	41
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MPO	45	37
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	BRS3	26	42
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	NMBR	36	40
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MC3R	39	40
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MC5R	58	40
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MMP2	22	41
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	GRPR	52	33
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	ECE1	45	41
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MMP11	41	33
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	CCKBR	77	42
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	GHSR	54	39
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MMP9	20	47
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MC1R	61	40
CC(CCc1c[nH]c2ccccc12)=NNCC(=O)O	ZINC000872378195	CE	On-Demand	Mild	MMP1	17	40
O=C(COc1ccccc1O)NN=CC(F)(F)C(F)(F)F	ZINC000872378223	DE	On-Demand	Reactive	ADCYAP1R1	42	29
C#CC[C@@H]1CCN(S(=O)(=O)c2cc(Cl)c([N+](=O)[O-])cc2C)C1	ZINC000872378245	EF	On-Demand	Mild	EPHX2	17	41
C#CC[C@H]1CCN(S(=O)(=O)c2cc(Cl)c([N+](=O)[O-])cc2C)C1	ZINC000872378246	EF	On-Demand	Mild	EPHX2	17	41
CCC(=NNCC(=O)O)c1cccc(OC)c1OC	ZINC000872378255	CD	On-Demand	Mild	KCNK3	44	39
C#CC[C@@H]1CCN(S(=O)(=O)c2ccc(OC(C)C)nc2)C1	ZINC000872378259	DD	On-Demand	Mild	GCKR	76	36
C#CC[C@H]1CCN(S(=O)(=O)c2ccc(OC(C)C)nc2)C1	ZINC000872378260	DD	On-Demand	Mild	GCKR	76	36
O=C(NN=Cc1ccc(F)c2ccccc12)[C@H]1CCCO1	ZINC000872378291	CF	On-Demand	Reactive	GCGR	22	41
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCCO1	ZINC000872378357	CD	On-Demand	Reactive	CHRNA7	42	35
O=C(c1ccc(C=NOCC2CC2)cc1)N1CCCC1	ZINC000872378413	CF	On-Demand	Mild	L3MBTL3	92	44
COc1ccc(Cn2cc(C=NNCCO)nn2)cc1	ZINC000872378422	CC	On-Demand	Mild	PROKR1	68	38
CC(CCc1cccnc1)=NNCCO	ZINC000872378474	BC	On-Demand	Mild	TBXAS1	35	40
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@H]1CCCO1	ZINC000872378500	DF	On-Demand	Reactive	FAAH	63	37
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@H]1CCCO1	ZINC000872378500	DF	On-Demand	Reactive	CES1	57	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC1CC1	ZINC000872378504	CG	On-Demand	Reactive	EDNRA	20	44
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC1CC1	ZINC000872378504	CG	On-Demand	Reactive	MC5R	34	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC1CC1	ZINC000872378504	CG	On-Demand	Reactive	CCKBR	53	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC1CC1	ZINC000872378504	CG	On-Demand	Reactive	GHSR	49	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CC1CC1	ZINC000872378504	CG	On-Demand	Reactive	MC1R	15	41
Cc1nocc1S(=O)(=O)Nc1cccc2c1OC(C)(C)CC2	ZINC000872378576	DF	On-Demand	Anodyne	G2YM83_BOTF4	23	43
O=C(NNS(=O)(=O)CCC1CCCCC1)c1cccc(F)n1	ZINC000872378616	ED	On-Demand	Reactive	BMP1	71	35
O=C(NN=CCCCCCO)Nc1ccc2c(c1)OCO2	ZINC000872378634	CE	On-Demand	Reactive	CLK1	27	42
O=C(NN=CCCCCCO)Nc1ccc2c(c1)OCO2	ZINC000872378634	CE	On-Demand	Reactive	DYRK2	53	39
CCN(Cc1ccccc1)C(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000872378662	FG	On-Demand	Anodyne	HDAC8	16	43
CCN(Cc1ccccc1)C(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000872378662	FG	On-Demand	Anodyne	HDAC1	18	43
CCN(Cc1ccccc1)C(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000872378662	FG	On-Demand	Anodyne	LIMK2	29	49
O=C(CC1CC1)NN=Cc1ccc(F)c2ccccc12	ZINC000872378691	CG	On-Demand	Reactive	GCGR	26	44
CC(=O)Nc1cccc(C=NNC(=O)CC2CC2)c1	ZINC000872378706	CD	On-Demand	Reactive	ABAT	18	42
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@@H]1CCCCO1	ZINC000872378707	EG	On-Demand	Reactive	FAAH	59	36
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@@H]1CCCCO1	ZINC000872378707	EG	On-Demand	Reactive	CES1	53	35
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@H]1CCCCO1	ZINC000872378708	EG	On-Demand	Reactive	FAAH	59	36
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@H]1CCCCO1	ZINC000872378708	EG	On-Demand	Reactive	CES1	53	35
O=C(CC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378750	ED	On-Demand	Reactive	ESR1	61	36
O=C(CC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378750	ED	On-Demand	Reactive	ESR2	40	36
O=C(CC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378750	ED	On-Demand	Reactive	LTA4H	45	43
O=C(CC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378750	ED	On-Demand	Reactive	HRH3	19	41
O=C(CC1CC1)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378750	ED	On-Demand	Reactive	EPHX2	23	47
C(=NOCC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378759	DE	On-Demand	Mild	ESR1	63	37
C(=NOCC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378759	DE	On-Demand	Mild	ESR2	40	37
C(=NOCC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378759	DE	On-Demand	Mild	LTA4H	48	48
C(=NOCC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378759	DE	On-Demand	Mild	HRH3	24	41
C(=NOCC1CC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378759	DE	On-Demand	Mild	PSMB1	41	37
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	ESR1	64	37
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	ESR2	41	37
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	LTA4H	44	48
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	HRH3	18	44
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	EPHX2	17	45
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	PSMB2	40	37
OCCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872378793	CC	On-Demand	Mild	PSMB1	43	37
C(=NNc1nc(-c2cccnc2)no1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872378808	GE	On-Demand	Mild	LTA4H	18	40
Cn1ncc(S(=O)(=O)Nc2ccc(C(F)(F)F)c(F)c2)c1C(F)(F)F	ZINC000872378815	GG	On-Demand	Mild	SGK1	54	36
CC(CCc1c[nH]c2ccccc12)=NNCCO	ZINC000872378825	BE	On-Demand	Mild	MPO	45	45
CC(CCc1c[nH]c2ccccc12)=NNc1cnnn1C	ZINC000872378873	CF	On-Demand	Mild	HTR1D	24	40
CC(CCc1c[nH]c2ccccc12)=NNc1cnnn1C	ZINC000872378873	CF	On-Demand	Mild	HTR1B	21	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	ESR1	60	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	ESR2	40	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	LTA4H	42	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	HRH3	26	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	EPHX2	19	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCO1	ZINC000872378927	ED	On-Demand	Reactive	PSMB1	41	36
O=C(c1ccc(C=NNCCO)cc1)N1CCCC1	ZINC000872378933	CC	On-Demand	Mild	MLYCD	17	40
O=C(c1ccc(C=NNCCO)cc1)N1CCCC1	ZINC000872378933	CC	On-Demand	Mild	L3MBTL3	73	40
COc1cc(C=NNC(=O)[C@H]2CCCO2)c(Cl)cc1O	ZINC000872378940	CD	On-Demand	Reactive	GCGR	19	42
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCCO3)nn2)cc1	ZINC000872378942	EC	On-Demand	Reactive	PROKR1	56	33
C(=NOCC1CC1)c1cn(C[C@H]2CCCO2)nn1	ZINC000872379010	CD	On-Demand	Mild	PDE8B	42	34
C(=NOCC1CC1)c1cn(C[C@@H]2CCCO2)nn1	ZINC000872379011	CD	On-Demand	Mild	PDE8B	42	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCO1	ZINC000872379032	CF	On-Demand	Reactive	MC5R	28	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCO1	ZINC000872379032	CF	On-Demand	Reactive	GHSR	50	37
COc1cc(C=NNC(=O)CC2CC2)c(Cl)cc1O	ZINC000872379085	CE	On-Demand	Reactive	GCGR	26	42
COc1cc(C=NNC(=O)CC2CC2)c(Cl)cc1O	ZINC000872379085	CE	On-Demand	Reactive	ADCYAP1R1	43	35
Cn1nncc1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379086	EC	On-Demand	Mild	LTA4H	33	44
O=C(NN=Cc1ccc(F)c2ccccc12)[C@@H]1CCCCO1	ZINC000872379117	DF	On-Demand	Reactive	GCGR	21	41
O=C(NN=Cc1ccc(F)c2ccccc12)[C@H]1CCCCO1	ZINC000872379118	DF	On-Demand	Reactive	GCGR	21	41
O=C(CC1CC1)NN=Cc1cccc(F)c1I	ZINC000872379144	EF	On-Demand	Reactive	ABAT	22	47
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCCO1	ZINC000872379148	DG	On-Demand	Reactive	SSTR3	15	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCCO1	ZINC000872379148	DG	On-Demand	Reactive	GHSR	44	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCCO1	ZINC000872379149	DG	On-Demand	Reactive	SSTR3	15	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCCO1	ZINC000872379149	DG	On-Demand	Reactive	GHSR	44	37
CN1CCC(C=NNC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000872379150	CF	On-Demand	Reactive	SLC6A3	19	41
CN1CCC(C=NNC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000872379150	CF	On-Demand	Reactive	HTR1F	43	33
CN1CCC(C=NNC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000872379150	CF	On-Demand	Reactive	EPHX2	30	44
CN1CCC(C=NNC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000872379160	DD	On-Demand	Reactive	HTR1F	21	40
CN1CCC(C=NNC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000872379160	DD	On-Demand	Reactive	NOS2	53	32
CN1CCC(C=NNC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000872379160	DD	On-Demand	Reactive	DYRK2	50	35
O=C(c1ccc(C=NOCCC2CC2)cc1)N1CCCC1	ZINC000872379203	CG	On-Demand	Mild	L3MBTL3	91	42
OCCNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872379218	CD	On-Demand	Mild	SIGMAR1	27	44
CC(C)(C)OC(=O)NCc1cccc(C=NNCCO)c1	ZINC000872379224	CD	On-Demand	Mild	PDS	41	32
O=C(CC1CC1)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872379242	CE	On-Demand	Reactive	L3MBTL3	91	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)Nc1ccc2c(c1)OCO2	ZINC000872379350	GF	On-Demand	Reactive	DYRK2	40	34
CCC(=NNC(=O)CC1CC1)c1cccc(OC)c1OC	ZINC000872379354	CF	On-Demand	Reactive	DRD2	20	41
CC(CCc1cccnc1)=NNC(=O)CC1CC1	ZINC000872379356	BE	On-Demand	Reactive	TBXAS1	30	40
CC(CCc1cccnc1)=NNC(=O)CC1CC1	ZINC000872379356	BE	On-Demand	Reactive	CHRNA7	43	35
CC(CCc1cccnc1)=NNC(=O)CC1CC1	ZINC000872379356	BE	On-Demand	Reactive	C3AR1	39	40
CC(CCc1cccnc1)=NNC(=O)CC1CC1	ZINC000872379356	BE	On-Demand	Reactive	NAMPT	27	42
Cn1nncc1NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872379390	CD	On-Demand	Mild	L3MBTL3	55	35
COc1ccc(Cn2cc(C=NNC(=O)CC3CC3)nn2)cc1	ZINC000872379447	DD	On-Demand	Reactive	PROKR1	57	34
COc1ccc(Cn2cc(C=NN[C@H]3CCOC3(C)C)nn2)cc1	ZINC000872379494	ED	On-Demand	Mild	PROKR1	53	32
COc1ccc(Cn2cc(C=NN[C@@H]3CCOC3(C)C)nn2)cc1	ZINC000872379495	ED	On-Demand	Mild	PROKR1	53	32
CN1CCC(C=NNc2ccc(C(=O)O)nc2)CC1	ZINC000872379513	CD	On-Demand	Mild	HTR1F	45	33
C#CCNN=C(C)CCc1cccnc1	ZINC000872379641	BD	On-Demand	Mild	TBXAS1	28	40
C#CCNN=C(C)CCc1cccnc1	ZINC000872379641	BD	On-Demand	Mild	NAMPT	17	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	LTA4H	39	45
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	MAPK14	17	41
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	MET	23	41
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	EPHX2	24	47
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	FLT3	15	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1F	ZINC000872379676	GF	On-Demand	Mild	STAT6	44	33
C#CCNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872379699	CD	On-Demand	Mild	L3MBTL3	73	39
COC(=O)c1cc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)ccc1F	ZINC000872379737	FG	On-Demand	Mild	L3MBTL3	41	32
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	ESR1	63	35
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	ESR2	44	35
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	LTA4H	45	48
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	HRH3	31	44
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	PSMB2	41	39
C#CCNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379784	CC	On-Demand	Mild	PSMB1	45	40
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c(F)c1	ZINC000872379808	FH	On-Demand	Mild	DRD4	26	41
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c(F)c1	ZINC000872379808	FH	On-Demand	Mild	ACHE	31	41
O=C(O)c1ccc(NN=C2CCOC3(CCCC3)C2)cc1F	ZINC000872379840	DG	On-Demand	Mild	RARA	15	42
C#CCNN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872379841	CE	On-Demand	Mild	PDS	59	34
C=CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379880	CD	On-Demand	Mild	ESR1	50	38
C=CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379880	CD	On-Demand	Mild	LTA4H	43	50
C=CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379880	CD	On-Demand	Mild	HRH3	20	43
C=CCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872379880	CD	On-Demand	Mild	PSMB1	42	38
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	ESR1	44	35
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	LTA4H	28	42
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	MAPK14	18	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	HRH3	15	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	EPHX2	22	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	FLT3	16	43
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)c(F)c1	ZINC000872379921	GF	On-Demand	Mild	PSMB1	40	37
O=C(O)c1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1F	ZINC000872379945	FH	On-Demand	Mild	SIGMAR1	28	40
CC(CCc1cccnc1)=NNCc1ccccc1F	ZINC000872379962	CG	On-Demand	Mild	NAMPT	16	41
COc1ccc(Cn2cc(C=NOC(C)C)nn2)cc1	ZINC000872380029	CE	On-Demand	Mild	PROKR1	43	31
CCC(CCC(F)(F)F)=NNc1ccc(F)c(C(=O)OC)c1	ZINC000872380092	DI	On-Demand	Mild	DHODH	15	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCCO1	ZINC000872380093	FD	On-Demand	Reactive	ESR1	57	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCCO1	ZINC000872380093	FD	On-Demand	Reactive	LTA4H	38	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCCO1	ZINC000872380093	FD	On-Demand	Reactive	HRH3	25	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCCO1	ZINC000872380093	FD	On-Demand	Reactive	EPHX2	19	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCCO1	ZINC000872380093	FD	On-Demand	Reactive	PSMB1	41	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCCO1	ZINC000872380096	FD	On-Demand	Reactive	ESR1	57	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCCO1	ZINC000872380096	FD	On-Demand	Reactive	LTA4H	38	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCCO1	ZINC000872380096	FD	On-Demand	Reactive	HRH3	25	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCCO1	ZINC000872380096	FD	On-Demand	Reactive	EPHX2	19	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCCO1	ZINC000872380096	FD	On-Demand	Reactive	PSMB1	41	36
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCCCO3)nn2)cc1	ZINC000872380109	ED	On-Demand	Reactive	PROKR1	56	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCCCO3)nn2)cc1	ZINC000872380110	ED	On-Demand	Reactive	PROKR1	56	33
C#CCNN=C(C)CCc1c[nH]c2ccccc12	ZINC000872380112	BF	On-Demand	Mild	MPO	65	44
C(=Nn1ccnn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872380114	DC	On-Demand	Mild	LTA4H	41	47
C(=Nn1ccnn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872380114	DC	On-Demand	Mild	PSMB1	40	36
O=C(c1ccc(C=NNCc2ccccc2F)cc1)N1CCCC1	ZINC000872380168	EG	On-Demand	Mild	L3MBTL3	57	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@]1(C)CCCO1	ZINC000872380187	DG	On-Demand	Reactive	NMBR	80	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@]1(C)CCCO1	ZINC000872380187	DG	On-Demand	Reactive	GRPR	43	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@]1(C)CCCO1	ZINC000872380189	DG	On-Demand	Reactive	NMBR	80	34
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@]1(C)CCCO1	ZINC000872380189	DG	On-Demand	Reactive	GRPR	43	34
C(=NNc1ccncn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872380202	ED	On-Demand	Mild	LTA4H	35	44
O=C(c1ccc(C=NNc2ccncn2)cc1)N1CCCC1	ZINC000872380304	CE	On-Demand	Mild	L3MBTL3	47	35
CC(=O)Nc1cccc(C=NOC(C)C)c1	ZINC000872380312	BE	On-Demand	Mild	KCNK3	98	37
CC(=O)Nc1cccc(C=NOC(C)C)c1	ZINC000872380312	BE	On-Demand	Mild	KCNK9	72	37
O=C(c1ccc(C=Nn2ccnn2)cc1)N1CCCC1	ZINC000872380323	CD	On-Demand	Mild	MLYCD	18	41
O=C(c1ccc(C=Nn2ccnn2)cc1)N1CCCC1	ZINC000872380323	CD	On-Demand	Mild	L3MBTL3	57	38
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	LTA4H	38	44
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	EPHX2	21	48
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	FLT3	18	41
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	EPHA2	19	40
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	MKNK1	27	40
O=C(O)c1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cn1	ZINC000872380350	FD	On-Demand	Mild	TBK1	15	42
C=CCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872380366	CE	On-Demand	Mild	MLYCD	17	40
C=CCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872380366	CE	On-Demand	Mild	L3MBTL3	63	40
COc1ccc(Cn2cc(C=NN[C@@H](C)C(F)(F)F)nn2)cc1	ZINC000872380481	EE	On-Demand	Mild	PROKR1	54	32
COc1ccc(Cn2cc(C=NN[C@H](C)C(F)(F)F)nn2)cc1	ZINC000872380482	EE	On-Demand	Mild	PROKR1	54	32
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	ESR1	58	37
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	ESR2	40	37
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	LTA4H	35	42
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	HRH3	24	42
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	EPHX2	18	43
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	PSMB2	40	37
C[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCO1	ZINC000872380505	FD	On-Demand	Reactive	PSMB1	43	38
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCCO1	ZINC000872380560	CE	On-Demand	Reactive	CHRNA7	40	36
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCCO1	ZINC000872380560	CE	On-Demand	Reactive	C3AR1	39	41
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCCCO1	ZINC000872380561	CE	On-Demand	Reactive	CHRNA7	40	36
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCCCO1	ZINC000872380561	CE	On-Demand	Reactive	C3AR1	39	41
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCCO1	ZINC000872380592	ED	On-Demand	Reactive	L3MBTL3	79	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCCO1	ZINC000872380593	ED	On-Demand	Reactive	L3MBTL3	79	40
CC(CCc1c[nH]c2ccccc12)=NN[C@H](C)C(F)(F)F	ZINC000872380608	CI	On-Demand	Mild	TACR1	18	42
CC(CCc1c[nH]c2ccccc12)=NN[C@H](C)C(F)(F)F	ZINC000872380608	CI	On-Demand	Mild	MPO	45	42
CC(CCc1c[nH]c2ccccc12)=NN[C@H](C)C(F)(F)F	ZINC000872380608	CI	On-Demand	Mild	NMBR	40	36
CC(CCc1c[nH]c2ccccc12)=NN[C@@H](C)C(F)(F)F	ZINC000872380609	CI	On-Demand	Mild	TACR1	18	42
CC(CCc1c[nH]c2ccccc12)=NN[C@@H](C)C(F)(F)F	ZINC000872380609	CI	On-Demand	Mild	MPO	45	42
CC(CCc1c[nH]c2ccccc12)=NN[C@@H](C)C(F)(F)F	ZINC000872380609	CI	On-Demand	Mild	NMBR	40	36
O=C(NN=Cc1cn(C[C@H]2CCCO2)nn1)[C@H]1CCCCO1	ZINC000872380612	DC	On-Demand	Reactive	PDE8B	45	33
O=C(NN=Cc1cn(C[C@H]2CCCO2)nn1)[C@@H]1CCCCO1	ZINC000872380613	DC	On-Demand	Reactive	PDE8B	45	33
O=C(NN=Cc1cn(C[C@@H]2CCCO2)nn1)[C@H]1CCCCO1	ZINC000872380614	DC	On-Demand	Reactive	PDE8B	45	33
O=C(NN=Cc1cn(C[C@@H]2CCCO2)nn1)[C@@H]1CCCCO1	ZINC000872380615	DC	On-Demand	Reactive	PDE8B	45	33
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=C(CC)CCC(F)(F)F	ZINC000872380621	FG	On-Demand	Reactive	PAPA1_CARPA	35	40
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=C(CC)CCC(F)(F)F	ZINC000872380624	FG	On-Demand	Reactive	PAPA1_CARPA	35	40
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1c(OC)cc(F)cc1OC	ZINC000872380656	GE	On-Demand	Reactive	PAPA1_CARPA	34	40
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1c(OC)cc(F)cc1OC	ZINC000872380658	GE	On-Demand	Reactive	PAPA1_CARPA	34	40
CSc1ccc(NN=C(C)CCc2cccnc2)cc1	ZINC000872380663	CI	On-Demand	Mild	NAMPT	22	41
CC(CCc1cccnc1)=NOC(C)C	ZINC000872380664	BF	On-Demand	Mild	TBXAS1	27	41
CC(=NN(C)C[C@@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872380677	CD	On-Demand	Mild	COLA	51	32
CC(=NN(C)C[C@H](C)O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872380679	CD	On-Demand	Mild	COLA	51	32
C[C@H](O)CN(C)N=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872380719	DE	On-Demand	Mild	PDS	41	32
CNC(=S)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872380745	ED	On-Demand	Mild	ESR1	81	40
CNC(=S)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872380745	ED	On-Demand	Mild	ESR2	52	40
CNC(=S)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872380745	ED	On-Demand	Mild	LTA4H	36	46
CNC(=S)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872380745	ED	On-Demand	Mild	PSMB1	41	36
CSc1ccc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872380838	EI	On-Demand	Mild	L3MBTL3	61	37
CNC(=S)N(C)N=C(C)CCc1c[nH]c2ccccc12	ZINC000872380847	CF	On-Demand	Mild	MPO	22	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNc1ccncn1)C2	ZINC000872380870	EG	On-Demand	Mild	GPR119	20	43
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=CC(F)(F)C(F)(F)F	ZINC000872380871	FE	On-Demand	Reactive	CTSK	17	40
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=CC(F)(F)C(F)(F)F	ZINC000872380873	FE	On-Demand	Reactive	CTSK	17	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1nnn(C)c1C	ZINC000872380916	DE	On-Demand	Reactive	MC5R	48	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1nnn(C)c1C	ZINC000872380916	DE	On-Demand	Reactive	GHSR	51	40
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872381013	FE	On-Demand	Reactive	REN	43	37
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccnn1CC1CCC1	ZINC000872381014	FE	On-Demand	Reactive	REN	43	37
COc1cc(C=NNC(=O)[C@H]2CCCCO2)c(Cl)cc1O	ZINC000872381062	DE	On-Demand	Reactive	GCGR	17	43
COc1cc(C=NNC(=O)[C@@H]2CCCCO2)c(Cl)cc1O	ZINC000872381063	DE	On-Demand	Reactive	GCGR	17	43
C[C@H](O)CN(C)N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872381341	CD	On-Demand	Mild	L3MBTL3	60	40
C[C@H](O)CN(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872381399	DD	On-Demand	Mild	ESR1	83	40
C[C@H](O)CN(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872381399	DD	On-Demand	Mild	ESR2	53	40
C[C@H](O)CN(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872381399	DD	On-Demand	Mild	LTA4H	39	46
C[C@H](O)CN(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872381399	DD	On-Demand	Mild	HRH3	20	40
C[C@H](O)CN(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872381399	DD	On-Demand	Mild	PSMB1	43	41
CC(CCOCc1ccccc1)=NNC(=O)c1nnn(C)c1C	ZINC000872381447	DD	On-Demand	Reactive	PPO2	34	40
C[C@H](O)CN(C)N=Cc1cccc(S(N)(=O)=O)c1	ZINC000872381463	CB	On-Demand	Mild	CA2	17	42
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1c(F)cccc1OCC	ZINC000872381469	GF	On-Demand	Reactive	PAPA1_CARPA	35	41
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1c(F)cccc1OCC	ZINC000872381470	GF	On-Demand	Reactive	PAPA1_CARPA	35	41
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CTSD	15	40
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	PGC	58	39
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CTSB	41	36
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	PAPA1_CARPA	63	46
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CCKAR	42	35
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CTSK	26	51
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CTSL	26	46
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CAPNS1	53	33
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	REN	76	43
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	CAPN1	39	40
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	FPR1	58	43
C[C@H](O)CN(C)N=CC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381509	EF	On-Demand	Mild	NPR	55	32
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CTSD	15	40
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	PGC	58	39
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CTSB	41	36
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	PAPA1_CARPA	63	46
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CCKAR	42	35
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CTSK	26	51
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CTSL	26	46
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CAPNS1	53	33
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	REN	76	43
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	CAPN1	39	40
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	FPR1	58	43
C[C@H](O)CN(C)N=CC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000872381511	EF	On-Demand	Mild	NPR	55	32
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872381516	FE	On-Demand	Reactive	PAPA1_CARPA	33	40
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872381516	FE	On-Demand	Reactive	FPR1	43	36
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872381517	FE	On-Demand	Reactive	PAPA1_CARPA	33	40
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=C(C)CCc1cccnc1	ZINC000872381517	FE	On-Demand	Reactive	FPR1	43	36
CNC(=S)N(C)N=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872381526	DD	On-Demand	Mild	PROKR1	53	32
C[C@H](O)CN(C)N=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872381590	DE	On-Demand	Mild	SIGMAR1	17	42
CNC(=S)N(C)N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872381619	DD	On-Demand	Mild	L3MBTL3	56	39
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1CC(F)(F)F	ZINC000872381745	GG	On-Demand	Reactive	PAPA1_CARPA	36	41
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1CC(F)(F)F	ZINC000872381745	GG	On-Demand	Reactive	FPR1	45	35
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1CC(F)(F)F	ZINC000872381746	GG	On-Demand	Reactive	PAPA1_CARPA	36	41
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1CC(F)(F)F	ZINC000872381746	GG	On-Demand	Reactive	FPR1	45	35
Cc1c(C=NN(C)C[C@@H](C)O)cccc1[N+](=O)[O-]	ZINC000872381777	CD	On-Demand	Mild	COLA	95	34
Cc1c(C=NN(C)C[C@H](C)O)cccc1[N+](=O)[O-]	ZINC000872381778	CD	On-Demand	Mild	COLA	95	34
COC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(OC)cc2F)s1	ZINC000872381825	GF	On-Demand	Anodyne	MTNR1A	48	43
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCCOC3)nn2)cc1	ZINC000872381843	ED	On-Demand	Reactive	PROKR1	55	33
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCCOC3)nn2)cc1	ZINC000872381844	ED	On-Demand	Reactive	PROKR1	55	33
O=C(NN=Cc1cccc(CC2CCC2)c1)c1ccnnc1	ZINC000872381853	CF	On-Demand	Reactive	ADCYAP1R1	43	37
CN1CCC(C=NNC(=O)c2ccnnc2)CC1	ZINC000872381859	BC	On-Demand	Reactive	HTR1F	46	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872382023	FD	On-Demand	Reactive	ESR1	68	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872382023	FD	On-Demand	Reactive	ESR2	47	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872382023	FD	On-Demand	Reactive	LTA4H	45	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872382023	FD	On-Demand	Reactive	EPHX2	20	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCOC1	ZINC000872382023	FD	On-Demand	Reactive	PSMB1	42	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872382024	FD	On-Demand	Reactive	ESR1	68	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872382024	FD	On-Demand	Reactive	ESR2	47	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872382024	FD	On-Demand	Reactive	LTA4H	45	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872382024	FD	On-Demand	Reactive	EPHX2	20	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCOC1	ZINC000872382024	FD	On-Demand	Reactive	PSMB1	42	36
O=C(NN=Cc1ccc(F)c2ccccc12)[C@@H]1CCCOC1	ZINC000872382059	DF	On-Demand	Reactive	GCGR	15	41
O=C(NN=Cc1ccc(F)c2ccccc12)[C@H]1CCCOC1	ZINC000872382060	DF	On-Demand	Reactive	GCGR	15	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCS1	ZINC000872382088	FD	On-Demand	Reactive	ESR1	62	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCS1	ZINC000872382088	FD	On-Demand	Reactive	ESR2	41	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCS1	ZINC000872382088	FD	On-Demand	Reactive	LTA4H	38	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCS1	ZINC000872382088	FD	On-Demand	Reactive	HRH3	17	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1CCCS1	ZINC000872382088	FD	On-Demand	Reactive	EPHX2	22	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCS1	ZINC000872382089	FD	On-Demand	Reactive	ESR1	62	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCS1	ZINC000872382089	FD	On-Demand	Reactive	ESR2	41	35
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCS1	ZINC000872382089	FD	On-Demand	Reactive	LTA4H	38	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCS1	ZINC000872382089	FD	On-Demand	Reactive	HRH3	17	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1CCCS1	ZINC000872382089	FD	On-Demand	Reactive	EPHX2	22	47
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccnnc1	ZINC000872382136	FC	On-Demand	Reactive	LTA4H	32	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccnnc1	ZINC000872382136	FC	On-Demand	Reactive	EPHX2	18	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccnnc1	ZINC000872382136	FC	On-Demand	Reactive	FLT3	18	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCOC1	ZINC000872382154	DG	On-Demand	Reactive	MC5R	29	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCOC1	ZINC000872382154	DG	On-Demand	Reactive	CCKBR	41	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCOC1	ZINC000872382154	DG	On-Demand	Reactive	GHSR	49	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCOC1	ZINC000872382155	DG	On-Demand	Reactive	MC5R	29	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCOC1	ZINC000872382155	DG	On-Demand	Reactive	CCKBR	41	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCOC1	ZINC000872382155	DG	On-Demand	Reactive	GHSR	49	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCS1	ZINC000872382443	DG	On-Demand	Reactive	NMBR	41	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCS1	ZINC000872382443	DG	On-Demand	Reactive	MC5R	28	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCS1	ZINC000872382443	DG	On-Demand	Reactive	GHSR	46	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCS1	ZINC000872382444	DG	On-Demand	Reactive	NMBR	41	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCS1	ZINC000872382444	DG	On-Demand	Reactive	MC5R	28	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCCS1	ZINC000872382444	DG	On-Demand	Reactive	GHSR	46	37
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCCS3)nn2)cc1	ZINC000872382477	ED	On-Demand	Reactive	PROKR1	53	32
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCCS3)nn2)cc1	ZINC000872382478	ED	On-Demand	Reactive	PROKR1	53	32
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	CYSLTR1	30	47
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	PPIA	32	42
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	LTA4H	17	44
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	PTGER1	64	50
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	UL80	22	40
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	NR1I2	41	40
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	TAAR1	23	41
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	FFAR1	38	40
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	AKR1C3	27	41
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	LIMK2	33	47
O=C(O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872382597	HH	On-Demand	Anodyne	PDS	65	34
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	CA2	17	47
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	ADRB2	18	44
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	ADRB1	21	44
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MAOB	42	41
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	CYSLTR1	20	40
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	PPIA	40	39
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	ADRB3	33	41
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	LTA4H	19	44
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	FABP4	45	34
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	CA1	16	47
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	CA7	18	47
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP13	38	55
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	ADAM17	39	55
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	PPARD	33	52
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	CA4	15	41
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP2	28	55
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP14	24	55
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	PLA2G4B	32	40
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	PRTN3	58	40
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP9	26	55
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP12	15	40
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	ADAMTS4	47	45
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	MMP1	17	40
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	PTGDR2	21	46
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	FFAR1	76	49
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	FFAR4	53	42
O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382623	HH	On-Demand	Anodyne	LIMK2	38	51
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872382714	HI	On-Demand	Bother	NR1I2	30	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	PTGER1	49	47
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	MMP13	18	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	TRY2_BOVIN	48	33
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	ADAM17	20	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	CCR2	16	47
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	NR1I2	41	39
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	ADAMTS4	38	40
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	FFAR1	27	40
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	MCL1	17	44
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	LIMK2	35	47
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Cl	ZINC000872382717	HI	On-Demand	Anodyne	PDS	43	33
O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1O	ZINC000872382748	HH	On-Demand	Bother	HSD17B1	31	42
O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1O	ZINC000872382748	HH	On-Demand	Bother	HSD17B2	17	42
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCS1	ZINC000872382805	EE	On-Demand	Reactive	L3MBTL3	78	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCS1	ZINC000872382806	EE	On-Demand	Reactive	L3MBTL3	78	40
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCOC1	ZINC000872382813	ED	On-Demand	Reactive	L3MBTL3	72	39
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000872382814	ED	On-Demand	Reactive	L3MBTL3	72	39
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	CA2	22	42
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	ADRB2	23	48
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	ADRB1	24	48
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	CYSLTR1	26	43
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	ADRB3	54	44
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	LTA4H	15	45
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	TBXA2R	55	42
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	TBXAS1	40	41
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	PTGER4	23	42
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	CA1	22	42
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	CA7	17	40
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	PTGER3	73	38
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	MMP13	22	46
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	ADAM17	18	46
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	MMP2	21	46
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	MMP14	17	46
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	FAAH	20	41
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	MMP9	15	46
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	NR1I2	36	40
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	ADAMTS4	41	44
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	FFAR1	116	63
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	FFAR4	73	55
O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872382848	HI	On-Demand	Anodyne	LIMK2	40	53
COc1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc(C(=O)O)c1OC	ZINC000872382877	IH	On-Demand	Anodyne	MAOB	26	41
COc1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc(C(=O)O)c1OC	ZINC000872382877	IH	On-Demand	Anodyne	MMP9	21	41
COc1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc(C(=O)O)c1OC	ZINC000872382877	IH	On-Demand	Anodyne	MMP1	19	41
COc1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc(C(=O)O)c1OC	ZINC000872382877	IH	On-Demand	Anodyne	AKR1C3	18	40
COc1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc(C(=O)O)c1OC	ZINC000872382877	IH	On-Demand	Anodyne	LIMK2	29	48
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccccc2CCSC)c1	ZINC000872382881	GG	On-Demand	Anodyne	CPT1A	43	30
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000872383045	FG	On-Demand	Reactive	NMBR	48	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000872383045	FG	On-Demand	Reactive	GHSR	40	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000872383046	FG	On-Demand	Reactive	NMBR	48	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000872383046	FG	On-Demand	Reactive	GHSR	40	37
CCO[C@]1(C(=O)NN=Cc2cn(Cc3ccc(OC)cc3)nn2)CCOC1	ZINC000872383075	FC	On-Demand	Reactive	PROKR1	44	30
CCO[C@@]1(C(=O)NN=Cc2cn(Cc3ccc(OC)cc3)nn2)CCOC1	ZINC000872383076	FC	On-Demand	Reactive	PROKR1	44	30
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	CA2	16	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	CA1	15	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	CA7	17	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	MMP13	26	44
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	TRY2_BOVIN	41	32
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	ADAM17	29	44
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	MMP9	20	44
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	MMP1	17	40
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1Br	ZINC000872383094	JJ	On-Demand	Anodyne	LIMK2	34	46
CCO[C@@]1(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)CCOC1	ZINC000872383227	EF	On-Demand	Reactive	NMBR	43	34
CCO[C@]1(C(=O)NN=C(C)CCc2c[nH]c3ccccc23)CCOC1	ZINC000872383230	EF	On-Demand	Reactive	NMBR	43	34
CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cnn(C3CCN(C)CC3)c2)c1	ZINC000872383414	GF	On-Demand	Anodyne	MAP3K7	42	38
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	CYSLTR1	18	41
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	PTGER1	57	40
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	PTGER3	40	36
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	MMP13	16	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	TRY2_BOVIN	47	33
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	ADAM17	20	42
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	FFAR1	35	40
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	LIMK2	35	47
O=C(O)c1cc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)ccc1F	ZINC000872383467	HH	On-Demand	Anodyne	PDS	55	34
O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872383512	JJ	On-Demand	Anodyne	CYSLTR1	26	46
O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872383512	JJ	On-Demand	Anodyne	PPIA	29	42
O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872383512	JJ	On-Demand	Anodyne	PTGER1	36	40
O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872383512	JJ	On-Demand	Anodyne	AKR1C3	23	41
O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872383512	JJ	On-Demand	Anodyne	LIMK2	27	44
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	TSHR	42	33
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	CYSLTR1	34	44
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	PPIA	37	42
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	PTGER1	54	41
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	CPT1A	56	53
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	CPT2	43	33
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	CPT1B	42	40
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	ALPL	21	44
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	AKR1C3	33	42
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	ADCYAP1R1	50	36
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	LIMK2	28	49
COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872383543	HH	On-Demand	Anodyne	KCNK3	41	34
COc1ccc(Cn2cc(C=NNC34CC(C3)C4)nn2)cc1	ZINC000872383589	CD	On-Demand	Mild	PROKR1	54	32
CCCc1ccc(S(=O)(=O)NNC(=O)COCCOC)cc1	ZINC000872383689	EC	On-Demand	Reactive	CA2	19	41
CCCc1ccc(S(=O)(=O)NNC(=O)COCCOC)cc1	ZINC000872383689	EC	On-Demand	Reactive	CA4	15	40
CCCc1ccc(S(=O)(=O)NNC(=O)COCCOC)cc1	ZINC000872383689	EC	On-Demand	Reactive	IDO1	25	44
CC(=O)Nc1cccc(C=NNC(=O)OC(C)C)c1	ZINC000872383828	CE	On-Demand	Reactive	KCNK3	55	34
CC(=O)Nc1cccc(C=NNC(=O)OC(C)C)c1	ZINC000872383828	CE	On-Demand	Reactive	KCNK9	44	34
CCO[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCOC1	ZINC000872383844	GD	On-Demand	Reactive	LTA4H	27	41
CCO[C@@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCOC1	ZINC000872383844	GD	On-Demand	Reactive	EPHX2	16	41
CCO[C@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCOC1	ZINC000872383845	GD	On-Demand	Reactive	LTA4H	27	41
CCO[C@]1(C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCOC1	ZINC000872383845	GD	On-Demand	Reactive	EPHX2	16	41
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	ESR1	65	38
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	ESR2	43	38
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	LTA4H	41	46
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	HRH3	17	40
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	EPHX2	25	49
C(=NNC12CC(C1)C2)c1ccc(OCCN2CCOCC2)cc1	ZINC000872383939	DD	On-Demand	Mild	PSMB1	40	36
O=S(=O)(Nc1cccc(OCc2ccccc2)c1)N1CCOCC1	ZINC000872384003	EE	On-Demand	Anodyne	CYSLTR1	16	41
O=S(=O)(Nc1cccc(OCc2ccccc2)c1)N1CCOCC1	ZINC000872384003	EE	On-Demand	Anodyne	PRKDC	15	44
CC(CCc1cccnc1)=NNC(=O)[C@H]1CNC(=O)C1	ZINC000872384093	CC	On-Demand	Reactive	NAMPT	22	40
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CNC(=O)C1	ZINC000872384094	CC	On-Demand	Reactive	NAMPT	22	40
c1ccc(CN2C[C@H]3C(=NNC45CC(C4)C5)CC[C@H]3C2)cc1	ZINC000872384120	CG	On-Demand	Mild	SIGMAR1	21	44
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000872384133	FD	On-Demand	Anodyne	NMT1	44	42
CCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384147	CE	On-Demand	Mild	ESR1	50	36
CCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384147	CE	On-Demand	Mild	LTA4H	43	50
CCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384147	CE	On-Demand	Mild	HRH3	25	43
CCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384147	CE	On-Demand	Mild	PSMB2	41	38
CCCON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384147	CE	On-Demand	Mild	PSMB1	44	41
CC(CCOCc1ccccc1)=NNC(=O)[C@@H]1CCO[C@@H]1C	ZINC000872384154	DF	On-Demand	Reactive	NAAA	37	42
CC(CCOCc1ccccc1)=NNC(=O)[C@@H]1CCO[C@H]1C	ZINC000872384155	DF	On-Demand	Reactive	NAAA	37	42
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CCO[C@H]1C	ZINC000872384156	DF	On-Demand	Reactive	NAAA	37	42
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CCO[C@@H]1C	ZINC000872384157	DF	On-Demand	Reactive	NAAA	37	42
CC(=O)Nc1cccc(C=NNC23CC(C2)C3)c1	ZINC000872384168	BE	On-Demand	Mild	EPHX2	28	44
C[C@H](CO)N(C)N=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872384185	DE	On-Demand	Mild	PDS	56	34
C[C@@H](CO)N(C)N=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872384186	DE	On-Demand	Mild	PDS	56	34
O=S(=O)(Nc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000872384200	DG	On-Demand	Anodyne	MAOB	43	41
O=S(=O)(Nc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000872384200	DG	On-Demand	Anodyne	ADAM17	15	40
O=S(=O)(Nc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000872384200	DG	On-Demand	Anodyne	FFAR1	27	41
C[C@@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384235	DD	On-Demand	Mild	ESR1	76	39
C[C@@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384235	DD	On-Demand	Mild	ESR2	50	39
C[C@@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384235	DD	On-Demand	Mild	LTA4H	33	45
C[C@@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384235	DD	On-Demand	Mild	HRH3	18	41
C[C@@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384235	DD	On-Demand	Mild	PSMB1	42	39
C[C@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384236	DD	On-Demand	Mild	ESR1	76	39
C[C@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384236	DD	On-Demand	Mild	ESR2	50	39
C[C@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384236	DD	On-Demand	Mild	LTA4H	33	45
C[C@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384236	DD	On-Demand	Mild	HRH3	18	41
C[C@H](CO)N(C)N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872384236	DD	On-Demand	Mild	PSMB1	42	39
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	CA2	19	42
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	ADRB2	19	44
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	ADRB1	19	44
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	CYSLTR1	21	43
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	PPIA	38	40
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	ADRB3	35	41
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	PTGER4	21	49
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	CA1	20	42
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	CA7	18	42
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	PTGER3	49	36
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	MMP13	26	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	ADAM17	27	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	MMP2	22	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	MMP14	17	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	NR1H3	17	41
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	GHSR	18	40
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	MMP9	17	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	NR1I2	40	37
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	ADAMTS4	44	45
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	NR1H2	24	41
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	PTGDR2	15	55
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	FFAR1	61	47
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	FFAR4	46	40
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	LIMK2	39	52
O=C(O)Cc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1	ZINC000872384255	GH	On-Demand	Anodyne	PDS	40	31
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CNC(=O)C1	ZINC000872384286	DD	On-Demand	Reactive	GHSR	41	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CNC(=O)C1	ZINC000872384287	DD	On-Demand	Reactive	GHSR	41	37
CCCON=Cc1cccc(S(N)(=O)=O)c1	ZINC000872384299	BD	On-Demand	Mild	CA2	21	43
CCCON=Cc1cccc(S(N)(=O)=O)c1	ZINC000872384299	BD	On-Demand	Mild	CA7	22	41
CCCON=Cc1cccc(NC(C)=O)c1	ZINC000872384306	BE	On-Demand	Mild	FAAH	18	40
CC(CCc1c[nH]c2ccccc12)=NNC12CC(C1)C2	ZINC000872384331	CH	On-Demand	Mild	HTR1D	18	43
CC(CCc1c[nH]c2ccccc12)=NNC12CC(C1)C2	ZINC000872384331	CH	On-Demand	Mild	HTR1B	15	43
CC(CCc1c[nH]c2ccccc12)=NNC12CC(C1)C2	ZINC000872384331	CH	On-Demand	Mild	MPO	51	43
CC(CCc1c[nH]c2ccccc12)=NNC12CC(C1)C2	ZINC000872384331	CH	On-Demand	Mild	CCKBR	45	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCO[C@H]1C	ZINC000872384333	DG	On-Demand	Reactive	GHSR	42	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCO[C@@H]1C	ZINC000872384334	DG	On-Demand	Reactive	GHSR	42	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCO[C@@H]1C	ZINC000872384335	DG	On-Demand	Reactive	GHSR	42	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCO[C@H]1C	ZINC000872384336	DG	On-Demand	Reactive	GHSR	42	36
CCCON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872384435	CF	On-Demand	Mild	L3MBTL3	69	39
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCO[C@H]3C)nn2)cc1	ZINC000872384509	ED	On-Demand	Reactive	PROKR1	56	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCO[C@H]3C)nn2)cc1	ZINC000872384510	ED	On-Demand	Reactive	PROKR1	56	33
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCO[C@@H]3C)nn2)cc1	ZINC000872384511	ED	On-Demand	Reactive	PROKR1	56	33
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3CCO[C@@H]3C)nn2)cc1	ZINC000872384512	ED	On-Demand	Reactive	PROKR1	56	33
O=C(O)c1cc(F)c(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872384559	HI	On-Demand	Anodyne	CYSLTR1	18	42
O=C(O)c1cc(F)c(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872384559	HI	On-Demand	Anodyne	PTGER1	47	41
O=C(O)c1cc(F)c(F)c(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c1	ZINC000872384559	HI	On-Demand	Anodyne	PDS	52	33
O=C1C[C@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)CN1	ZINC000872384608	EC	On-Demand	Reactive	L3MBTL3	59	37
O=C1C[C@@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)CN1	ZINC000872384610	EC	On-Demand	Reactive	L3MBTL3	59	37
O=S(=O)(C[C@H]1CCCO1)Nc1cccc(OCc2ccccc2)c1	ZINC000872384702	EG	On-Demand	Anodyne	MAOB	17	43
O=S(=O)(C[C@H]1CCCO1)Nc1cccc(OCc2ccccc2)c1	ZINC000872384702	EG	On-Demand	Anodyne	CYSLTR1	18	41
O=S(=O)(C[C@@H]1CCCO1)Nc1cccc(OCc2ccccc2)c1	ZINC000872384703	EG	On-Demand	Anodyne	MAOB	17	43
O=S(=O)(C[C@@H]1CCCO1)Nc1cccc(OCc2ccccc2)c1	ZINC000872384703	EG	On-Demand	Anodyne	CYSLTR1	18	41
O=C(c1ccc(C=NNC23CC(C2)C3)cc1)N1CCCC1	ZINC000872384742	CE	On-Demand	Mild	L3MBTL3	84	41
C[C@H](CO)N(C)N=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872384754	DE	On-Demand	Mild	SIGMAR1	16	42
C[C@@H](CO)N(C)N=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872384755	DE	On-Demand	Mild	SIGMAR1	16	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	CYSLTR1	15	41
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	PTGER1	43	38
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	MMP13	15	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	TRY2_BOVIN	47	33
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	ADAM17	19	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	FFAR1	30	40
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	MCL1	16	40
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1F	ZINC000872384762	HH	On-Demand	Anodyne	LIMK2	35	47
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	PTGER1	44	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	MMP13	16	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	TRY2_BOVIN	43	32
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	ADAM17	19	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	NR1I2	40	38
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	MCL1	19	43
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1Cl	ZINC000872384763	HI	On-Demand	Anodyne	LIMK2	36	48
CC(=NNC(=O)[C@@H]1CNC(=O)C1)c1cccc(SC(F)(F)F)c1	ZINC000872384803	EE	On-Demand	Reactive	F2RL1	21	43
COc1cc(C=NNC(=O)OC(C)C)c(Cl)cc1O	ZINC000872384945	CF	On-Demand	Reactive	GCGR	20	44
COc1cc(C=NNC(=O)OC(C)C)c(Cl)cc1O	ZINC000872384945	CF	On-Demand	Reactive	ADCYAP1R1	43	39
COc1ccc(Cn2cc(C=NNC(=O)[C@]3(OC(C)C)CCOC3)nn2)cc1	ZINC000872384990	GD	On-Demand	Reactive	PROKR1	43	30
COc1ccc(Cn2cc(C=NNC(=O)[C@@]3(OC(C)C)CCOC3)nn2)cc1	ZINC000872384992	GD	On-Demand	Reactive	PROKR1	43	30
CCCON=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872385008	CE	On-Demand	Mild	PROKR1	53	31
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	CYSLTR1	28	46
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	PPIA	31	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	PTGER1	46	47
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	AKR1C3	26	41
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	LIMK2	29	44
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(F)c1	ZINC000872385022	HH	On-Demand	Anodyne	PDS	40	33
CC(CCc1c[nH]c2ccccc12)=NN(C)[C@H](C)CO	ZINC000872385044	CF	On-Demand	Mild	HTR1D	15	43
CC(CCc1c[nH]c2ccccc12)=NN(C)[C@H](C)CO	ZINC000872385044	CF	On-Demand	Mild	MPO	29	43
CC(CCc1c[nH]c2ccccc12)=NN(C)[C@@H](C)CO	ZINC000872385045	CF	On-Demand	Mild	HTR1D	15	43
CC(CCc1c[nH]c2ccccc12)=NN(C)[C@@H](C)CO	ZINC000872385045	CF	On-Demand	Mild	MPO	29	43
Cc1c(C=NN(C)[C@H](C)CO)cccc1[N+](=O)[O-]	ZINC000872385065	CD	On-Demand	Mild	COLA	51	32
Cc1c(C=NN(C)[C@@H](C)CO)cccc1[N+](=O)[O-]	ZINC000872385066	CD	On-Demand	Mild	COLA	51	32
CCCCCOc1ccc(S(=O)(=O)NNc2nc3ccncc3s2)cc1	ZINC000872385068	GH	On-Demand	Clean	PLA2G4B	42	30
CC(CCc1cccnc1)=NNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000872385128	DE	On-Demand	Reactive	PPO2	25	42
CC(CCc1cccnc1)=NNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000872385129	DE	On-Demand	Reactive	PPO2	25	42
CC(=NN(C)[C@H](C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872385171	CD	On-Demand	Mild	COLA	45	32
CC(=NN(C)[C@@H](C)CO)c1c(F)cccc1[N+](=O)[O-]	ZINC000872385173	CD	On-Demand	Mild	COLA	45	32
COCCS(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872385182	DF	On-Demand	Anodyne	MAOB	42	38
COCCS(=O)(=O)Nc1cccc(OCc2ccccc2)c1	ZINC000872385182	DF	On-Demand	Anodyne	FFAR1	34	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1ccnnc1)C2	ZINC000872385239	FE	On-Demand	Reactive	GPR119	15	40
O=C(c1ccc(C=NN[C@@H]2CCC[C@H]2O)cc1)N1CCCC1	ZINC000872385241	DD	On-Demand	Mild	L3MBTL3	92	43
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(Br)c1	ZINC000872385328	JJ	On-Demand	Anodyne	CYSLTR1	27	46
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(Br)c1	ZINC000872385328	JJ	On-Demand	Anodyne	PPIA	29	42
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(Br)c1	ZINC000872385328	JJ	On-Demand	Anodyne	PTGER1	35	40
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(Br)c1	ZINC000872385328	JJ	On-Demand	Anodyne	AKR1C3	23	41
O=C(O)c1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)c(Br)c1	ZINC000872385328	JJ	On-Demand	Anodyne	LIMK2	27	44
C[C@H](CO)N(C)N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872385329	CD	On-Demand	Mild	L3MBTL3	59	39
C[C@@H](CO)N(C)N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872385330	CD	On-Demand	Mild	L3MBTL3	59	39
COC1(CS(=O)(=O)Nc2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000872385335	GG	On-Demand	Anodyne	ALOX5	21	44
OC[C@@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385348	ED	On-Demand	Mild	ESR1	97	38
OC[C@@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385348	ED	On-Demand	Mild	ESR2	65	38
OC[C@@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385348	ED	On-Demand	Mild	LTA4H	48	44
OC[C@@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385348	ED	On-Demand	Mild	HRH3	27	40
OC[C@@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385348	ED	On-Demand	Mild	PSMB1	42	37
OC[C@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385350	ED	On-Demand	Mild	ESR1	97	38
OC[C@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385350	ED	On-Demand	Mild	ESR2	65	38
OC[C@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385350	ED	On-Demand	Mild	LTA4H	48	44
OC[C@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385350	ED	On-Demand	Mild	HRH3	27	40
OC[C@H]1CCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385350	ED	On-Demand	Mild	PSMB1	42	37
CC(CCc1c[nH]c2ccccc12)=NN[C@@H]1CCC[C@H]1O	ZINC000872385408	CF	On-Demand	Mild	HTR1B	17	40
CC(CCc1c[nH]c2ccccc12)=NN[C@@H]1CCC[C@H]1O	ZINC000872385408	CF	On-Demand	Mild	CCKBR	20	41
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	PPIA	41	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	PTGER1	48	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	MMP13	24	42
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	TRY2_BOVIN	40	33
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	ADAM17	22	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	MMP9	16	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	ADAMTS4	38	41
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	LIMK2	35	46
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	HCN1	55	34
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	HCN4	42	32
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	KCNK3	32	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	KCNK9	24	40
CCOc1ccc(S(=O)(=O)Nc2cccc(OCc3ccccc3)c2)cc1C(=O)O	ZINC000872385428	II	On-Demand	Anodyne	PDS	52	33
CCOc1cc(F)cc(C=NN2CCC[C@@H]2CO)c1	ZINC000872385438	CE	On-Demand	Mild	CHRNA10	34	43
CCOc1cc(F)cc(C=NN2CCC[C@H]2CO)c1	ZINC000872385439	CE	On-Demand	Mild	CHRNA10	34	43
CC(CCc1c[nH]c2ccccc12)=NN(C)C[C@@H](C)O	ZINC000872385463	CF	On-Demand	Mild	HTR1D	19	44
CC(CCc1c[nH]c2ccccc12)=NN(C)C[C@H](C)O	ZINC000872385464	CF	On-Demand	Mild	HTR1D	19	44
O=C1C[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385482	FB	On-Demand	Reactive	ESR1	46	34
O=C1C[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385482	FB	On-Demand	Reactive	LTA4H	33	40
O=C1C[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385482	FB	On-Demand	Reactive	HRH3	15	40
O=C1C[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385482	FB	On-Demand	Reactive	EPHX2	16	42
O=C1C[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385488	FB	On-Demand	Reactive	ESR1	46	34
O=C1C[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385488	FB	On-Demand	Reactive	LTA4H	33	40
O=C1C[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385488	FB	On-Demand	Reactive	HRH3	15	40
O=C1C[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CN1	ZINC000872385488	FB	On-Demand	Reactive	EPHX2	16	42
CC(CCOCc1ccccc1)=NNC(=O)c1ncccn1	ZINC000872385591	CE	On-Demand	Reactive	PPO2	34	41
O[C@@H]1CCC[C@H]1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385648	ED	On-Demand	Mild	ESR1	85	38
O[C@@H]1CCC[C@H]1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385648	ED	On-Demand	Mild	ESR2	57	38
O[C@@H]1CCC[C@H]1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385648	ED	On-Demand	Mild	LTA4H	49	46
O[C@@H]1CCC[C@H]1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385648	ED	On-Demand	Mild	HRH3	28	40
O[C@@H]1CCC[C@H]1NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872385648	ED	On-Demand	Mild	PSMB1	43	38
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	ESR1	45	36
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	LTA4H	51	46
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	HRH3	16	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	EPHX2	21	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	FLT3	18	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ncccn1	ZINC000872385719	FC	On-Demand	Reactive	PSMB1	40	36
O=C(NN=Cc1cccc(CC2CCC2)c1)c1ncccn1	ZINC000872385773	CF	On-Demand	Reactive	ADCYAP1R1	42	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(C=NNC(=O)c1ncccn1)C2	ZINC000872385815	FE	On-Demand	Reactive	GPR119	18	46
O=C(NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)c1ncccn1	ZINC000872385882	EE	On-Demand	Reactive	SIGMAR1	20	40
CCC(=NNC(=O)c1ncccn1)c1cccc(OC)c1OC	ZINC000872385894	DE	On-Demand	Reactive	KCNK3	45	41
CCC(=NNC(=O)c1ncccn1)c1cccc(OC)c1OC	ZINC000872385894	DE	On-Demand	Reactive	KCNK9	35	41
O=C(c1ccc(C=NNC2=NCCN2)cc1)N1CCCC1	ZINC000872385906	CC	On-Demand	Mild	L3MBTL3	50	36
COc1ccc(Cn2cc(C=NN[C@@H]3CCC[C@H]3O)nn2)cc1	ZINC000872385908	DD	On-Demand	Mild	PROKR1	55	33
O=C(c1ccc(C=NN2CCC[C@H]2CO)cc1)N1CCCC1	ZINC000872385931	DD	On-Demand	Mild	L3MBTL3	87	45
O=C(c1ccc(C=NN2CCC[C@@H]2CO)cc1)N1CCCC1	ZINC000872385932	DD	On-Demand	Mild	L3MBTL3	87	45
COc1ccc(Cn2cc(C=NNC3=NCCN3)nn2)cc1	ZINC000872386017	CC	On-Demand	Mild	PROKR1	42	31
O[C@@H]1CCC[C@H]1NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872386024	DE	On-Demand	Mild	SIGMAR1	16	42
O=C1c2ccncc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386029	GD	On-Demand	Mild	LTA4H	27	42
O=C1c2ccncc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386029	GD	On-Demand	Mild	EPHA2	16	46
O=C1c2ccncc2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386029	GD	On-Demand	Mild	MKNK1	23	41
C(=NNC1=NCCN1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872386042	DC	On-Demand	Mild	LTA4H	32	43
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	HTR1A	80	45
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	DRD2	59	49
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	DRD1	15	41
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	DRD4	33	44
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	ADRA1A	54	39
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	ADRA1B	49	39
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	DRD3	61	49
COc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386119	ED	On-Demand	Anodyne	HTR7	50	45
COc1ccc(OC)c2sc(NCCO)nc12	ZINC000872386191	CD	On-Demand	Anodyne	ADORA2B	17	42
CC(=O)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872386192	DE	On-Demand	Anodyne	GRM5	23	42
CCC(=O)c1c(Cl)cccc1NCCO	ZINC000872386217	BE	On-Demand	Anodyne	CXCL8	45	41
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000872386258	ED	On-Demand	Reactive	L3MBTL3	64	37
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@H]1C[C@H]2CC[C@H]1O2	ZINC000872386259	ED	On-Demand	Reactive	L3MBTL3	64	37
Nc1nc(NCc2ccc3c(c2)OCO3)nc(C(F)F)n1	ZINC000872386262	CD	On-Demand	Anodyne	DYRK1A	25	42
Nc1nc(NCc2ccc3c(c2)OCO3)nc(C(F)F)n1	ZINC000872386262	CD	On-Demand	Anodyne	CLK1	26	42
Nc1nc(NCc2ccc3c(c2)OCO3)nc(C(F)F)n1	ZINC000872386262	CD	On-Demand	Anodyne	CLK2	35	42
Nc1nc(NCc2ccc3c(c2)OCO3)nc(C(F)F)n1	ZINC000872386262	CD	On-Demand	Anodyne	CLK4	56	43
Nc1nc(NCc2ccc3c(c2)OCO3)nc(C(F)F)n1	ZINC000872386262	CD	On-Demand	Anodyne	DYRK1B	23	42
Cn1ncc2c(N3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386278	EE	On-Demand	Anodyne	DRD2	18	43
Cn1ncc2c(N3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386278	EE	On-Demand	Anodyne	DRD4	45	40
Cn1ncc2c(N3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386278	EE	On-Demand	Anodyne	DRD3	15	40
Cn1ncc2c(N3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386278	EE	On-Demand	Anodyne	SIGMAR1	32	43
Cn1ncc2c(N3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386278	EE	On-Demand	Anodyne	MTOR	17	41
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	HTR1A	103	50
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	DRD2	72	56
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	DRD1	17	45
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	DRD4	45	56
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	ADRA1D	71	45
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	HTR2A	26	46
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	ADRA1A	65	49
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	ADRA1B	56	45
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	DRD3	73	56
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	PDGFRB	16	41
COc1ccccc1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386293	DF	On-Demand	Anodyne	HTR7	62	56
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	HTR1A	98	44
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	DRD2	74	46
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	DRD1	23	41
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	DRD4	46	44
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	ADRA1D	78	45
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	HTR1B	17	42
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	HTR2A	28	44
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	ADRA1A	72	45
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	ADRA1B	63	42
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	DRD3	79	43
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	HTR7	59	42
COc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386309	ED	On-Demand	Anodyne	SCD1	15	40
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@H]1C[C@H]2CC[C@H]1O2	ZINC000872386363	FD	On-Demand	Reactive	EPHX2	18	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000872386364	FD	On-Demand	Reactive	EPHX2	18	42
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	HTR1A	91	48
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	DRD2	67	52
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	DRD1	16	43
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	DRD4	38	43
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	ADRA1D	74	40
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	HTR2A	22	43
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	ADRA1A	67	43
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	ADRA1B	57	40
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	DRD3	68	52
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	PDE3A	41	39
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	HTR7	55	48
COc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872386378	DE	On-Demand	Anodyne	PDE3B	44	39
Oc1nnc(Cl)cc1N1CCN(c2ccccc2)CC1	ZINC000872386379	CE	On-Demand	Anodyne	DRD4	21	40
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	HTR1A	31	47
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	DRD2	37	44
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	DRD4	78	43
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	DRD3	35	43
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	SIGMAR1	53	45
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	FAAH	23	45
NC(=O)c1cc(N2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386389	ED	On-Demand	Anodyne	NPFFR1	45	39
NC(=O)c1cc(NC2CCCCC2)nc(Cl)n1	ZINC000872386402	CD	On-Demand	Anodyne	PRKD1	60	42
NC(=O)c1cc(NC2CCCCC2)nc(Cl)n1	ZINC000872386402	CD	On-Demand	Anodyne	FAAH	15	40
C=C(C)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386410	DE	On-Demand	Mild	ESR1	57	36
C=C(C)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386410	DE	On-Demand	Mild	LTA4H	42	46
C=C(C)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386410	DE	On-Demand	Mild	HRH3	16	40
C=C(C)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386410	DE	On-Demand	Mild	PSMB2	40	41
C=C(C)CON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386410	DE	On-Demand	Mild	PSMB1	43	41
NC(=O)c1cc(NC[C@@H]2CCCO2)nc(Cl)n1	ZINC000872386431	CC	On-Demand	Anodyne	TNK2	40	38
NC(=O)c1cc(NC[C@H]2CCCO2)nc(Cl)n1	ZINC000872386432	CC	On-Demand	Anodyne	TNK2	40	38
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)nn2)cc1	ZINC000872386497	FD	On-Demand	Reactive	PROKR1	54	32
COc1ccc(Cn2cc(C=NNC(=O)[C@H]3C[C@H]4CC[C@H]3O4)nn2)cc1	ZINC000872386498	FD	On-Demand	Reactive	PROKR1	54	32
CC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872386501	CD	On-Demand	Anodyne	SMO	16	47
C=C(C)CON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872386598	CF	On-Demand	Mild	L3MBTL3	61	37
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	HTR1A	98	50
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	DRD2	74	54
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	DRD1	23	47
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	DRD4	44	47
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	ADRA1D	78	43
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	HTR1B	15	49
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	HTR2A	23	47
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	ADRA1A	70	44
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	ADRA1B	63	43
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	DRD3	76	54
COc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872386611	DE	On-Demand	Anodyne	HTR7	58	49
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	HTR1A	84	47
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	DRD2	57	49
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	DRD1	17	40
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	DRD4	33	41
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	ADRA1D	54	39
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	ADRA1A	49	41
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	ADRA1B	42	39
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	DRD3	61	49
COc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386613	FE	On-Demand	Anodyne	HTR7	53	47
Fc1cc(Cl)cc2sc(N3CCOCC3)nc12	ZINC000872386636	CF	On-Demand	Anodyne	PIK3CD	15	40
Fc1cc(Cl)cc2sc(N3CCOCC3)nc12	ZINC000872386636	CF	On-Demand	Anodyne	PIK3CB	21	40
C=C(C)CON=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872386656	CE	On-Demand	Mild	PROKR1	47	31
COc1ccc(OC)c2sc(N3CCN(C)CC3)nc12	ZINC000872386662	CE	On-Demand	Anodyne	HRH4	29	42
C[C@@H](Nc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872386668	CF	On-Demand	Anodyne	HTR7	21	53
C[C@@H](Nc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872386668	CF	On-Demand	Anodyne	TPH1	35	43
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	HTR1A	93	47
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	DRD2	63	51
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	DRD1	19	44
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	DRD4	37	44
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	ADRA1D	65	44
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	HTR2A	23	43
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	ADRA1A	60	44
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	ADRA1B	53	44
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	DRD3	68	51
COc1ccccc1N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872386682	EF	On-Demand	Anodyne	HTR7	58	47
CN1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386683	BC	On-Demand	Anodyne	HRH4	60	55
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	HTR1A	39	49
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	DRD2	54	60
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	DRD4	99	46
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	ACHE	29	40
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	DRD3	43	52
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	HTR7	28	42
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	SIGMAR1	68	50
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2)CC1	ZINC000872386718	DE	On-Demand	Anodyne	FAAH	15	42
Oc1nnc(Cl)cc1NC[C@@H]1CCCO1	ZINC000872386724	BD	On-Demand	Anodyne	TNK2	42	41
Oc1nnc(Cl)cc1NC[C@H]1CCCO1	ZINC000872386725	BD	On-Demand	Anodyne	TNK2	42	41
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000872386740	DD	On-Demand	Anodyne	HTR1A	15	44
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000872386740	DD	On-Demand	Anodyne	DRD2	20	51
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000872386740	DD	On-Demand	Anodyne	DRD4	54	49
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000872386740	DD	On-Demand	Anodyne	DRD3	16	46
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000872386740	DD	On-Demand	Anodyne	SIGMAR1	43	47
COC(=O)c1ccc(C=NNCCCn2ccnc2)cc1Br	ZINC000872386754	FE	On-Demand	Mild	TBXAS1	52	44
COC(=O)c1ccc(C=NNCCCn2ccnc2)cc1Br	ZINC000872386754	FE	On-Demand	Mild	QPCT	40	43
COC(=O)c1ccc(C=NNCCCn2ccnc2)cc1Br	ZINC000872386754	FE	On-Demand	Mild	CYP27B1	46	36
CCOc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386765	FF	On-Demand	Anodyne	HTR1A	36	48
CCOc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386765	FF	On-Demand	Anodyne	DRD2	20	48
CCOc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386765	FF	On-Demand	Anodyne	DRD4	20	44
CCOc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386765	FF	On-Demand	Anodyne	DRD3	19	47
CCOc1ccccc1N1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872386765	FF	On-Demand	Anodyne	HTR7	24	41
O=C(O)Cc1ccc(NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872386783	FH	On-Demand	Mild	SIGMAR1	26	42
Oc1nnc(Cl)cc1NCCCn1ccnc1	ZINC000872386790	CD	On-Demand	Anodyne	TBXAS1	40	43
Oc1nnc(Cl)cc1NCCCn1ccnc1	ZINC000872386790	CD	On-Demand	Anodyne	HMOX2	48	34
Oc1nnc(Cl)cc1NCCCn1ccnc1	ZINC000872386790	CD	On-Demand	Anodyne	QPCT	40	40
CCOC(=O)C1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386793	DD	On-Demand	Anodyne	PTR1	46	33
Oc1nnc(Cl)cc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872386821	EF	On-Demand	Anodyne	HTR1A	18	53
Oc1nnc(Cl)cc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872386821	EF	On-Demand	Anodyne	HTR2A	16	49
Oc1nnc(Cl)cc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872386821	EF	On-Demand	Anodyne	HTR7	15	49
Oc1nnc(Cl)cc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872386821	EF	On-Demand	Anodyne	MLYCD	15	44
O=C1CCCN1CCCNc1ccnc2ncccc12	ZINC000872386836	CE	On-Demand	Anodyne	HRP1_PLAFA	115	45
O=C1CCCN1CCCNc1ccnc2ncccc12	ZINC000872386836	CE	On-Demand	Anodyne	HNMT	76	47
Oc1ccc(N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872386855	DD	On-Demand	Anodyne	METAP1	27	40
CCOc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386865	FE	On-Demand	Anodyne	HTR1A	27	48
CCOc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386865	FE	On-Demand	Anodyne	DRD2	20	50
CCOc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386865	FE	On-Demand	Anodyne	DRD4	20	47
CCOc1ccccc1N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872386865	FE	On-Demand	Anodyne	DRD3	18	50
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	CHRM2	19	42
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	DRD2	22	47
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	DRD4	60	49
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	ACHE	51	44
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	DRD3	19	47
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	KCNH2	21	44
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	CHRM3	25	42
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	LTA4H	22	44
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	SIGMAR1	56	52
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	SSTR5	85	40
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	CHEK2	19	41
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	BCHE	15	40
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	CCR3	47	44
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	UTS2R	15	40
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	FAAH	29	43
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	MCHR1	50	47
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	CCR8	17	40
NC(=O)c1cc(NC2CCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872386867	EE	On-Demand	Anodyne	NPFFR1	43	37
C=C[C@@H](C)ON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872386887	CF	On-Demand	Mild	L3MBTL3	59	37
C=C[C@H](C)ON=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872386888	CF	On-Demand	Mild	L3MBTL3	59	37
CCOC(=O)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872386896	CE	On-Demand	Anodyne	GPR119	28	45
CCOC(=O)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872386902	EG	On-Demand	Anodyne	PDE6D	50	35
COc1ccc(OC)c2sc(NCCCN3CCCC3=O)nc12	ZINC000872386905	EF	On-Demand	Anodyne	ADORA2B	15	47
COc1ccc(OC)c2sc(NCCCN3CCCC3=O)nc12	ZINC000872386905	EF	On-Demand	Anodyne	TYRO3	19	43
COc1ccc(OC)c2sc(NCCCO)nc12	ZINC000872386909	CE	On-Demand	Anodyne	ADORA2B	16	44
O=C1CCCN1CCCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872386923	EG	On-Demand	Anodyne	HRP1_PLAFA	51	38
O=C1CCCN1CCCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872386923	EG	On-Demand	Anodyne	TYRO3	19	47
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	HTR1A	62	45
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	DRD2	54	47
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	DRD4	36	47
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	HTR2A	18	40
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	DRD3	60	47
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	HTR7	41	41
CCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872386926	FD	On-Demand	Anodyne	HCN1	47	31
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	DRD4	39	48
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	ACHE	38	42
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	SIGMAR1	41	43
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	SSTR5	57	40
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	MCHR1	19	52
Cn1ncc2c(NC3CCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872386944	FG	On-Demand	Anodyne	EHMT2	37	47
C=C[C@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386949	DE	On-Demand	Mild	ESR1	45	36
C=C[C@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386949	DE	On-Demand	Mild	LTA4H	38	47
C=C[C@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386949	DE	On-Demand	Mild	HRH3	15	41
C=C[C@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872386949	DE	On-Demand	Mild	PSMB1	42	42
CCN(Cc1ccccc1)c1nc(N)nc(C(F)F)n1	ZINC000872386950	CE	On-Demand	Anodyne	DYR_PNECA	15	52
COc1ccccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872386957	CE	On-Demand	Anodyne	DHFR	35	44
COc1ccccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872386957	CE	On-Demand	Anodyne	DRTS_TOXGO	50	43
COc1ccccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872386957	CE	On-Demand	Anodyne	DYR_PNECA	35	42
C(=NNCCCn1ccnc1)c1nncn1Cc1ccccc1	ZINC000872386970	DD	On-Demand	Mild	CYP11B1	25	45
C(=NNCCCn1ccnc1)c1nncn1Cc1ccccc1	ZINC000872386970	DD	On-Demand	Mild	TBXAS1	39	45
C(=NNCCCn1ccnc1)c1nncn1Cc1ccccc1	ZINC000872386970	DD	On-Demand	Mild	QPCT	32	40
COc1cncc(C=NNCCCn2ccnc2)c1C	ZINC000872386977	CD	On-Demand	Mild	QPCT	46	44
COc1ccc(OC)c2c1NC(=O)C2=NNCCCn1ccnc1	ZINC000872386983	ED	On-Demand	Mild	QPCT	46	46
NC(=O)c1cc(NCCN2CCOCC2)nc(Cl)n1	ZINC000872386986	CB	On-Demand	Anodyne	CASR	43	36
NC(=O)c1cc(NCCN2CCOCC2)nc(Cl)n1	ZINC000872386986	CB	On-Demand	Anodyne	STAT6	54	34
Cn1ncc2c(N[C@@H]3CCCc4ccccc43)nc(Cl)nc21	ZINC000872386992	DH	On-Demand	Anodyne	KCNN3	27	42
Cn1ncc2c(N[C@H]3CCCc4ccccc43)nc(Cl)nc21	ZINC000872386993	DH	On-Demand	Anodyne	KCNN3	27	42
Cc1ccc([N+](=O)[O-])c(C)c1C=NNCCCn1ccnc1	ZINC000872386998	DE	On-Demand	Mild	TBXAS1	32	40
Cc1ccc([N+](=O)[O-])c(C)c1C=NNCCCn1ccnc1	ZINC000872386998	DE	On-Demand	Mild	QPCT	41	45
COc1ccc(OC)c2sc(N3CCN(CCO)CC3)nc12	ZINC000872387000	DD	On-Demand	Anodyne	HTR1A	57	42
COc1ccc(OC)c2sc(N3CCN(CCO)CC3)nc12	ZINC000872387000	DD	On-Demand	Anodyne	ADRA1D	42	39
COc1ccc(OC)c2sc(N3CCN(CCO)CC3)nc12	ZINC000872387000	DD	On-Demand	Anodyne	DRD3	40	37
Cc1c(C=NNCCCn2ccnc2)cccc1[N+](=O)[O-]	ZINC000872387001	CE	On-Demand	Mild	QPCT	42	45
CCC(=NNCCCn1ccnc1)c1cccc(OC)c1OC	ZINC000872387009	DF	On-Demand	Mild	QPCT	46	47
O=C(c1ccc(C=NNCCCn2ccnc2)cc1)N1CCCC1	ZINC000872387015	EE	On-Demand	Mild	TBXAS1	47	46
c1ccc(N2CCN(c3ccncc3C3CC3)CC2)nc1	ZINC000872387016	CF	On-Demand	Anodyne	DRD4	26	44
c1ccc(N2CCN(c3ccncc3C3CC3)CC2)nc1	ZINC000872387016	CF	On-Demand	Anodyne	EBP	34	53
C(=NNCCCn1ccnc1)c1ccnn1CC1CCC1	ZINC000872387027	CD	On-Demand	Mild	QPCT	32	44
C=C[C@@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872387031	DE	On-Demand	Mild	ESR1	45	36
C=C[C@@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872387031	DE	On-Demand	Mild	LTA4H	38	47
C=C[C@@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872387031	DE	On-Demand	Mild	HRH3	15	41
C=C[C@@H](C)ON=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872387031	DE	On-Demand	Mild	PSMB1	42	42
c1cn(CCCNN=C(C2CCC2)[C@@H]2CCCO2)cn1	ZINC000872387040	CE	On-Demand	Mild	QPCT	34	41
c1cn(CCCNN=C(C2CCC2)[C@H]2CCCO2)cn1	ZINC000872387041	CE	On-Demand	Mild	QPCT	34	41
CCC(=O)c1c(Cl)cccc1NC[C@@H](C)O	ZINC000872387052	BF	On-Demand	Anodyne	CXCL8	42	38
CCC(=O)c1c(Cl)cccc1NC[C@H](C)O	ZINC000872387053	BF	On-Demand	Anodyne	CXCL8	42	38
NC(=O)c1cc(NCCCn2ccnc2)nc(Cl)n1	ZINC000872387061	CC	On-Demand	Anodyne	TBXAS1	52	44
NC(=O)c1cc(NCCCn2ccnc2)nc(Cl)n1	ZINC000872387061	CC	On-Demand	Anodyne	HMOX2	48	35
NC(=O)c1cc(NCCCn2ccnc2)nc(Cl)n1	ZINC000872387061	CC	On-Demand	Anodyne	QPCT	35	41
Oc1nnc(Cl)cc1N1CCC(Cc2ccccc2)CC1	ZINC000872387076	DG	On-Demand	Anodyne	GRIN2B	76	43
Oc1nnc(Cl)cc1N1CCC(Cc2ccccc2)CC1	ZINC000872387076	DG	On-Demand	Anodyne	SIGMAR1	22	43
Oc1nnc(Cl)cc1N1CCC(Cc2ccccc2)CC1	ZINC000872387076	DG	On-Demand	Anodyne	GRIN2C	22	40
NC(=O)c1cc(N2CCN(c3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872387092	ED	On-Demand	Anodyne	STAT6	49	34
CCOc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872387098	DF	On-Demand	Anodyne	HTR1A	47	52
CCOc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872387098	DF	On-Demand	Anodyne	DRD2	32	52
CCOc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872387098	DF	On-Demand	Anodyne	DRD4	22	47
CCOc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872387098	DF	On-Demand	Anodyne	DRD3	25	51
CCOc1ccccc1N1CCN(c2ncnc(F)c2C)CC1	ZINC000872387098	DF	On-Demand	Anodyne	HTR7	29	41
CCC(=O)c1c(Cl)cccc1NCCCn1ccnc1	ZINC000872387113	CH	On-Demand	Anodyne	TBXAS1	62	47
CCC(=O)c1c(Cl)cccc1NCCCn1ccnc1	ZINC000872387113	CH	On-Demand	Anodyne	HMOX2	48	35
CCC(=O)c1c(Cl)cccc1NCCCn1ccnc1	ZINC000872387113	CH	On-Demand	Anodyne	QPCT	37	41
Nc1nc(NCCCn2ccnc2)nc(C(F)F)n1	ZINC000872387124	CD	On-Demand	Anodyne	HMOX2	45	32
CCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387132	EF	On-Demand	Anodyne	HTR1A	64	52
CCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387132	EF	On-Demand	Anodyne	DRD2	50	54
CCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387132	EF	On-Demand	Anodyne	DRD4	36	54
CCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387132	EF	On-Demand	Anodyne	DRD3	48	54
CCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387132	EF	On-Demand	Anodyne	HTR7	40	41
Fc1cc(C=NNCCCn2ccnc2)cnc1Cl	ZINC000872387140	CE	On-Demand	Mild	HMOX2	40	33
Fc1cc(C=NNCCCn2ccnc2)cnc1Cl	ZINC000872387140	CE	On-Demand	Mild	QPCT	31	40
COc1cc(C=NNCCCn2ccnc2)c(Cl)cc1O	ZINC000872387142	DE	On-Demand	Mild	QPCT	44	45
FC(F)(F)Cc1ccccc1C=NNCCCn1ccnc1	ZINC000872387168	DG	On-Demand	Mild	QPCT	34	40
Brc1ncccc1C=NNCCCn1ccnc1	ZINC000872387170	DE	On-Demand	Mild	CYP11B1	16	47
Brc1ncccc1C=NNCCCn1ccnc1	ZINC000872387170	DE	On-Demand	Mild	HMOX2	33	40
CC(=NNCCCn1ccnc1)c1cc2c(Cl)nccc2o1	ZINC000872387180	DG	On-Demand	Mild	TBXAS1	29	43
CC(CCOCc1ccccc1)=NNCCCn1ccnc1	ZINC000872387188	DF	On-Demand	Mild	TBXAS1	47	41
CC(CCOCc1ccccc1)=NNCCCn1ccnc1	ZINC000872387188	DF	On-Demand	Mild	QPCT	40	48
C(=NNCCCn1ccnc1)c1cnsc1	ZINC000872387201	BD	On-Demand	Mild	HMOX2	44	32
CCNc1ccccc1C=NNCCCn1ccnc1	ZINC000872387202	CE	On-Demand	Mild	QPCT	36	42
CCOc1cc(F)cc(C=NNCCCn2ccnc2)c1	ZINC000872387216	CE	On-Demand	Mild	QPCT	35	44
NC(=O)c1cc(NC2CCCC2)nc(Cl)n1	ZINC000872387222	BD	On-Demand	Anodyne	PRKD1	39	40
NC(=O)c1cc(NC2CCCC2)nc(Cl)n1	ZINC000872387222	BD	On-Demand	Anodyne	SYK	44	34
FC(F)(F)Cc1ccc(C=NNCCCn2ccnc2)cc1	ZINC000872387223	DG	On-Demand	Mild	TBXAS1	28	40
FC(F)(F)Cc1ccc(C=NNCCCn2ccnc2)cc1	ZINC000872387223	DG	On-Demand	Mild	QPCT	37	41
CC(CCc1cncc2ccccc12)=NNCCCn1ccnc1	ZINC000872387228	DG	On-Demand	Mild	QPCT	38	46
COc1ccc(OC)c2sc(NC[C@@H](C)O)nc12	ZINC000872387237	CE	On-Demand	Anodyne	ADORA2B	17	42
COc1ccc(OC)c2sc(NC[C@H](C)O)nc12	ZINC000872387238	CE	On-Demand	Anodyne	ADORA2B	17	42
COc1ccc(OC)c2sc(N3CCC(C(N)=O)CC3)nc12	ZINC000872387249	DE	On-Demand	Anodyne	LUCI_LUCLA	17	45
c1cn(CCCN=c2cc[nH]cc2C2CC2)cn1	ZINC000872387252	BE	On-Demand	Anodyne	HMOX2	46	34
c1cn(CCCN=c2cc[nH]cc2C2CC2)cn1	ZINC000872387252	BE	On-Demand	Anodyne	QPCT	40	36
NC(=O)c1cc(NCCCN2CCOCC2)nc(Cl)n1	ZINC000872387255	CC	On-Demand	Anodyne	CASR	40	35
NC(=O)c1cc(NCCCN2CCOCC2)nc(Cl)n1	ZINC000872387255	CC	On-Demand	Anodyne	FGFR1	15	43
NC(=O)c1cc(NCCCN2CCOCC2)nc(Cl)n1	ZINC000872387255	CC	On-Demand	Anodyne	STAT6	53	33
Fc1cc(OC(F)F)ccc1C=NNCCCn1ccnc1	ZINC000872387259	DF	On-Demand	Mild	HMOX2	51	38
CCCCN(C)c1cc(C)nc2c1cnn2C	ZINC000872387262	BF	On-Demand	Anodyne	CRHR1	25	40
COc1ccc(OC)c2sc(NCCN(C)C)nc12	ZINC000872387265	CE	On-Demand	Anodyne	ADORA2B	17	41
Cc1c(F)ncnc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872387276	DF	On-Demand	Anodyne	HTR1A	18	52
Cc1c(F)ncnc1N1CCN(c2cccc(Cl)c2)CC1	ZINC000872387276	DF	On-Demand	Anodyne	HTR2A	15	45
O=C(O)Cc1ccc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000872387280	FF	On-Demand	Mild	L3MBTL3	60	37
O=C1CCCN1CCCNc1cc(Cl)nnc1O	ZINC000872387282	CD	On-Demand	Anodyne	HRP1_PLAFA	54	39
CCOC(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387302	CD	On-Demand	Anodyne	P2RY12	41	41
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA2	36	47
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA1	37	47
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA7	23	42
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA4	21	47
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA12	24	44
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CA9	29	44
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	CAH_METTE	19	42
NS(=O)(=O)c1ccc(CCN=c2cc[nH]cc2C2CC2)cc1	ZINC000872387303	DD	On-Demand	Anodyne	NCE103	15	42
COc1nscc1C=NNCCCn1ccnc1	ZINC000872387325	CD	On-Demand	Mild	QPCT	40	41
Oc1nnc(Cl)cc1NCCCN1CCOCC1	ZINC000872387328	CC	On-Demand	Anodyne	HRP1_PLAFA	84	38
Oc1nnc(Cl)cc1NCCCN1CCOCC1	ZINC000872387328	CC	On-Demand	Anodyne	HNMT	50	40
F[C@H]1CCCC1=NNCCCn1ccnc1	ZINC000872387330	BD	On-Demand	Mild	HMOX2	43	32
F[C@H]1CCCC1=NNCCCn1ccnc1	ZINC000872387330	BD	On-Demand	Mild	QPCT	41	40
F[C@@H]1CCCC1=NNCCCn1ccnc1	ZINC000872387338	BD	On-Demand	Mild	HMOX2	43	32
F[C@@H]1CCCC1=NNCCCn1ccnc1	ZINC000872387338	BD	On-Demand	Mild	QPCT	41	40
CCOC(=O)/C=C/c1ccc(C=NNCCCn2ccnc2)n1C	ZINC000872387343	ED	On-Demand	Mild	TBXAS1	45	40
Cc1c(F)ncnc1NCCCN1CCCC1=O	ZINC000872387349	CD	On-Demand	Anodyne	TYRO3	20	41
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCO[C@H]1c1nccn1C	ZINC000872387350	FE	On-Demand	Reactive	CHRNA7	42	35
CC(=O)Nc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387360	CD	On-Demand	Mild	TBXAS1	55	41
CC(=O)Nc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387360	CD	On-Demand	Mild	CYP24A1	23	40
CC(=O)Nc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387360	CD	On-Demand	Mild	QPCT	52	48
CC(=O)Nc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387360	CD	On-Demand	Mild	CYP27B1	35	40
NC(=O)c1cc(N2CCN(c3ccccn3)CC2)nc(Cl)n1	ZINC000872387391	DC	On-Demand	Anodyne	DRD4	26	40
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C=NNCCCn1ccnc1	ZINC000872387393	EF	On-Demand	Mild	TBXAS1	18	45
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C=NNCCCn1ccnc1	ZINC000872387393	EF	On-Demand	Mild	HMOX2	43	32
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C=NNCCCn1ccnc1	ZINC000872387393	EF	On-Demand	Mild	QPCT	31	55
CSc1ccc([N+](=O)[O-])cc1C(C)=NNCCCn1ccnc1	ZINC000872387394	EF	On-Demand	Mild	TBXAS1	26	42
CSc1ccc([N+](=O)[O-])cc1C(C)=NNCCCn1ccnc1	ZINC000872387394	EF	On-Demand	Mild	QPCT	34	43
CCOC(=O)[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872387397	CE	On-Demand	Anodyne	SLC6A1	66	33
O=C(c1ccc(C=NNc2ncc(Br)cn2)cc1)N1CCCC1	ZINC000872387401	FF	On-Demand	Mild	L3MBTL3	77	39
Nc1nc(NCCc2ccc(Cl)cc2)nc(C(F)F)n1	ZINC000872387402	CF	On-Demand	Anodyne	MRGPRX1	41	42
COc1cc2c(cc1OC)C(=NNCCCn1ccnc1)CCCC2	ZINC000872387406	EG	On-Demand	Mild	QPCT	54	45
Cn1nc2c(c1C=NNCCCn1ccnc1)CCCC2	ZINC000872387418	CD	On-Demand	Mild	QPCT	41	37
C(=NNCCCn1ccnc1)c1cn(C2CC2)cn1	ZINC000872387422	CD	On-Demand	Mild	QPCT	30	41
C(=NNCCCn1ccnc1)c1cc2c([nH]1)CCCC2	ZINC000872387429	CE	On-Demand	Mild	QPCT	40	35
CCOC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872387456	CD	On-Demand	Anodyne	SIRT3	59	37
CCOC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872387456	CD	On-Demand	Anodyne	SIRT2	48	33
CCOC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872387456	CD	On-Demand	Anodyne	SIRT1	46	32
O=C(O)Cc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872387457	GE	On-Demand	Mild	LTA4H	48	50
O=C(O)Cc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872387457	GE	On-Demand	Mild	HRH3	18	41
O=C(O)Cc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872387457	GE	On-Demand	Mild	EPHX2	23	54
O=C(O)Cc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872387457	GE	On-Demand	Mild	FLT3	16	42
O=C(O)Cc1ccc(NN=Cc2ccc(OCCN3CCOCC3)cc2)cc1	ZINC000872387457	GE	On-Demand	Mild	PSMB1	40	37
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1	ZINC000872387478	GE	On-Demand	Anodyne	CA2	15	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1	ZINC000872387478	GE	On-Demand	Anodyne	ADRB3	43	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1	ZINC000872387478	GE	On-Demand	Anodyne	CA1	16	42
c1cnc2c(c1)C(=NNCCCn1ccnc1)CCC2	ZINC000872387490	CD	On-Demand	Mild	TBXAS1	30	54
CC(CCc1cccnc1)=NNCCCn1ccnc1	ZINC000872387492	CE	On-Demand	Mild	CYP11B1	22	46
CC(CCc1cccnc1)=NNCCCn1ccnc1	ZINC000872387492	CE	On-Demand	Mild	TBXAS1	59	38
CC(CCc1cccnc1)=NNCCCn1ccnc1	ZINC000872387492	CE	On-Demand	Mild	QPCT	40	40
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CA2	29	58
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	ADRB1	19	42
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	ADRB3	76	42
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CA1	32	58
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CA4	25	43
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CA12	18	58
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CA9	24	58
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	CYNT	24	41
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	LIMK2	42	51
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872387511	GF	On-Demand	Anodyne	A6YCJ1_9METZ	15	43
Cn1nc2c(c1C=NNc1ccc(CC(=O)O)cc1)CCCC2	ZINC000872387532	DE	On-Demand	Mild	PDE4B	26	45
c1ccc(CCC(=NNCCCn2ccnc2)c2ccccn2)cc1	ZINC000872387534	EG	On-Demand	Mild	TBXAS1	34	41
c1ccc(CCC(=NNCCCn2ccnc2)c2ccccn2)cc1	ZINC000872387534	EG	On-Demand	Mild	QPCT	36	44
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	CA2	21	45
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	ADRB2	31	43
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	ADRB1	26	44
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	ADRB3	70	45
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	BMP1	21	47
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	CA1	23	45
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	MTNR1A	75	40
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	MTNR1B	67	42
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	PTPRB	50	43
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	CA9	21	42
COc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872387538	GE	On-Demand	Anodyne	LIMK2	32	51
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	CA2	20	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	ADRB3	56	45
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	CA1	22	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	PNMT	19	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	MLNR	17	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	CA9	16	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1	ZINC000872387540	GF	On-Demand	Anodyne	LIMK2	31	41
Cn1ncc2c(NCCCN3CCOCC3)nc(Cl)nc21	ZINC000872387547	DD	On-Demand	Anodyne	SRC	16	41
C(=NNCCCn1ccnc1)C1([C@@H]2CCCCO2)CCC1	ZINC000872387548	CF	On-Demand	Mild	QPCT	23	40
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872387553	ED	On-Demand	Anodyne	TGM2	19	40
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872387553	ED	On-Demand	Anodyne	GCK	42	36
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872387553	ED	On-Demand	Anodyne	F13A1	15	40
C(=NNCCCn1ccnc1)C1([C@H]2CCCCO2)CCC1	ZINC000872387555	CF	On-Demand	Mild	QPCT	23	40
Cc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1C	ZINC000872387559	GD	On-Demand	Anodyne	NOD2	18	42
CC(C)(C)OC(=O)NCc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387575	FF	On-Demand	Mild	TBXAS1	45	42
CC(C)(C)OC(=O)NCc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387575	FF	On-Demand	Mild	CYP24A1	40	37
CC(C)(C)OC(=O)NCc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387575	FF	On-Demand	Mild	QPCT	38	41
CC(C)(C)OC(=O)NCc1cccc(C=NNCCCn2ccnc2)c1	ZINC000872387575	FF	On-Demand	Mild	CYP27B1	63	37
CCOC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872387581	EH	On-Demand	Anodyne	GRM5	17	44
CCOC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872387581	EH	On-Demand	Anodyne	DGAT1	19	40
c1ccc(CN2C[C@H]3CCC(=NNCCCn4ccnc4)[C@H]3C2)cc1	ZINC000872387589	EF	On-Demand	Mild	TBXAS1	19	40
CCOC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872387602	CE	On-Demand	Anodyne	PTR1	45	33
COc1cc2c(cc1OC)CN(c1ncnc(F)c1C)CC2	ZINC000872387607	DF	On-Demand	Anodyne	PDE3A	49	35
COc1cc2c(cc1OC)CN(c1ncnc(F)c1C)CC2	ZINC000872387607	DF	On-Demand	Anodyne	ABCB1B	50	31
COc1cc2c(cc1OC)CN(c1ncnc(F)c1C)CC2	ZINC000872387607	DF	On-Demand	Anodyne	PDE3B	41	35
COC(=O)CSc1nc2c(OC)ccc(OC)c2s1	ZINC000872387610	CF	On-Demand	Anodyne	ENPP1	69	33
COc1ccc(Cn2cc(C=NNCCCn3ccnc3)nn2)cc1	ZINC000872387633	ED	On-Demand	Mild	QPCT	40	49
COc1ccc(Cn2cc(C=NNCCCn3ccnc3)nn2)cc1	ZINC000872387633	ED	On-Demand	Mild	PROKR1	53	31
OCCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872387634	CB	On-Demand	Anodyne	BCL2A1	15	40
NC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872387643	DE	On-Demand	Anodyne	ADK	21	43
NC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872387643	DE	On-Demand	Anodyne	GRM5	17	46
NC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872387643	DE	On-Demand	Anodyne	LUCI_LUCLA	22	42
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872387654	FE	On-Demand	Anodyne	PKM	36	42
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000872387654	FE	On-Demand	Anodyne	GCK	41	34
Oc1nnc(Cl)cc1N1CCN(c2ccccn2)CC1	ZINC000872387666	CD	On-Demand	Anodyne	DRD4	27	42
Oc1nnc(Cl)cc1N1CCN(c2ccccn2)CC1	ZINC000872387666	CD	On-Demand	Anodyne	EBP	26	42
COc1cc2c(cc1OC)CN(c1cc(Cl)nnc1O)CC2	ZINC000872387702	DE	On-Demand	Anodyne	ABCB1	15	42
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	DHFR	34	45
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	FOLA	17	43
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	DFR1	16	40
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	DRTS_TOXGO	47	45
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	DYR_PNECA	34	42
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872387706	CE	On-Demand	Anodyne	DRTS_TRYCR	55	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000872387715	FE	On-Demand	Reactive	MC5R	45	52
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000872387715	FE	On-Demand	Reactive	GHSR	44	36
Oc1nnc(Cl)cc1N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000872387716	FG	On-Demand	Anodyne	SERPINE1	25	42
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	JAK2	19	48
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	MAPKAPK5	48	43
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	MAPK9	50	49
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	MAPK10	58	49
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	MAPK8	18	49
NC(=O)c1cc(Nc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872387721	ED	On-Demand	Anodyne	STAT6	89	46
COc1cc2c(cc1OC)CN(c1ccnc3ncccc13)CC2	ZINC000872387743	DG	On-Demand	Anodyne	PDE3A	44	37
COc1cc2c(cc1OC)CN(c1ccnc3ncccc13)CC2	ZINC000872387743	DG	On-Demand	Anodyne	ABCB1B	48	35
O=[N+]([O-])c1ccc(N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872387748	EE	On-Demand	Bother	NOD2	17	40
FC(F)(F)C(F)(F)C=NNCCCn1ccnc1	ZINC000872387754	CE	On-Demand	Mild	TBXAS1	25	42
FC(F)(F)C(F)(F)C=NNCCCn1ccnc1	ZINC000872387754	CE	On-Demand	Mild	QPCT	37	42
CCC(=NNc1ccc(CC(=O)O)cc1)c1cccc(OC)c1OC	ZINC000872387764	EH	On-Demand	Mild	PTGDR2	16	41
CCOc1ccc(Nc2cc(Cl)nnc2O)cc1OCC	ZINC000872387772	DG	On-Demand	Anodyne	AGPAT2	47	40
CCC(=O)c1c(Cl)cccc1NCCCN1CCCC1=O	ZINC000872387780	DG	On-Demand	Anodyne	TYRO3	20	45
c1cn(CCCNN=C2CC[C@@H]3C[C@H]23)cn1	ZINC000872387791	BD	On-Demand	Mild	QPCT	40	38
CN(C)[C@@H](CNc1nc(Cl)nc2c1cnn2C)c1ccccc1	ZINC000872387795	EF	On-Demand	Anodyne	ABL1	32	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cc[nH]n1	ZINC000872387822	EC	On-Demand	Reactive	LTA4H	36	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cc[nH]n1	ZINC000872387822	EC	On-Demand	Reactive	EPHX2	17	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cc[nH]n1	ZINC000872387822	EC	On-Demand	Reactive	FLT3	17	42
C(=NNCCCn1ccnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872387848	FD	On-Demand	Mild	LTA4H	24	41
C(=NNCCCn1ccnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872387848	FD	On-Demand	Mild	TBXAS1	15	44
C(=NNCCCn1ccnc1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872387848	FD	On-Demand	Mild	HMOX2	19	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCO[C@H]1c1nccn1C	ZINC000872387857	GG	On-Demand	Reactive	NMBR	40	32
CC(=NNCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872387867	DE	On-Demand	Mild	TBXAS1	27	41
CC(=NNCCCn1ccnc1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872387867	DE	On-Demand	Mild	QPCT	38	47
CCOC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872387869	CD	On-Demand	Anodyne	P2RY12	54	38
CCOC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872387869	CD	On-Demand	Anodyne	METAP1	22	42
NC(=O)c1cc(N[C@@H]2CCCc3ccccc32)nc(Cl)n1	ZINC000872387893	DF	On-Demand	Anodyne	KCNN3	27	44
NC(=O)c1cc(N[C@H]2CCCc3ccccc32)nc(Cl)n1	ZINC000872387895	DF	On-Demand	Anodyne	KCNN3	27	44
COCCN(CCOC)c1cc(C)nc2c1cnn2C	ZINC000872387916	CD	On-Demand	Anodyne	CRHR1	32	46
Nc1nc(C(F)F)nc(N2CCN(c3ccccn3)CC2)n1	ZINC000872387924	DD	On-Demand	Anodyne	DRD4	26	41
Nc1nc(C(F)F)nc(N2CCN(c3ccccn3)CC2)n1	ZINC000872387924	DD	On-Demand	Anodyne	SORD	41	36
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1cc[nH]n1	ZINC000872387928	DD	On-Demand	Reactive	L3MBTL3	46	35
CCN1CCC[C@@H]1CNc1cc(Cl)nnc1O	ZINC000872387933	CD	On-Demand	Anodyne	DRD2	33	44
O=c1oc2cc(Oc3cc(Cl)nnc3O)ccc2c2c1CCCCC2	ZINC000872387936	FI	On-Demand	Anodyne	MAOB	19	45
O=C(Cc1ccccc1O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872387943	FE	On-Demand	Reactive	L3MBTL3	57	35
FC(F)c1ccc(C=NNCCCn2ccnc2)cn1	ZINC000872387958	CE	On-Demand	Mild	HMOX2	45	34
Nc1nc(C(F)F)nc(N2CCC(Cc3ccccc3)CC2)n1	ZINC000872387965	DF	On-Demand	Anodyne	GRIN2B	68	42
OCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872387967	CD	On-Demand	Anodyne	HTR1A	29	42
OCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872387967	CD	On-Demand	Anodyne	DRD2	30	40
OCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872387967	CD	On-Demand	Anodyne	DRD4	42	46
OCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872387967	CD	On-Demand	Anodyne	HTR2A	17	40
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	DRD2	16	43
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	DRD4	44	44
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	ACHE	34	41
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	DRD3	15	43
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	SIGMAR1	43	43
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	SSTR5	45	39
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	HRH4	20	43
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872387979	EE	On-Demand	Anodyne	MCHR1	21	44
CCC(CCC(F)(F)F)=NNCCCn1ccnc1	ZINC000872387989	CF	On-Demand	Mild	TBXAS1	21	42
Oc1nnc(Cl)cc1N[C@@H]1CCCc2ccccc21	ZINC000872387998	CG	On-Demand	Anodyne	KCNN3	28	44
Oc1nnc(Cl)cc1N[C@H]1CCCc2ccccc21	ZINC000872387999	CG	On-Demand	Anodyne	KCNN3	28	44
CCOC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388009	CD	On-Demand	Anodyne	PDE6D	44	39
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000872388019	FH	On-Demand	Reactive	CHRNA7	42	37
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000872388019	FH	On-Demand	Reactive	C3AR1	37	40
Nc1nc(N[C@H]2CCCc3ccccc32)nc(C(F)F)n1	ZINC000872388021	CF	On-Demand	Anodyne	KCNN3	33	48
Nc1nc(N[C@@H]2CCCc3ccccc32)nc(C(F)F)n1	ZINC000872388023	CF	On-Demand	Anodyne	KCNN3	33	48
CCCN(CCC)S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388045	FE	On-Demand	Anodyne	CA1	17	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	CA2	20	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	ADRB3	56	38
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	BMP1	59	39
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	CA1	21	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	CA12	15	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	CA9	16	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1	ZINC000872388046	GE	On-Demand	Anodyne	LIMK2	30	40
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	ESR1	86	38
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	ESR2	57	38
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	LTA4H	51	45
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	HRH3	57	44
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	PSMB2	41	39
C[C@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388063	EF	On-Demand	Mild	PSMB1	45	39
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	ESR1	86	38
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	ESR2	57	38
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	LTA4H	51	45
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	HRH3	57	44
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	PSMB2	41	39
C[C@@H]1CCCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388065	EF	On-Demand	Mild	PSMB1	45	39
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000872388082	FD	On-Demand	Reactive	L3MBTL3	95	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cnc3n2CCC3)cc1	ZINC000872388087	GD	On-Demand	Anodyne	ADRB3	42	36
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	JAK2	15	42
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	MAPKAPK5	45	39
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	MAPK9	35	45
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	MAPK10	45	45
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	EPHB4	67	34
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)cc1	ZINC000872388105	DE	On-Demand	Anodyne	STAT6	67	41
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	CHRM2	15	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	DRD2	21	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	DRD4	57	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	ACHE	49	46
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	DRD3	18	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	CHRM3	20	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	LTA4H	16	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	SIGMAR1	60	50
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	SSTR5	78	39
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	BCHE	16	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	CCR3	31	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccc2)CC1	ZINC000872388110	DF	On-Demand	Anodyne	MCHR1	36	49
NC(=O)c1cc(NC2CCCCCC2)nc(Cl)n1	ZINC000872388116	CE	On-Demand	Anodyne	PRKD1	60	42
NC(=O)c1cc(NC2CCCCCC2)nc(Cl)n1	ZINC000872388116	CE	On-Demand	Anodyne	FAAH	15	40
CC(=NNCCCn1ccnc1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872388129	FF	On-Demand	Mild	TBXAS1	32	41
CC(=NNCCCn1ccnc1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872388129	FF	On-Demand	Mild	QPCT	35	42
CC(CCc1c[nH]c2ccccc12)=NNCCCn1ccnc1	ZINC000872388131	DG	On-Demand	Mild	TBXAS1	33	52
CC(CCc1c[nH]c2ccccc12)=NNCCCn1ccnc1	ZINC000872388131	DG	On-Demand	Mild	QPCT	33	41
OCCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388136	DD	On-Demand	Anodyne	HTR1A	24	55
OCCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388136	DD	On-Demand	Anodyne	DRD2	18	43
OCCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388136	DD	On-Demand	Anodyne	DRD4	27	42
OCCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388136	DD	On-Demand	Anodyne	HTR2A	19	41
OCCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388136	DD	On-Demand	Anodyne	DRD3	18	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000872388139	GG	On-Demand	Reactive	MC5R	40	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000872388139	GG	On-Demand	Reactive	GHSR	47	39
COCCS(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388142	EC	On-Demand	Anodyne	CA1	15	40
COCCS(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388142	EC	On-Demand	Anodyne	PTPRB	64	36
COc1cc(C=NNCCCn2ccnc2)c(F)cc1Br	ZINC000872388157	FF	On-Demand	Mild	QPCT	38	42
C[C@H]1CCCCN1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872388179	CG	On-Demand	Mild	MLYCD	18	41
C[C@H]1CCCCN1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872388179	CG	On-Demand	Mild	L3MBTL3	92	44
C[C@@H]1CCCCN1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872388183	CG	On-Demand	Mild	MLYCD	18	41
C[C@@H]1CCCCN1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872388183	CG	On-Demand	Mild	L3MBTL3	92	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cnn(C)c2)cc1	ZINC000872388193	FD	On-Demand	Anodyne	ADRB3	68	38
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccoc2)cc1	ZINC000872388199	ED	On-Demand	Anodyne	CA2	15	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccoc2)cc1	ZINC000872388199	ED	On-Demand	Anodyne	ADRB3	48	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccoc2)cc1	ZINC000872388199	ED	On-Demand	Anodyne	CA1	17	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccoc2)cc1	ZINC000872388199	ED	On-Demand	Anodyne	LIMK2	30	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1	ZINC000872388211	GG	On-Demand	Anodyne	CCR4	62	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N(C)CC2CC2)cc1	ZINC000872388219	FD	On-Demand	Anodyne	PTPRB	48	34
CO[C@@H](CS(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1)C(C)C	ZINC000872388221	FD	On-Demand	Anodyne	PTPRB	50	35
CN1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388227	DF	On-Demand	Anodyne	HTR3A	15	40
CN1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872388227	DF	On-Demand	Anodyne	HRH4	57	66
O=S(=O)(c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388267	FD	On-Demand	Anodyne	PKM	31	41
O=S(=O)(c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388267	FD	On-Demand	Anodyne	F13A1	42	38
O=S(=O)(c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388267	FD	On-Demand	Anodyne	AKR1C3	45	38
Fc1c[nH]ccc1=NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388279	ED	On-Demand	Mild	LTA4H	31	43
CCC(=NNC(=O)Cc1ccccc1O)c1cccc(OC)c1OC	ZINC000872388288	EF	On-Demand	Reactive	KCNK3	49	38
O=S(=O)(c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388291	GD	On-Demand	Anodyne	PKM	36	46
O=S(=O)(c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388291	GD	On-Demand	Anodyne	NOD2	19	47
Cc1ccc(F)c(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388303	GF	On-Demand	Anodyne	SGK1	45	43
Cc1ccc(F)c(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388303	GF	On-Demand	Anodyne	LIMK2	25	40
COc1cc2c(cc1OC)CN(c1cc(C)nc3c1cnn3C)CC2	ZINC000872388304	EF	On-Demand	Anodyne	ABCB1B	60	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)COC3)cc1	ZINC000872388314	GE	On-Demand	Anodyne	CA2	16	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)COC3)cc1	ZINC000872388314	GE	On-Demand	Anodyne	ADRB3	51	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc3c(c2)COC3)cc1	ZINC000872388314	GE	On-Demand	Anodyne	CA1	18	43
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000872388318	DD	On-Demand	Reactive	CHRNA7	44	35
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1F	ZINC000872388362	GF	On-Demand	Anodyne	LIMK2	27	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)Cc2cccc(Cl)c2)cc1	ZINC000872388379	GG	On-Demand	Anodyne	GRIN1	17	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)Cc2cccc(Cl)c2)cc1	ZINC000872388379	GG	On-Demand	Anodyne	ADRB3	20	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)Cc2cccc(Cl)c2)cc1	ZINC000872388379	GG	On-Demand	Anodyne	LIMK2	19	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(Cl)c2)cc1	ZINC000872388389	GE	On-Demand	Anodyne	ADRB2	24	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(Cl)c2)cc1	ZINC000872388389	GE	On-Demand	Anodyne	ADRB1	18	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(Cl)c2)cc1	ZINC000872388389	GE	On-Demand	Anodyne	ADRB3	76	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(Cl)c2)cc1	ZINC000872388389	GE	On-Demand	Anodyne	CA1	15	42
Cc1ccc(OCCNc2ncnc(F)c2C)cc1	ZINC000872388408	CF	On-Demand	Anodyne	DRD4	16	50
COc1cc2c(cc1OC)CN(c1nc(Cl)nc3c1cnn3C)CC2	ZINC000872388416	FF	On-Demand	Anodyne	ABCB1B	42	34
CCC(=NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)c1cccc(OC)c1OC	ZINC000872388432	FD	On-Demand	Reactive	DRD2	31	41
O=S(=O)(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388473	GD	On-Demand	Anodyne	HTR6	16	46
O=S(=O)(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388473	GD	On-Demand	Anodyne	PKM	35	41
O=S(=O)(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388473	GD	On-Demand	Anodyne	AKR1C3	45	38
O=S(=O)(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388473	GD	On-Demand	Anodyne	NOD2	17	40
COc1ccc(CN(C)c2nc(Cl)nc3c2cnn3C)cc1	ZINC000872388474	DF	On-Demand	Anodyne	NPBWR1	51	36
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	ESR1	85	39
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	ESR2	56	39
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	LTA4H	48	47
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	HRH3	16	43
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	EPHX2	19	51
O=C(Cc1ccccc1O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872388476	GD	On-Demand	Reactive	PSMB1	40	37
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccs2)cc1	ZINC000872388477	FE	On-Demand	Anodyne	ADRB3	49	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccs2)cc1	ZINC000872388477	FE	On-Demand	Anodyne	CA5B	20	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccs2)cc1	ZINC000872388477	FE	On-Demand	Anodyne	RORA	15	46
CSc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388478	GG	On-Demand	Anodyne	CA2	25	49
CSc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388478	GG	On-Demand	Anodyne	ADRB3	73	41
CSc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388478	GG	On-Demand	Anodyne	CA1	28	49
CSc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388478	GG	On-Demand	Anodyne	CA9	20	49
CSc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388478	GG	On-Demand	Anodyne	LIMK2	35	46
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	CA2	18	43
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	GRIN1	27	43
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	ADRB3	20	44
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	CA1	20	43
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	TRPV1	29	51
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	PTPRB	48	35
CN(C)C(=O)NCCc1ccc(NS(C)(=O)=O)cc1	ZINC000872388490	CC	On-Demand	Anodyne	CA9	17	43
CC(C)c1ccc(S(=O)(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872388491	GE	On-Demand	Anodyne	NOD2	17	40
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872388494	FD	On-Demand	Anodyne	HSD11B1	15	55
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872388494	FD	On-Demand	Anodyne	PKM	35	43
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872388494	FD	On-Demand	Anodyne	TGM2	24	40
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872388494	FD	On-Demand	Anodyne	GCK	42	34
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872388494	FD	On-Demand	Anodyne	F13A1	22	40
CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388500	GF	On-Demand	Anodyne	CA2	18	47
CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388500	GF	On-Demand	Anodyne	ADRB3	54	38
CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388500	GF	On-Demand	Anodyne	CA1	20	47
CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388500	GF	On-Demand	Anodyne	AKR1C3	15	47
CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388500	GF	On-Demand	Anodyne	LIMK2	33	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(F)c2)cc1	ZINC000872388506	FD	On-Demand	Anodyne	ADRB2	24	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(F)c2)cc1	ZINC000872388506	FD	On-Demand	Anodyne	ADRB1	19	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(F)c2)cc1	ZINC000872388506	FD	On-Demand	Anodyne	ADRB3	77	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(F)c2)cc1	ZINC000872388506	FD	On-Demand	Anodyne	CA1	15	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cncc(F)c2)cc1	ZINC000872388506	FD	On-Demand	Anodyne	LIMK2	27	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccsc2)cc1	ZINC000872388520	FE	On-Demand	Anodyne	CA2	15	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccsc2)cc1	ZINC000872388520	FE	On-Demand	Anodyne	ADRB1	19	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccsc2)cc1	ZINC000872388520	FE	On-Demand	Anodyne	ADRB3	58	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccsc2)cc1	ZINC000872388520	FE	On-Demand	Anodyne	CA1	17	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccsc2)cc1	ZINC000872388520	FE	On-Demand	Anodyne	LIMK2	30	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N2CCCCC2)cc1	ZINC000872388521	FD	On-Demand	Anodyne	NAMPT	16	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2cccs2)cc1	ZINC000872388525	GF	On-Demand	Anodyne	CA5B	29	46
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cnn(CC3CC3)c2)cc1	ZINC000872388534	GD	On-Demand	Anodyne	ADRB3	45	35
CCCN(C)S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388543	ED	On-Demand	Anodyne	CA1	15	40
Cc1ncc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)s1	ZINC000872388545	FE	On-Demand	Anodyne	ADRB3	41	35
CN1CCCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872388547	CC	On-Demand	Anodyne	HRH4	51	50
CN1CCCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872388551	CC	On-Demand	Anodyne	HRH4	51	48
CCC(CCC(F)(F)F)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000872388552	FG	On-Demand	Reactive	ETHR	53	36
CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872388565	CE	On-Demand	Anodyne	HTR3A	18	48
CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872388565	CE	On-Demand	Anodyne	HRH4	53	89
CN1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872388576	CF	On-Demand	Anodyne	HTR3A	15	40
CN1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872388576	CF	On-Demand	Anodyne	HRH4	52	61
COCc1ccccc1S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388596	GE	On-Demand	Anodyne	PTPRB	44	34
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCC(C)(C)C)cc1	ZINC000872388621	FF	On-Demand	Anodyne	PTPRB	59	34
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	CA2	20	44
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	ADRB3	59	39
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	CA1	21	44
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	FBP1	22	46
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	PTPRB	53	35
Cc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872388624	FF	On-Demand	Anodyne	LIMK2	33	48
O=S(=O)(c1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388637	FD	On-Demand	Anodyne	HSD11B1	19	51
O=S(=O)(c1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388637	FD	On-Demand	Anodyne	PKM	41	44
O=S(=O)(c1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872388637	FD	On-Demand	Anodyne	GCK	40	33
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ncn(C)c2Cl)cc1	ZINC000872388638	GD	On-Demand	Anodyne	ADRB3	40	35
CCN1CCC[C@@H]1CNc1cc(C(N)=O)nc(Cl)n1	ZINC000872388641	CD	On-Demand	Anodyne	DRD2	31	41
CN1CCC(C=NNC(=O)c2cc[nH]n2)CC1	ZINC000872388645	BC	On-Demand	Reactive	HTR1F	71	32
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	CA2	16	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	ADRB3	19	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	CA1	18	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	CA5B	21	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	CA5A	19	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	PTPRB	49	38
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	CA9	15	49
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccccc2)cc1	ZINC000872388651	GE	On-Demand	Anodyne	LIMK2	32	42
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	CA2	30	48
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	ADRB2	31	49
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	ADRB1	35	49
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	ADRB3	80	49
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	CA1	33	48
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	CA7	15	41
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	ALOX15	17	41
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	CA12	22	48
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	CA9	28	48
CCOc1ccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1	ZINC000872388659	GF	On-Demand	Anodyne	LIMK2	37	49
CCOc1ccc(Nc2cc(C(N)=O)nc(Cl)n2)cc1OCC	ZINC000872388661	EF	On-Demand	Anodyne	AGPAT2	74	46
CCOc1ccc(Nc2cc(C(N)=O)nc(Cl)n2)cc1OCC	ZINC000872388661	EF	On-Demand	Anodyne	RPS27	35	42
Cc1ccccc1S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388691	FF	On-Demand	Anodyne	CA1	15	53
Cc1ccccc1S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388691	FF	On-Demand	Anodyne	LIMK2	31	41
Nc1nc(NCc2cccc(C(F)(F)F)c2)nc(C(F)F)n1	ZINC000872388692	DG	On-Demand	Anodyne	TPH1	25	40
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388699	GF	On-Demand	Anodyne	LIMK2	22	41
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccsc2C)CC1	ZINC000872388701	ED	On-Demand	Anodyne	TGM2	45	48
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccsc2C)CC1	ZINC000872388701	ED	On-Demand	Anodyne	F13A1	56	48
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1	ZINC000872388710	CE	On-Demand	Anodyne	DHFR	18	41
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1	ZINC000872388710	CE	On-Demand	Anodyne	DRTS_TOXGO	31	41
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1	ZINC000872388710	CE	On-Demand	Anodyne	DYR_PNECA	30	41
COc1cc2c(cc1OC)CN(c1cc(C(N)=O)nc(Cl)n1)CC2	ZINC000872388711	ED	On-Demand	Anodyne	ABCB1B	50	31
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000872388718	FE	On-Demand	Anodyne	PKM	42	39
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000872388718	FE	On-Demand	Anodyne	GCK	42	35
Cc1ccc(OCCNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872388728	CE	On-Demand	Anodyne	HTR7	15	54
CN1CCCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872388736	CD	On-Demand	Anodyne	HRH4	25	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCC2CC2)cc1	ZINC000872388737	EE	On-Demand	Anodyne	PTPRB	50	34
C[C@@H]1CCCC[C@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872388747	CE	On-Demand	Anodyne	SYK	56	38
C[C@@H]1CCCC[C@@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872388749	CE	On-Demand	Anodyne	SYK	56	38
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)CCc2ccc(F)cc2)cc1	ZINC000872388755	GF	On-Demand	Anodyne	LIMK2	15	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N2CCCC2)cc1	ZINC000872388774	ED	On-Demand	Anodyne	ADRB3	15	48
CCCCN(CC)c1nc(Cl)nc2c1cnn2C	ZINC000872388777	CF	On-Demand	Anodyne	CRHR1	24	42
O=C(NN=C(CCc1ccccc1)c1ccccn1)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000872388787	GE	On-Demand	Reactive	PREP	27	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	CA2	21	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	ADRB2	26	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	ADRB1	19	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	ADRB3	79	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	CA1	24	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	CA4	16	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	CA12	15	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	CA9	19	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1	ZINC000872388799	GE	On-Demand	Anodyne	LIMK2	34	41
O=S(=O)(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872388813	EE	On-Demand	Anodyne	TGM2	42	37
O=S(=O)(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872388813	EE	On-Demand	Anodyne	F13A1	40	37
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	CA2	28	51
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	ADRB2	26	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	ADRB1	20	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	ADRB3	78	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	CA1	31	51
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	CA4	24	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	CA12	16	51
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	CA9	23	51
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1	ZINC000872388831	GE	On-Demand	Anodyne	LIMK2	40	47
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	CA2	24	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	ADRB2	29	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	ADRB1	21	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	ADRB3	88	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	CA1	26	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	CA12	15	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	CA9	18	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1	ZINC000872388843	GG	On-Demand	Anodyne	LIMK2	35	46
CN1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872388866	BC	On-Demand	Anodyne	HRH4	28	40
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000872388869	FE	On-Demand	Reactive	CHRNA7	40	34
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000872388886	GG	On-Demand	Anodyne	CA2	23	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000872388886	GG	On-Demand	Anodyne	ADRB3	67	38
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000872388886	GG	On-Demand	Anodyne	CA1	25	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000872388886	GG	On-Demand	Anodyne	CA9	18	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000872388886	GG	On-Demand	Anodyne	LIMK2	38	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cn(C)nn1	ZINC000872388901	DE	On-Demand	Reactive	MC5R	49	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cn(C)nn1	ZINC000872388901	DE	On-Demand	Reactive	MMP11	43	33
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cn(C)nn1	ZINC000872388901	DE	On-Demand	Reactive	GHSR	53	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cn(C)nn1	ZINC000872388901	DE	On-Demand	Reactive	MMP9	15	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)c1cn(C)nn1	ZINC000872388901	DE	On-Demand	Reactive	MC1R	41	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	CA2	16	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	ADRB2	31	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	ADRB1	28	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	ADRB3	97	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	CA1	17	41
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1	ZINC000872388919	GG	On-Demand	Anodyne	LIMK2	31	40
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccco2)cc1	ZINC000872388922	ED	On-Demand	Anodyne	CA2	16	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccco2)cc1	ZINC000872388922	ED	On-Demand	Anodyne	ADRB3	43	35
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccco2)cc1	ZINC000872388922	ED	On-Demand	Anodyne	CA1	18	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccco2)cc1	ZINC000872388922	ED	On-Demand	Anodyne	CA9	15	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccco2)cc1	ZINC000872388922	ED	On-Demand	Anodyne	LIMK2	33	43
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)C2=CCCCC2)cc1	ZINC000872388953	FF	On-Demand	Anodyne	LIMK2	29	40
CO[C@@H](C)CS(=O)(=O)Nc1ccc(CCNC(=O)N(C)C)cc1	ZINC000872388958	ED	On-Demand	Anodyne	PTPRB	45	36
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N(C)C)cc1	ZINC000872388967	DC	On-Demand	Anodyne	CA2	16	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N(C)C)cc1	ZINC000872388967	DC	On-Demand	Anodyne	ADRB3	15	48
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N(C)C)cc1	ZINC000872388967	DC	On-Demand	Anodyne	CA1	18	42
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)N(C)C)cc1	ZINC000872388967	DC	On-Demand	Anodyne	PTPRB	47	34
CC(CCc1cccnc1)=NN1CCCC[C@@H]1C	ZINC000872388975	BG	On-Demand	Mild	FKBP1A	16	41
CC(CCc1cccnc1)=NN1CCCC[C@@H]1C	ZINC000872388975	BG	On-Demand	Mild	CHRNA7	40	35
CC(CCc1cccnc1)=NN1CCCC[C@@H]1C	ZINC000872388975	BG	On-Demand	Mild	C3AR1	40	44
CC(CCc1cccnc1)=NN1CCCC[C@H]1C	ZINC000872388976	BG	On-Demand	Mild	FKBP1A	16	41
CC(CCc1cccnc1)=NN1CCCC[C@H]1C	ZINC000872388976	BG	On-Demand	Mild	CHRNA7	40	35
CC(CCc1cccnc1)=NN1CCCC[C@H]1C	ZINC000872388976	BG	On-Demand	Mild	C3AR1	40	44
CN(C)C(=O)NCCc1ccc(NS(=O)(=O)c2ccc(C(F)F)o2)cc1	ZINC000872388980	GF	On-Demand	Anodyne	ADRB3	55	36
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	CA2	15	47
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	ADRB2	27	42
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	ADRB1	26	45
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	ADRB3	67	48
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	CA1	17	47
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	MTNR1A	27	40
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	CA9	15	47
CCOc1cccc(S(=O)(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)c1	ZINC000872389011	GF	On-Demand	Anodyne	LIMK2	30	41
CN1CCCN(c2ccnc3ncccc23)CC1	ZINC000872389051	BD	On-Demand	Anodyne	HTR3A	19	48
CN1CCCN(c2ccnc3ncccc23)CC1	ZINC000872389051	BD	On-Demand	Anodyne	METAP1	16	44
CN1CCCN(c2ccnc3ncccc23)CC1	ZINC000872389051	BD	On-Demand	Anodyne	HRH4	22	42
NC(=O)c1cc(Nc2ccc(N3CCCC3)cc2)nc(Cl)n1	ZINC000872389148	DF	On-Demand	Anodyne	MAPK9	44	41
NC(=O)c1cc(Nc2ccc(N3CCCC3)cc2)nc(Cl)n1	ZINC000872389148	DF	On-Demand	Anodyne	MAPK10	50	41
NC(=O)c1cc(Nc2ccc(N3CCCC3)cc2)nc(Cl)n1	ZINC000872389148	DF	On-Demand	Anodyne	MAPK8	17	41
NC(=O)c1cc(Nc2ccc(N3CCCC3)cc2)nc(Cl)n1	ZINC000872389148	DF	On-Demand	Anodyne	STAT6	75	40
COc1ccc(CN(C)c2ncnc(F)c2C)c(OC)c1	ZINC000872389206	CF	On-Demand	Anodyne	DRTS_TOXGO	22	46
COc1ccc(CN(C)c2ncnc(F)c2C)c(OC)c1	ZINC000872389206	CF	On-Demand	Anodyne	DYR_PNECA	19	46
CN(Cc1ccc(Cl)cc1Cl)c1nc(N)nc(C(F)F)n1	ZINC000872389224	EG	On-Demand	Anodyne	DRTS_TOXGO	25	42
CN(Cc1ccc(Cl)cc1Cl)c1nc(N)nc(C(F)F)n1	ZINC000872389224	EG	On-Demand	Anodyne	DYR_PNECA	21	42
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)c(OC)c1	ZINC000872389237	EE	On-Demand	Anodyne	DHFR	26	56
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)c(OC)c1	ZINC000872389237	EE	On-Demand	Anodyne	DFR1	17	44
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)c(OC)c1	ZINC000872389237	EE	On-Demand	Anodyne	DRTS_TOXGO	49	56
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)c(OC)c1	ZINC000872389237	EE	On-Demand	Anodyne	DYR_PNECA	44	56
CC(CCc1cccnc1)=NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000872389246	EE	On-Demand	Reactive	TBXAS1	58	39
CC(CCc1cccnc1)=NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000872389246	EE	On-Demand	Reactive	PTAFR	25	43
C[C@@H]1CN(C)C[C@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)O1	ZINC000872389248	FD	On-Demand	Reactive	L3MBTL3	43	36
O=S(=O)(c1c(F)cccc1F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872389278	GD	On-Demand	Anodyne	PKM	39	55
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000872389308	FD	On-Demand	Anodyne	PKM	32	57
CNc1ccccc1C=NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000872389331	DE	On-Demand	Reactive	ABAT	36	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccc(Cl)n1	ZINC000872389351	GE	On-Demand	Reactive	LTA4H	41	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccc(Cl)n1	ZINC000872389351	GE	On-Demand	Reactive	EPHX2	17	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccc(Cl)n1	ZINC000872389351	GE	On-Demand	Reactive	FLT3	18	43
COc1ccc(CN(C)c2cc(C(N)=O)nc(Cl)n2)c(OC)c1	ZINC000872389372	ED	On-Demand	Anodyne	DRTS_TOXGO	15	44
CC(=O)Nc1cccc(C=NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000872389421	EE	On-Demand	Reactive	ABAT	26	46
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CN(C)C[C@H](C)O1	ZINC000872389507	EE	On-Demand	Reactive	MC5R	41	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CN(C)C[C@H](C)O1	ZINC000872389507	EE	On-Demand	Reactive	GHSR	40	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN(C)C[C@@H](C)O1	ZINC000872389508	EE	On-Demand	Reactive	MC5R	41	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN(C)C[C@@H](C)O1	ZINC000872389508	EE	On-Demand	Reactive	GHSR	40	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN(C)C[C@H](C)O1	ZINC000872389509	EE	On-Demand	Reactive	MC5R	41	38
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CN(C)C[C@H](C)O1	ZINC000872389509	EE	On-Demand	Reactive	GHSR	40	36
CN(Cc1ccc(Cl)cc1)c1nc(N)nc(C(F)F)n1	ZINC000872389554	CF	On-Demand	Anodyne	DRTS_TOXGO	19	40
CN(Cc1ccc(Cl)cc1)c1nc(N)nc(C(F)F)n1	ZINC000872389554	CF	On-Demand	Anodyne	DYR_PNECA	17	40
C[C@@H]1CN(C)C[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)O1	ZINC000872389596	GC	On-Demand	Reactive	EPHX2	16	41
COc1ccc(CN(C)c2cc(C)nc3c2cnn3C)c(OC)c1	ZINC000872389613	EF	On-Demand	Anodyne	DRTS_TOXGO	19	44
COc1ccc(CN(C)c2cc(C)nc3c2cnn3C)c(OC)c1	ZINC000872389613	EF	On-Demand	Anodyne	DYR_PNECA	15	44
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DHFR	25	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	FOLA	21	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DRTS_PLAFK	27	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DRTS_PLABA	15	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DRTS_TOXGO	43	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DYR_PNECA	35	40
COc1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872389713	EE	On-Demand	Anodyne	DRTS_TRYCR	46	38
O=C(O)c1cccc(C(=O)NN=CCCOCC(F)F)c1	ZINC000872389788	DD	On-Demand	Reactive	ADCYAP1R1	48	31
CN1CCC(C=NNC(=O)c2cccc(Cl)n2)CC1	ZINC000872389806	CD	On-Demand	Reactive	HTR1F	65	35
CC(C)(C)C(=O)NCCCC(=O)NN=Cc1cccnc1Br	ZINC000872389847	FE	On-Demand	Reactive	ABAT	25	40
CC(C)(C)C(=O)NCCCC(=O)NN=Cc1ccccc1CC(F)(F)F	ZINC000872389858	FG	On-Demand	Reactive	ABAT	24	43
CC(C)(C)C(=O)NCCCC(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872389864	FF	On-Demand	Reactive	ABAT	19	40
O=S(=O)(Nc1cnn2c1CCCC2)c1cccc2ncccc12	ZINC000872389905	EF	On-Demand	Anodyne	HNMT	44	38
CCNc1ccccc1C=NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000872389950	EF	On-Demand	Reactive	ABAT	31	44
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2cnn3c2CCCC3)c1	ZINC000872390028	FD	On-Demand	Anodyne	CPT1A	37	40
CC(C)(C)C(=O)NCCCC(=O)NN=Cc1cccc(F)c1OC(F)(F)F	ZINC000872390069	GG	On-Demand	Reactive	ABAT	19	41
CCOC(=O)N1CCN(S(=O)(=O)Nc2cnn3c2CCCC3)CC1	ZINC000872390107	FC	On-Demand	Anodyne	TGM2	31	41
CCOC(=O)N1CCN(S(=O)(=O)Nc2cnn3c2CCCC3)CC1	ZINC000872390107	FC	On-Demand	Anodyne	F13A1	30	41
O=C(O)c1cccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872390108	GG	On-Demand	Reactive	DRD4	35	48
O=C(O)c1cccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872390108	GG	On-Demand	Reactive	ACHE	31	43
O=C(O)c1cccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)c1	ZINC000872390108	GG	On-Demand	Reactive	SIGMAR1	33	46
Cn1ncc2c(N3CCN(C(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872390115	FD	On-Demand	Anodyne	P2RY12	15	43
Cn1ncc2c(N3CCN(C(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872390115	FD	On-Demand	Anodyne	MTOR	18	42
Cn1ncc2c(N3CCN(C(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872390115	FD	On-Demand	Anodyne	SMO	48	47
Nc1nc(NC[C@@H]2CN(Cc3ccccc3)CCO2)nc(C(F)F)n1	ZINC000872390132	FD	On-Demand	Anodyne	DRD4	18	47
Nc1nc(NC[C@H]2CN(Cc3ccccc3)CCO2)nc(C(F)F)n1	ZINC000872390133	FD	On-Demand	Anodyne	DRD4	18	47
Cn1ncc2c(NC[C@@H](c3ccc(F)cc3)N3CCOCC3)nc(Cl)nc21	ZINC000872390140	GF	On-Demand	Anodyne	ABL1	20	41
Cn1ncc2c(NC[C@H](c3ccc(F)cc3)N3CCOCC3)nc(Cl)nc21	ZINC000872390141	GF	On-Demand	Anodyne	ABL1	20	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3cnn4c3CCCC4)cc2N1	ZINC000872390160	GF	On-Demand	Anodyne	PKM	38	47
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2cnn3c2CCCC3)cc1	ZINC000872390161	FG	On-Demand	Anodyne	PRTN3	54	33
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2)CC1	ZINC000872390169	DD	On-Demand	Anodyne	PDGFRB	28	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2)CC1	ZINC000872390169	DD	On-Demand	Anodyne	NPY2R	25	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2)CC1	ZINC000872390169	DD	On-Demand	Anodyne	AKT1	27	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2)CC1	ZINC000872390169	DD	On-Demand	Anodyne	SMO	52	51
COc1cc(C=NNC(=O)OCC(F)(F)F)c(Cl)cc1O	ZINC000872390195	EF	On-Demand	Reactive	GCGR	23	42
COc1cc(C=NNC(=O)OCC(F)(F)F)c(Cl)cc1O	ZINC000872390195	EF	On-Demand	Reactive	ADCYAP1R1	70	39
CN(Cc1ccc(Cl)c(Cl)c1)c1nc(N)nc(C(F)F)n1	ZINC000872390208	EG	On-Demand	Anodyne	DRTS_TOXGO	20	41
CN(Cc1ccc(Cl)c(Cl)c1)c1nc(N)nc(C(F)F)n1	ZINC000872390208	EG	On-Demand	Anodyne	DYR_PNECA	17	41
O=C(O)c1cccc(C(=O)NN=Cc2ccnn2CC2CCC2)c1	ZINC000872390211	EE	On-Demand	Reactive	ADCYAP1R1	48	31
Cn1ncc2c(NC[C@H]3CN(Cc4ccccc4)CCO3)nc(Cl)nc21	ZINC000872390223	FE	On-Demand	Anodyne	DRD4	15	45
Cn1ncc2c(NC[C@@H]3CN(Cc4ccccc4)CCO3)nc(Cl)nc21	ZINC000872390224	FE	On-Demand	Anodyne	DRD4	15	45
COc1ccc(OC)c2sc(NCCNC(C)=O)nc12	ZINC000872390229	CD	On-Demand	Anodyne	ADORA2B	19	44
COc1ccc(OC)c2sc(NCCNC(C)=O)nc12	ZINC000872390229	CD	On-Demand	Anodyne	NQO2	49	37
COc1ccc(OC)c2sc(NCCNC(C)=O)nc12	ZINC000872390229	CD	On-Demand	Anodyne	MTNR1A	51	39
COc1ccc(OC)c2sc(NCCNC(C)=O)nc12	ZINC000872390229	CD	On-Demand	Anodyne	MTNR1B	53	42
O=C(c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872390234	DD	On-Demand	Anodyne	NPY2R	36	49
O=C(c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872390234	DD	On-Demand	Anodyne	SMO	47	49
COc1ccc(Cn2cc(C=NNC(=O)OCC(F)(F)F)nn2)cc1	ZINC000872390239	FD	On-Demand	Reactive	PROKR1	64	35
CCC(=NNC(=O)OCC(F)(F)F)c1cccc(OC)c1OC	ZINC000872390266	EG	On-Demand	Reactive	KCNK3	43	37
Oc1nnc(Cl)cc1NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872390267	EE	On-Demand	Anodyne	DRD4	31	59
Oc1nnc(Cl)cc1NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872390268	EE	On-Demand	Anodyne	DRD4	31	59
NC(=O)c1cc(NC[C@@H](c2ccc(F)cc2)N2CCOCC2)nc(Cl)n1	ZINC000872390292	GD	On-Demand	Anodyne	STAT6	49	34
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccc(F)n1	ZINC000872390294	FD	On-Demand	Reactive	LTA4H	42	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cccc(F)n1	ZINC000872390294	FD	On-Demand	Reactive	EPHX2	18	43
NC(=O)c1cc(NC[C@H](c2ccc(F)cc2)N2CCOCC2)nc(Cl)n1	ZINC000872390295	GD	On-Demand	Anodyne	STAT6	49	34
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)OCC(F)(F)F	ZINC000872390308	EF	On-Demand	Reactive	MLYCD	19	43
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)OCC(F)(F)F	ZINC000872390308	EF	On-Demand	Reactive	L3MBTL3	47	35
NC(=O)c1cc(N2CCN(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872390309	ED	On-Demand	Anodyne	NPY2R	29	42
NC(=O)c1cc(N2CCN(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872390309	ED	On-Demand	Anodyne	SCD1	19	42
NC(=O)c1cc(N2CCN(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872390309	ED	On-Demand	Anodyne	SMO	43	47
COC(=O)CCCNc1cc(-c2ccccc2)ncn1	ZINC000872390314	CF	On-Demand	Anodyne	LTB4R	31	51
COC(=O)CCCNc1cc(-c2ccccc2)ncn1	ZINC000872390314	CF	On-Demand	Anodyne	FAAH	21	51
CCCN(C)S(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872390362	DE	On-Demand	Anodyne	MLYCD	18	53
Nc1nc(C(F)F)nc(N2CCN(C(=O)c3ccccc3)CC2)n1	ZINC000872390427	ED	On-Demand	Anodyne	SMO	32	42
NC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390452	CD	On-Demand	Anodyne	SLC6A1	70	35
NC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390452	CD	On-Demand	Anodyne	PDPK1	15	44
NC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390452	CD	On-Demand	Anodyne	VCP	43	34
NC(=O)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390453	CD	On-Demand	Anodyne	SLC6A1	70	35
NC(=O)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390453	CD	On-Demand	Anodyne	PDPK1	15	44
NC(=O)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872390453	CD	On-Demand	Anodyne	VCP	43	34
Cn1ncc2c(N3CCN(C(=O)[C@H]4CCCO4)CC3)nc(Cl)nc21	ZINC000872390549	FC	On-Demand	Anodyne	MTOR	43	33
Cn1ncc2c(N3CCN(C(=O)[C@@H]4CCCO4)CC3)nc(Cl)nc21	ZINC000872390550	FC	On-Demand	Anodyne	MTOR	43	33
Nc1nc(NCCOc2ccccc2)nc(C(F)F)n1	ZINC000872390603	CD	On-Demand	Anodyne	HTR7	17	61
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)OCC(F)(F)F	ZINC000872390616	GE	On-Demand	Reactive	LTA4H	30	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)OCC(F)(F)F	ZINC000872390616	GE	On-Demand	Reactive	EPHX2	22	50
NC(=O)c1cc(NC[C@@H]2CN(Cc3ccccc3)CCO2)nc(Cl)n1	ZINC000872390618	FD	On-Demand	Anodyne	DRD4	31	47
NC(=O)c1cc(NC[C@H]2CN(Cc3ccccc3)CCO2)nc(Cl)n1	ZINC000872390619	FD	On-Demand	Anodyne	DRD4	31	47
O=S(=O)(Nc1cnn2c1CCCC2)c1cnc(Cl)c(F)c1	ZINC000872390636	EE	On-Demand	Anodyne	PIK3C3	46	34
COc1ccc(Cn2cc(C=NNc3nnc(C)n3C)nn2)cc1	ZINC000872390641	ED	On-Demand	Mild	PROKR1	62	34
O=C(O)c1cccc(C(=O)NN=CCCCCCO)c1	ZINC000872390668	CD	On-Demand	Reactive	ADCYAP1R1	42	30
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872390715	GF	On-Demand	Anodyne	TGM2	64	38
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872390715	GF	On-Demand	Anodyne	F13A1	47	36
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872390715	GF	On-Demand	Anodyne	NAMPT	45	39
CN1CCC(C=NNC(=O)c2cccc(F)n2)CC1	ZINC000872390751	CD	On-Demand	Reactive	HTR1F	79	36
O=C(c1ccc(NS(=O)(=O)N2CCOCC2)cc1)C(F)(F)F	ZINC000872390794	ED	On-Demand	Anodyne	EPHX2	15	45
COc1ccc(Cn2cc(C=NN3C(=O)[C@@H](C)N(C)C3=O)nn2)cc1	ZINC000872390795	EC	On-Demand	Mild	PROKR1	60	32
COc1ccc(Cn2cc(C=NN3C(=O)[C@H](C)N(C)C3=O)nn2)cc1	ZINC000872390797	EC	On-Demand	Mild	PROKR1	60	32
CC(CCc1cccnc1)=NNCC(C)(C)O	ZINC000872390822	BD	On-Demand	Mild	TBXAS1	29	40
C[C@@H]1[C@H](C(=O)NN=Cc2cc(F)ccc2N(C)C)CCCN1C	ZINC000872390841	DE	On-Demand	Reactive	ACKR3	45	32
C[C@@H]1[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCN1C	ZINC000872390845	GD	On-Demand	Reactive	ESR1	46	34
C[C@@H]1[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCN1C	ZINC000872390845	GD	On-Demand	Reactive	HRH3	23	42
C[C@@H]1[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)CCCN1C	ZINC000872390845	GD	On-Demand	Reactive	EPHX2	18	44
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	ESR1	55	36
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	LTA4H	41	46
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	HRH3	17	43
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	EPHX2	16	43
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	PSMB2	40	38
CC(C)(O)CNN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872390884	DD	On-Demand	Mild	PSMB1	44	41
CN1CCC(C=NNC(=O)c2cccc(C(=O)O)c2)CC1	ZINC000872390894	CD	On-Demand	Reactive	AKR1C3	40	35
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872390924	EF	On-Demand	Anodyne	DRD2	25	45
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872390924	EF	On-Demand	Anodyne	DRD4	76	43
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872390924	EF	On-Demand	Anodyne	DRD3	19	40
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872390924	EF	On-Demand	Anodyne	SIGMAR1	15	48
CC(CCOCc1ccccc1)=NNC(=O)OCC(F)(F)F	ZINC000872390981	DG	On-Demand	Reactive	PPO2	34	40
O=C(c1ccc(C=NNc2ncc(Cl)cn2)cc1)N1CCCC1	ZINC000872391000	EF	On-Demand	Mild	L3MBTL3	75	39
Nc1nc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391060	DE	On-Demand	Anodyne	DRD4	38	44
Nc1nc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391060	DE	On-Demand	Anodyne	HRH4	20	44
Nc1nc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391060	DE	On-Demand	Anodyne	CCR3	17	42
Nc1nc(N[C@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391061	DE	On-Demand	Anodyne	DRD4	38	44
Nc1nc(N[C@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391061	DE	On-Demand	Anodyne	HRH4	20	44
Nc1nc(N[C@H]2CCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872391061	DE	On-Demand	Anodyne	CCR3	17	42
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CCCO[C@H]3C(C)(C)C)nn2)cc1	ZINC000872391090	GF	On-Demand	Reactive	PROKR1	55	33
CC(C)(O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872391092	CD	On-Demand	Mild	MLYCD	19	44
CC(C)(O)CNN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872391092	CD	On-Demand	Mild	L3MBTL3	69	38
COc1ccc(Cn2cc(C=NNCC(C)(C)O)nn2)cc1	ZINC000872391132	DD	On-Demand	Mild	PROKR1	69	38
Cc1nnc(NN=Cc2ccc(OCCN3CCOCC3)cc2)n1C	ZINC000872391148	ED	On-Demand	Mild	LTA4H	35	44
CCOC(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872391149	DD	On-Demand	Anodyne	P2RY12	52	36
O=C(O)c1cccc(C(=O)NN=C2CC[C@@H]3C[C@H]23)c1	ZINC000872391167	CD	On-Demand	Reactive	AKR1C3	41	34
Cc1c(F)ncnc1NCC1(N2CCOCC2)CCCCC1	ZINC000872391184	DE	On-Demand	Anodyne	HCN1	51	31
Cc1c(F)ncnc1NCC1(N2CCOCC2)CCCCC1	ZINC000872391184	DE	On-Demand	Anodyne	HCN4	47	30
CCCc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872391185	GE	On-Demand	Anodyne	ADORA2B	46	34
CCCc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872391185	GE	On-Demand	Anodyne	NOD2	18	42
CCOC(=O)N1CCC(Nc2cc(C)nc3c2cnn3C)CC1	ZINC000872391189	DE	On-Demand	Anodyne	CCR8	26	40
CCOC(=O)N1CCC(Nc2cc(C)nc3c2cnn3C)CC1	ZINC000872391189	DE	On-Demand	Anodyne	CD38	40	30
CCOC(=O)N1CCC(Nc2cc(C)nc3c2cnn3C)CC1	ZINC000872391189	DE	On-Demand	Anodyne	GPR119	15	41
CC(CCc1c[nH]c2ccccc12)=NNc1nnc(C)n1C	ZINC000872391239	CG	On-Demand	Mild	MPO	16	40
CCC(=O)c1c(Cl)cccc1NCCNC(C)=O	ZINC000872391244	CE	On-Demand	Anodyne	ECR	45	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	TACR1	27	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	CCKAR	39	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	NMBR	24	42
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	MMP11	44	32
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	CCKBR	54	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)OCC(F)(F)F	ZINC000872391247	EH	On-Demand	Reactive	GHSR	46	37
O=C(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872391261	DF	On-Demand	Anodyne	NPY2R	35	42
O=C(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872391261	DF	On-Demand	Anodyne	RBP4	26	43
O=C(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872391261	DF	On-Demand	Anodyne	SMO	43	43
O=C(c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872391261	DF	On-Demand	Anodyne	L3MBTL3	55	34
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872391287	EE	On-Demand	Anodyne	PTPRB	46	36
COCCS(=O)(=O)Nc1cc(C)cc(NC(=O)OC(C)(C)C)c1	ZINC000872391291	EF	On-Demand	Anodyne	PTPRB	28	41
Cn1ncc2c(NCc3ccc4c(c3)OCCO4)nc(Cl)nc21	ZINC000872391293	EE	On-Demand	Anodyne	CLK2	22	41
Cn1ncc2c(NCc3ccc4c(c3)OCCO4)nc(Cl)nc21	ZINC000872391293	EE	On-Demand	Anodyne	CLK4	22	41
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCO2	ZINC000872391327	CE	On-Demand	Anodyne	DYRK1A	30	42
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCO2	ZINC000872391327	CE	On-Demand	Anodyne	CLK1	30	44
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCO2	ZINC000872391327	CE	On-Demand	Anodyne	CLK2	35	42
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCO2	ZINC000872391327	CE	On-Demand	Anodyne	CLK4	61	44
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCO2	ZINC000872391327	CE	On-Demand	Anodyne	DYRK1B	26	42
CC(C)(C)OC(=O)NCc1cccc(C=NNC(=O)c2cccc(F)n2)c1	ZINC000872391331	FG	On-Demand	Reactive	ADCYAP1R1	42	36
O=C(c1ccc(C=NOCC2CCC2)cc1)N1CCCC1	ZINC000872391344	CG	On-Demand	Mild	L3MBTL3	89	43
COCCS(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872391402	DD	On-Demand	Anodyne	PTPRB	71	40
COCCS(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872391402	DD	On-Demand	Anodyne	MLYCD	15	42
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	DRD2	16	41
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	DRD4	38	40
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	ACHE	31	44
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	HRP1_PLAFA	75	35
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	SIGMAR1	55	48
Oc1nnc(Cl)cc1NCCN1CCN(Cc2ccccc2)CC1	ZINC000872391450	EE	On-Demand	Anodyne	HNMT	57	38
Cc1nnc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1C	ZINC000872391487	DD	On-Demand	Mild	L3MBTL3	54	36
Cc1nnc(NN=Cc2ccc(C(=O)N3CCCC3)cc2)n1C	ZINC000872391487	DD	On-Demand	Mild	HPGD	42	36
O=C(NN=Cc1ccc(CC(F)(F)F)cc1)OCC(F)(F)F	ZINC000872391499	EG	On-Demand	Reactive	ADCYAP1R1	40	35
N#Cc1ccc(CN2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872391500	EF	On-Demand	Mild	DRD4	34	40
COc1ccc(Cn2cc(C=NN[C@H]3CCCS(=O)(=O)C3)nn2)cc1	ZINC000872391510	FC	On-Demand	Mild	PROKR1	43	30
COc1ccc(Cn2cc(C=NN[C@@H]3CCCS(=O)(=O)C3)nn2)cc1	ZINC000872391511	FC	On-Demand	Mild	PROKR1	43	30
CCCCN(C)S(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872391516	EF	On-Demand	Anodyne	MLYCD	16	48
COc1cccc([C@H](CNc2cc(C(N)=O)nc(Cl)n2)N(C)C)c1	ZINC000872391532	ED	On-Demand	Anodyne	AOC3	15	41
NC(=O)[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872391539	DE	On-Demand	Anodyne	GRM5	19	50
NC(=O)[C@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872391540	DE	On-Demand	Anodyne	GRM5	19	50
Nc1nc(NCc2ccc3c(c2)OCCO3)nc(C(F)F)n1	ZINC000872391550	DD	On-Demand	Anodyne	CLK2	28	43
C[C@H]1C(=O)N(N=Cc2ccc(C(=O)N3CCCC3)cc2)C(=O)N1C	ZINC000872391563	ED	On-Demand	Mild	L3MBTL3	58	38
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872391593	GE	On-Demand	Anodyne	TGM2	39	43
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872391593	GE	On-Demand	Anodyne	F13A1	33	43
C[C@H]1C(=O)N(N=Cc2ccc(OCCN3CCOCC3)cc2)C(=O)N1C	ZINC000872391627	FD	On-Demand	Mild	LTA4H	32	43
CC(CCc1c[nH]c2ccccc12)=NNCC(C)(C)O	ZINC000872391645	CF	On-Demand	Mild	MPO	36	44
N#Cc1ccc(CN2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872391647	DG	On-Demand	Mild	DRD4	18	42
CC(C)(O)CNN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872391664	DE	On-Demand	Mild	SIGMAR1	20	42
O=C(c1ccc(C=NN[C@H]2CCCS(=O)(=O)C2)cc1)N1CCCC1	ZINC000872391665	ED	On-Demand	Mild	L3MBTL3	73	39
O=C(c1ccc(C=NN[C@@H]2CCCS(=O)(=O)C2)cc1)N1CCCC1	ZINC000872391666	ED	On-Demand	Mild	L3MBTL3	73	39
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	P2RY12	69	36
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	GRIN2B	22	43
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	SSTR5	56	38
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	MAPK9	25	49
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	MAPK8	19	49
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	CCR8	84	46
CCOC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872391701	DF	On-Demand	Anodyne	GPR119	29	41
Cc1c(F)ncnc1N1CCN(C(=O)C(C)C)CC1	ZINC000872391726	CD	On-Demand	Anodyne	AKT2	23	40
Cc1c(F)ncnc1N1CCN(C(=O)C(C)C)CC1	ZINC000872391726	CD	On-Demand	Anodyne	AKT3	45	40
Cc1c(F)ncnc1N1CCN(C(=O)C(C)C)CC1	ZINC000872391726	CD	On-Demand	Anodyne	AKT1	37	43
Cc1cc(C)c(/C=C/C=NNC(=O)[C@@H]2CCC(=O)N2)c(C)c1	ZINC000872391753	CE	On-Demand	Reactive	TRHR	41	31
Cc1cc(C)c(/C=C/C=NNC(=O)[C@H]2CCC(=O)N2)c(C)c1	ZINC000872391756	CE	On-Demand	Reactive	TRHR	41	31
CO[C@@H](CS(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1)C(C)C	ZINC000872391768	FF	On-Demand	Anodyne	PTPRB	48	35
CCC(=O)c1c(Cl)cccc1NCCn1ccnc1	ZINC000872391782	CG	On-Demand	Anodyne	TBXAS1	58	42
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872391801	GD	On-Demand	Anodyne	TGM2	34	42
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872391801	GD	On-Demand	Anodyne	GCK	41	34
CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872391801	GD	On-Demand	Anodyne	F13A1	33	42
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	LTA4H	33	41
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	EPHX2	19	43
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	FLT3	18	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	EPHA2	17	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	MKNK1	23	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1cn[nH]c1	ZINC000872391817	EC	On-Demand	Reactive	TBK1	15	43
CC(CCc1cccnc1)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872391903	CC	On-Demand	Reactive	CHRNA7	43	35
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872391905	CC	On-Demand	Reactive	CHRNA7	43	35
N#Cc1ccc(CN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872391950	FD	On-Demand	Mild	DRD4	15	40
NC(=O)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872391958	BD	On-Demand	Anodyne	PIM1	19	40
NC(=O)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872391958	BD	On-Demand	Anodyne	PIM3	15	43
NC(=O)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872391961	BD	On-Demand	Anodyne	PIM1	19	40
NC(=O)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872391961	BD	On-Demand	Anodyne	PIM3	15	43
Cc1c(F)ncnc1N1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872392001	DE	On-Demand	Mild	ABCC1	62	38
Nc1nc(NCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872392020	FD	On-Demand	Anodyne	DRD4	26	42
Nc1nc(NCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872392020	FD	On-Demand	Anodyne	ACHE	17	42
Nc1nc(NCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872392020	FD	On-Demand	Anodyne	SIGMAR1	30	41
CCCc1ccc(C[C@H](C)C=NNC(=O)[C@@H]2CCC(=O)N2)cc1	ZINC000872392039	DE	On-Demand	Reactive	TRHR	45	37
CCCc1ccc(C[C@@H](C)C=NNC(=O)[C@@H]2CCC(=O)N2)cc1	ZINC000872392040	DE	On-Demand	Reactive	TRHR	45	37
CCCc1ccc(C[C@@H](C)C=NNC(=O)[C@H]2CCC(=O)N2)cc1	ZINC000872392041	DE	On-Demand	Reactive	TRHR	45	37
CCCc1ccc(C[C@H](C)C=NNC(=O)[C@H]2CCC(=O)N2)cc1	ZINC000872392042	DE	On-Demand	Reactive	TRHR	45	37
c1ccc(-c2cc(N3CCN(C[C@@H]4CCCO4)CC3)ncn2)cc1	ZINC000872392062	DE	On-Demand	Anodyne	TNK2	59	40
c1ccc(-c2cc(N3CCN(C[C@H]4CCCO4)CC3)ncn2)cc1	ZINC000872392063	DE	On-Demand	Anodyne	TNK2	59	40
CC(CCOCc1ccccc1)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872392102	DD	On-Demand	Reactive	HDAC10	21	40
CC(CCOCc1ccccc1)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872392102	DD	On-Demand	Reactive	HDAC6	15	40
CC(CCOCc1ccccc1)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872392102	DD	On-Demand	Reactive	HDAC11	28	40
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872392103	DD	On-Demand	Reactive	HDAC10	21	40
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872392103	DD	On-Demand	Reactive	HDAC6	15	40
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872392103	DD	On-Demand	Reactive	HDAC11	28	40
O=C1CC[C@@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392104	ED	On-Demand	Reactive	HDAC10	24	43
O=C1CC[C@@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392104	ED	On-Demand	Reactive	HDAC6	18	43
O=C1CC[C@@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392104	ED	On-Demand	Reactive	HDAC11	33	43
O=C1CC[C@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392106	ED	On-Demand	Reactive	HDAC10	24	43
O=C1CC[C@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392106	ED	On-Demand	Reactive	HDAC6	18	43
O=C1CC[C@H](C(=O)NN=C(CCc2ccccc2)c2ccccn2)N1	ZINC000872392106	ED	On-Demand	Reactive	HDAC11	33	43
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	CHRM2	19	41
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	DRD2	17	48
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	DRD4	52	48
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	ACHE	40	41
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	DRD3	16	46
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	SIGMAR1	43	47
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	SSTR5	59	36
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	CCR3	45	46
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	UTS2R	21	41
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	CCR2	21	43
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	MCHR1	37	53
NC(=O)c1cc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392107	ED	On-Demand	Anodyne	NPFFR1	42	36
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	CHRM2	19	41
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	DRD2	17	48
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	DRD4	52	48
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	ACHE	40	41
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	DRD3	16	46
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	SIGMAR1	43	47
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	SSTR5	59	36
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	CCR3	45	46
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	UTS2R	21	41
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	CCR2	21	43
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	MCHR1	37	53
NC(=O)c1cc(N[C@H]2CCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872392109	ED	On-Demand	Anodyne	NPFFR1	42	36
Cn1ncc2c(NCCNC(=O)C3CC3)nc(Cl)nc21	ZINC000872392117	CC	On-Demand	Anodyne	TBK1	63	38
CN(CC1CC1)S(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872392163	EE	On-Demand	Anodyne	MLYCD	15	51
CN(C)[C@@H](CNc1nc(Cl)nc2c1cnn2C)c1cccc(F)c1	ZINC000872392167	EF	On-Demand	Anodyne	ABL1	30	41
CCC(=NNC(=O)c1cn[nH]c1)c1cccc(OC)c1OC	ZINC000872392173	DD	On-Demand	Reactive	ROCK2	17	42
CCC(=NNC(=O)c1cn[nH]c1)c1cccc(OC)c1OC	ZINC000872392173	DD	On-Demand	Reactive	KCNK3	43	37
C[C@@H](Nc1nc(N)nc(C(F)F)n1)c1ccc(F)c(F)c1	ZINC000872392177	DF	On-Demand	Anodyne	TPH1	23	40
O=C1CC[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)N1	ZINC000872392182	FC	On-Demand	Reactive	LTA4H	27	40
O=C1CC[C@@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)N1	ZINC000872392182	FC	On-Demand	Reactive	EPHX2	18	43
O=C1CC[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)N1	ZINC000872392184	FC	On-Demand	Reactive	LTA4H	27	40
O=C1CC[C@H](C(=O)NN=Cc2ccc(OCCN3CCOCC3)cc2)N1	ZINC000872392184	FC	On-Demand	Reactive	EPHX2	18	43
O=C(C1CC1)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872392201	EF	On-Demand	Anodyne	GRM5	25	48
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	DRD2	16	46
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	DRD4	51	46
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	ACHE	39	42
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	DRD3	15	45
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	SIGMAR1	45	46
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	SSTR5	48	34
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	CCR3	30	42
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	UTS2R	19	41
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	CCR2	19	46
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872392225	DF	On-Demand	Anodyne	MCHR1	22	51
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	DRD2	16	46
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	DRD4	51	46
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	ACHE	39	42
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	DRD3	15	45
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	SIGMAR1	45	46
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	SSTR5	48	34
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	CCR3	30	42
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	UTS2R	19	41
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	CCR2	19	46
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000872392226	DF	On-Demand	Anodyne	MCHR1	22	51
O=S1(=O)CCC[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872392227	GC	On-Demand	Mild	ESR1	48	35
O=S1(=O)CCC[C@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872392227	GC	On-Demand	Mild	LTA4H	39	41
O=S1(=O)CCC[C@@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872392228	GC	On-Demand	Mild	ESR1	48	35
O=S1(=O)CCC[C@@H](NN=Cc2ccc(OCCN3CCOCC3)cc2)C1	ZINC000872392228	GC	On-Demand	Mild	LTA4H	39	41
CCOC(=O)N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872392233	EE	On-Demand	Anodyne	Q4VQ11_PIG	58	35
COc1ccc(OC)c2sc(NCCn3ccnc3)nc12	ZINC000872392251	DF	On-Demand	Anodyne	CYP19A1	17	47
COc1ccc(OC)c2sc(NCCn3ccnc3)nc12	ZINC000872392251	DF	On-Demand	Anodyne	HMOX2	46	33
COc1ccc(OC)c2sc(NCCn3ccnc3)nc12	ZINC000872392251	DF	On-Demand	Anodyne	QPCT	34	44
O=C(C1CC1)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872392284	CD	On-Demand	Anodyne	MAPK9	15	40
O=C(C1CC1)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872392284	CD	On-Demand	Anodyne	MAPK8	17	40
Cn1ncc2c(N3CCC(C(=O)N4CCOCC4)CC3)nc(Cl)nc21	ZINC000872392285	FD	On-Demand	Anodyne	PIK3CA	23	40
Cn1ncc2c(N3CCC(C(=O)N4CCOCC4)CC3)nc(Cl)nc21	ZINC000872392285	FD	On-Demand	Anodyne	MTOR	45	38
CN(C)S(=O)(=O)Nc1ccc(C(=O)C(F)(F)F)cc1	ZINC000872392322	CD	On-Demand	Anodyne	MLYCD	15	43
N#Cc1ccc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872392344	EE	On-Demand	Mild	DRD4	32	43
Nc1nc(C(F)F)nc(N2CCN(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872392349	FE	On-Demand	Anodyne	DRD4	48	42
Cn1ncc2c(N[C@@H]3CCN(Cc4ccccc4)C3)nc(Cl)nc21	ZINC000872392352	EF	On-Demand	Anodyne	DRD4	36	42
Cn1ncc2c(N[C@H]3CCN(Cc4ccccc4)C3)nc(Cl)nc21	ZINC000872392353	EF	On-Demand	Anodyne	DRD4	36	42
CC(CCc1cccnc1)=NNC(=O)c1cc(C)cs1	ZINC000872392357	CG	On-Demand	Reactive	PTAFR	21	40
CS(=O)(=O)Nc1cc(F)cc(CNC(=O)C(F)(F)F)c1	ZINC000872392396	DD	On-Demand	Anodyne	TRPV1	43	45
CC(C)(O)CNN=Cc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000872392416	DE	On-Demand	Mild	PDS	41	32
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	GSK3B	18	41
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	GSK3A	38	41
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	MTNR1A	18	40
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	MTNR1B	15	40
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	F11	33	47
O=C(NCCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872392446	CE	On-Demand	Anodyne	VCP	68	43
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872392454	DD	On-Demand	Reactive	CCKBR	43	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@@H]1CCC(=O)N1	ZINC000872392454	DD	On-Demand	Reactive	GHSR	50	37
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872392455	DD	On-Demand	Reactive	CCKBR	43	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)[C@H]1CCC(=O)N1	ZINC000872392455	DD	On-Demand	Reactive	GHSR	50	37
O=C(NN=Cc1ccc(C(=O)N2CCCC2)cc1)c1cn[nH]c1	ZINC000872392460	DD	On-Demand	Reactive	L3MBTL3	51	35
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000872392462	DE	On-Demand	Reactive	FKBP1A	15	41
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000872392462	DE	On-Demand	Reactive	CHRNA7	46	37
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000872392462	DE	On-Demand	Reactive	C3AR1	41	42
CC(CCc1cccnc1)=NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000872392462	DE	On-Demand	Reactive	NAMPT	33	40
COc1ccc(OC)c2sc(NCCNC(=O)C3CC3)nc12	ZINC000872392463	DE	On-Demand	Anodyne	ADORA2B	18	42
COc1ccc(OC)c2sc(NCCNC(=O)C3CC3)nc12	ZINC000872392463	DE	On-Demand	Anodyne	MTNR1A	37	46
COc1ccc(OC)c2sc(NCCNC(=O)C3CC3)nc12	ZINC000872392463	DE	On-Demand	Anodyne	MTNR1B	31	46
COc1ccc(OC)c2sc(NCCNC(=O)C3CC3)nc12	ZINC000872392463	DE	On-Demand	Anodyne	TBK1	49	41
O=C1CCCCCN1CCCNc1ccnc2ncccc12	ZINC000872392480	CF	On-Demand	Anodyne	HRP1_PLAFA	116	46
O=C1CCCCCN1CCCNc1ccnc2ncccc12	ZINC000872392480	CF	On-Demand	Anodyne	HNMT	107	51
O=C1CC[C@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392481	ED	On-Demand	Reactive	HDAC10	25	40
O=C1CC[C@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392481	ED	On-Demand	Reactive	HDAC2	15	40
O=C1CC[C@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392481	ED	On-Demand	Reactive	HDAC6	19	40
O=C1CC[C@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392481	ED	On-Demand	Reactive	HDAC11	36	40
O=C1CC[C@@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392482	ED	On-Demand	Reactive	HDAC10	25	40
O=C1CC[C@@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392482	ED	On-Demand	Reactive	HDAC2	15	40
O=C1CC[C@@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392482	ED	On-Demand	Reactive	HDAC6	19	40
O=C1CC[C@@H](C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)N1	ZINC000872392482	ED	On-Demand	Reactive	HDAC11	36	40
O=C(C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCOCC1	ZINC000872392485	GF	On-Demand	Anodyne	ADK	32	47
O=C(C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCOCC1	ZINC000872392485	GF	On-Demand	Anodyne	GRM5	17	44
O=C(C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCOCC1	ZINC000872392485	GF	On-Demand	Anodyne	SMG1	25	40
O=C1CCCCCN1CCCNc1cc(Cl)nnc1O	ZINC000872392512	CE	On-Demand	Anodyne	HRP1_PLAFA	56	40
O=C1CCCCCN1CCCNc1cc(Cl)nnc1O	ZINC000872392512	CE	On-Demand	Anodyne	HNMT	44	37
O=C1CC[C@@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)N1	ZINC000872392568	EC	On-Demand	Reactive	L3MBTL3	82	40
O=C1CC[C@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)N1	ZINC000872392569	EC	On-Demand	Reactive	L3MBTL3	82	40
CCC(=O)c1c(Cl)cccc1NCCNC(=O)C(C)C	ZINC000872392583	CG	On-Demand	Anodyne	CXCL8	48	40
CN1CCC(C=NNC(=O)c2cn[nH]c2)CC1	ZINC000872392592	BC	On-Demand	Reactive	HTR1F	62	35
O=C(C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCCCC1	ZINC000872392603	GI	On-Demand	Anodyne	GRM5	25	48
CC(=O)Nc1cccc(C=NNC(=O)[C@H]2CCC(=O)N2)c1	ZINC000872392620	CC	On-Demand	Reactive	HDAC10	27	42
CC(=O)Nc1cccc(C=NNC(=O)[C@H]2CCC(=O)N2)c1	ZINC000872392620	CC	On-Demand	Reactive	HDAC2	18	42
CC(=O)Nc1cccc(C=NNC(=O)[C@H]2CCC(=O)N2)c1	ZINC000872392620	CC	On-Demand	Reactive	HDAC3	15	41
CC(=O)Nc1cccc(C=NNC(=O)[C@H]2CCC(=O)N2)c1	ZINC000872392620	CC	On-Demand	Reactive	HDAC6	20	42
CC(=O)Nc1cccc(C=NNC(=O)[C@H]2CCC(=O)N2)c1	ZINC000872392620	CC	On-Demand	Reactive	HDAC11	39	42
CC(=O)Nc1cccc(C=NNC(=O)[C@@H]2CCC(=O)N2)c1	ZINC000872392621	CC	On-Demand	Reactive	HDAC10	27	42
CC(=O)Nc1cccc(C=NNC(=O)[C@@H]2CCC(=O)N2)c1	ZINC000872392621	CC	On-Demand	Reactive	HDAC2	18	42
CC(=O)Nc1cccc(C=NNC(=O)[C@@H]2CCC(=O)N2)c1	ZINC000872392621	CC	On-Demand	Reactive	HDAC3	15	41
CC(=O)Nc1cccc(C=NNC(=O)[C@@H]2CCC(=O)N2)c1	ZINC000872392621	CC	On-Demand	Reactive	HDAC6	20	42
CC(=O)Nc1cccc(C=NNC(=O)[C@@H]2CCC(=O)N2)c1	ZINC000872392621	CC	On-Demand	Reactive	HDAC11	39	42
COc1ccc(OC)c2sc(N3CCC(C(=O)N4CCCCC4)CC3)nc12	ZINC000872392639	GH	On-Demand	Anodyne	ADORA2B	15	41
COc1ccc(OC)c2sc(N3CCC(C(=O)N4CCCCC4)CC3)nc12	ZINC000872392639	GH	On-Demand	Anodyne	TTK	15	40
O=C(C1CCN(c2ccnc3ncccc23)CC1)N1CCOCC1	ZINC000872392653	ED	On-Demand	Anodyne	PIK3CA	17	45
O=C(C1CCN(c2ccnc3ncccc23)CC1)N1CCOCC1	ZINC000872392653	ED	On-Demand	Anodyne	MTOR	24	45
O=C(NCCNc1cc(-c2cccc(Cl)c2)ncn1)C1CC1	ZINC000872392654	DF	On-Demand	Anodyne	TYK2	51	38
O=C(NCCNc1cc(-c2cccc(Cl)c2)ncn1)C1CC1	ZINC000872392654	DF	On-Demand	Anodyne	VCP	43	44
O=C(C1CCN(c2nc(Cl)nc3sccc23)CC1)N1CCOCC1	ZINC000872392668	FE	On-Demand	Anodyne	PIK3CA	15	45
O=C1NC2(CCCC2)C(=O)N1CCCNc1ccnc2ncccc12	ZINC000872392669	EE	On-Demand	Anodyne	HRP1_PLAFA	101	36
O=C1NC2(CCCC2)C(=O)N1CCCNc1ccnc2ncccc12	ZINC000872392669	EE	On-Demand	Anodyne	HNMT	58	43
COc1ccc(OC)c2sc(NCCNC(=O)C(C)C)nc12	ZINC000872392705	DE	On-Demand	Anodyne	ADORA2B	18	44
COc1ccc(OC)c2sc(N3CCC(C(=O)N4CCOCC4)CC3)nc12	ZINC000872392738	GE	On-Demand	Anodyne	GAK	30	40
C[C@@H]1[C@H](C(=O)NN=Cc2ccc(C(=O)N3CCCC3)cc2)CCCN1C	ZINC000872392769	FE	On-Demand	Reactive	L3MBTL3	71	41
CN(C)C(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872392816	EG	On-Demand	Anodyne	GRM5	15	44
NC(=O)c1cc(N2CCN(C[C@@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872392829	EC	On-Demand	Anodyne	PDE8B	50	35
NC(=O)c1cc(N2CCN(C[C@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872392830	EC	On-Demand	Anodyne	PDE8B	50	35
COc1ccc(Cn2cc(C=NNC(=O)[C@@H]3CC[C@H](C)O3)nn2)cc1	ZINC000872392857	ED	On-Demand	Reactive	PROKR1	53	32
O=C(c1ccc(C=NN2CCOC2=O)cc1)N1CCCC1	ZINC000872392864	CD	On-Demand	Mild	MLYCD	18	41
O=C(c1ccc(C=NN2CCOC2=O)cc1)N1CCCC1	ZINC000872392864	CD	On-Demand	Mild	L3MBTL3	58	38
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccccc3)CC2)n1	ZINC000872392910	FD	On-Demand	Anodyne	DRD2	15	48
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccccc3)CC2)n1	ZINC000872392910	FD	On-Demand	Anodyne	LTA4H	61	44
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccccc3)CC2)n1	ZINC000872392910	FD	On-Demand	Anodyne	PSMB1	42	40
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	ESR1	44	36
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HTR1A	47	44
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	DRD2	43	44
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	DRD4	42	34
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HTR2A	36	44
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HTR2C	18	40
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HRH1	18	43
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	DRD3	44	44
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HTR4	15	40
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	LTA4H	58	43
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	HRH3	31	45
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	PSMB2	40	37
NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872392928	FD	On-Demand	Anodyne	PSMB1	43	40
CC(C)(C)OC(=O)NCc1cccc(C=Nn2cccn2)c1	ZINC000872392929	DF	On-Demand	Mild	PDS	50	33
Nc1nc(C(F)F)nc(N2CCN(Cc3cccc(Cl)c3)CC2)n1	ZINC000872392931	FE	On-Demand	Anodyne	DRD2	15	42
Nc1nc(C(F)F)nc(N2CCN(Cc3cccc(Cl)c3)CC2)n1	ZINC000872392931	FE	On-Demand	Anodyne	DRD4	35	42
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	PGC	55	36
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	PAPA1_CARPA	39	42
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	CCKAR	50	39
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	CTSK	27	47
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	CTSL	37	42
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	REN	66	39
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	CTSS	15	42
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	FPR1	50	39
CC(C)(C)OC(=O)N[C@H](CC=NN1CCOC1=O)Cc1ccccc1	ZINC000872392967	EF	On-Demand	Mild	CTRB_BOVIN	47	42
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	ESR1	53	37
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	LTA4H	53	52
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	HRH3	22	45
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	EPHA2	15	44
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	PSMB1	43	38
C(=Nn1cccn1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872392999	DD	On-Demand	Mild	MKNK1	22	41
CC(CCc1cccnc1)=NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000872393033	CE	On-Demand	Reactive	CHRNA7	41	33
c1ccc(CN2C[C@H]3C(=Nn4cccn4)CC[C@H]3C2)cc1	ZINC000872393034	CF	On-Demand	Mild	SIGMAR1	16	44
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccc(Cl)cc3)CC2)n1	ZINC000872393045	GE	On-Demand	Anodyne	DRD4	18	49
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccc(Cl)cc3)CC2)n1	ZINC000872393045	GE	On-Demand	Anodyne	LTA4H	48	47
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccc(Cl)cc3)CC2)n1	ZINC000872393045	GE	On-Demand	Anodyne	PSMB1	40	36
Oc1nnc(Cl)cc1N1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000872393081	FF	On-Demand	Anodyne	DRD2	28	40
Oc1nnc(Cl)cc1N1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000872393081	FF	On-Demand	Anodyne	DRD4	31	42
Oc1nnc(Cl)cc1N1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000872393081	FF	On-Demand	Anodyne	DRD3	46	37
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	HTR1A	17	44
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	DRD2	17	44
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	DRD4	16	44
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	HTR2A	15	44
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	LTA4H	52	41
Cn1ncc2c(N3CCN(CCOc4ccccc4)CC3)nc(Cl)nc21	ZINC000872393099	FE	On-Demand	Anodyne	PSMB1	41	38
O=C1OCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393165	DD	On-Demand	Mild	ESR1	40	37
O=C1OCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393165	DD	On-Demand	Mild	LTA4H	44	47
O=C1OCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393165	DD	On-Demand	Mild	HRH3	17	48
O=C1OCCN1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393165	DD	On-Demand	Mild	PSMB1	40	36
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	ESR1	77	41
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	HTR1A	22	46
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	DRD2	29	43
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	HTR2A	20	46
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	DRD3	26	46
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	ESR2	54	41
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	LTA4H	51	50
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	HRH3	25	45
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	EBP	17	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	PSMB2	40	38
Oc1nnc(Cl)cc1N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000872393167	FF	On-Demand	Anodyne	PSMB1	43	38
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	HTR1A	24	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	DRD2	26	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	DRD4	37	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	HTR2A	16	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	DRD3	21	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	LTA4H	62	46
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	HRH3	25	48
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	SIGMAR1	15	40
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	ABCC1	71	35
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	PSMB2	41	39
Cc1c(F)ncnc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393189	DE	On-Demand	Anodyne	PSMB1	44	40
O=S(=O)(c1ccc2c(c1)CCC2)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393190	GD	On-Demand	Anodyne	AKR1C3	42	34
O=S(=O)(c1ccc2c(c1)CCC2)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393190	GD	On-Demand	Anodyne	NOD2	19	43
Cc1ccccc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393274	DE	On-Demand	Anodyne	HTR1A	19	47
Cc1ccccc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393274	DE	On-Demand	Anodyne	DRD2	23	41
Cc1ccccc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393274	DE	On-Demand	Anodyne	DRD4	54	47
Cc1ccccc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393274	DE	On-Demand	Anodyne	DRD3	19	40
Cc1ccccc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872393274	DE	On-Demand	Anodyne	HTR7	18	43
COc1ccc(Cn2cc(C=NN3CCOC3=O)nn2)cc1	ZINC000872393282	DD	On-Demand	Mild	PROKR1	61	33
CC(CCc1cccnc1)=Nn1cccn1	ZINC000872393292	BE	On-Demand	Mild	TBXAS1	18	40
CC(C)c1ccc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872393315	EG	On-Demand	Anodyne	HTR1A	16	44
CC(C)c1ccc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872393315	EG	On-Demand	Anodyne	DRD2	21	44
CC(C)c1ccc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872393315	EG	On-Demand	Anodyne	DRD4	34	47
CC(C)c1ccc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872393315	EG	On-Demand	Anodyne	HSP90AA1	15	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	HTR1A	29	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	DRD2	31	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	DRD4	33	41
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	DRD3	43	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	KCNQ2	49	42
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	EPHB3	46	35
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1Cl	ZINC000872393343	GG	On-Demand	Anodyne	SLC27A1	47	43
CNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872393344	CC	On-Demand	Anodyne	HTR1A	38	40
CNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872393344	CC	On-Demand	Anodyne	DRD2	25	40
CNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872393344	CC	On-Demand	Anodyne	SLC27A1	47	38
CNC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872393351	ED	On-Demand	Anodyne	DRD4	43	34
CNC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872393351	ED	On-Demand	Anodyne	AVPR1B	42	35
CNC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872393351	ED	On-Demand	Anodyne	GRM5	15	40
CNC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872393351	ED	On-Demand	Anodyne	SLC27A1	47	33
Cc1ccccc1CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872393378	ED	On-Demand	Anodyne	DRD4	31	41
Cc1ccccc1CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872393378	ED	On-Demand	Anodyne	HTR2A	15	41
Cc1ccccc1CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872393378	ED	On-Demand	Anodyne	PIK3CD	15	44
Cc1ccccc1CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872393378	ED	On-Demand	Anodyne	PIK3CB	23	44
O=S(=O)(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCOCC1	ZINC000872393384	GE	On-Demand	Anodyne	MERTK	27	40
O=S(=O)(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCOCC1	ZINC000872393384	GE	On-Demand	Anodyne	NAMPT	63	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	HTR1A	28	51
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	DRD2	33	49
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	DRD4	61	49
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	DRD3	24	45
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	SIGMAR1	16	57
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000872393439	EF	On-Demand	Anodyne	FAAH	15	48
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	HTR1A	16	40
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	DRD2	26	41
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	DRD4	35	41
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	DRD3	46	36
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	KCNQ2	69	44
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	EPHB3	51	35
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1Cl	ZINC000872393448	GE	On-Demand	Anodyne	SLC27A1	43	42
CN(c1cccc2cc[nH]c12)S(=O)(=O)N1CCOCC1	ZINC000872393483	CD	On-Demand	Anodyne	ATR	20	42
CN(c1cccc2cc[nH]c12)S(=O)(=O)c1cc2c3c(c1)CCN3C(=O)CC2	ZINC000872393493	GF	On-Demand	Anodyne	CYP11B2	29	40
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	ESR1	70	39
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	HTR1A	60	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	DRD2	58	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	DRD1	18	45
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	DRD4	53	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	HTR2A	33	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	HRH1	20	47
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	DRD3	56	48
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	ESR2	51	39
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	LTA4H	62	45
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	HTR7	42	39
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	HRH3	24	50
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	PSMB2	41	38
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2)CC1	ZINC000872393507	EE	On-Demand	Anodyne	PSMB1	44	42
CC(CCOCc1ccccc1)=NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000872393520	DF	On-Demand	Reactive	NAAA	34	41
O=C(c1ccc(C=Nn2cccn2)cc1)N1CCCC1	ZINC000872393540	CE	On-Demand	Mild	MLYCD	18	42
O=C(c1ccc(C=Nn2cccn2)cc1)N1CCCC1	ZINC000872393540	CE	On-Demand	Mild	L3MBTL3	68	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA2	64	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA1	57	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA7	50	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA5B	49	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA4	66	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA5A	52	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA12	34	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	CA9	37	48
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	P96878_MYCTU	44	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc3c2CCCC3)c1	ZINC000872393554	FG	On-Demand	Anodyne	G2YM83_BOTF4	48	37
c1cc(CN2CCN(c3ccncc3C3CC3)CC2)ccn1	ZINC000872393570	CF	On-Demand	Anodyne	DRD4	27	48
c1cc(CN2CCN(c3ccncc3C3CC3)CC2)ccn1	ZINC000872393570	CF	On-Demand	Anodyne	SIGMAR1	19	40
Cc1c(F)ncnc1N1CCN(Cc2ccncc2)CC1	ZINC000872393572	CD	On-Demand	Anodyne	ABCC1	65	37
Cc1c(F)ncnc1N1CCN(CC(=O)NC(C)C)CC1	ZINC000872393605	CC	On-Demand	Anodyne	SLC27A1	50	33
COc1cc(C=NNC(=O)CS(C)(=O)=O)c(F)cc1Br	ZINC000872393613	FD	On-Demand	Reactive	PDE10A	17	43
COCC(COC)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872393633	EE	On-Demand	Mild	SIGMAR1	17	42
c1cnc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1	ZINC000872393652	DE	On-Demand	Anodyne	HTR1A	19	41
c1cnc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1	ZINC000872393652	DE	On-Demand	Anodyne	DRD2	23	47
c1cnc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1	ZINC000872393652	DE	On-Demand	Anodyne	DRD4	39	47
c1cnc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1	ZINC000872393652	DE	On-Demand	Anodyne	DRD3	19	47
CNC(=O)CN1CCN(c2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872393671	ED	On-Demand	Anodyne	SLC27A1	43	38
CS(=O)(=O)CC(=O)NN=C1CCCCc2ccccc2C1	ZINC000872393698	DD	On-Demand	Reactive	ABAT	18	55
CC(CCc1cccnc1)=NNC(=O)CS(C)(=O)=O	ZINC000872393701	CC	On-Demand	Reactive	TBXAS1	45	41
CC(CCc1cccnc1)=NNC(=O)CS(C)(=O)=O	ZINC000872393701	CC	On-Demand	Reactive	NAMPT	31	48
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(CO)o1	ZINC000872393707	FD	On-Demand	Reactive	LTA4H	36	45
O=C(NN=Cc1ccc(OCCN2CCOCC2)cc1)c1ccc(CO)o1	ZINC000872393707	FD	On-Demand	Reactive	EPHX2	16	43
COCC(COC)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872393728	DD	On-Demand	Mild	L3MBTL3	55	36
CNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872393734	DD	On-Demand	Anodyne	DRD2	19	40
CNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872393734	DD	On-Demand	Anodyne	PRNP	56	36
CNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872393734	DD	On-Demand	Anodyne	SLC27A1	63	38
O=C(c1ccc(C=NNC[C@@H]2COc3ccccc3O2)cc1)N1CCCC1	ZINC000872393740	FF	On-Demand	Mild	L3MBTL3	51	33
O=C(c1ccc(C=NNC[C@H]2COc3ccccc3O2)cc1)N1CCCC1	ZINC000872393741	FF	On-Demand	Mild	L3MBTL3	51	33
COc1ccc(CN(C)c2nc(Cl)nc3c2cnn3C)cc1F	ZINC000872393752	EF	On-Demand	Anodyne	Q9M629_MAIZE	52	38
O=C(NN=C1CCCCc2ccccc2C1)c1ccc(CO)o1	ZINC000872393765	DF	On-Demand	Reactive	ABAT	15	46
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(F)cc1	ZINC000872393782	FD	On-Demand	Anodyne	DRD4	25	48
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(F)cc1	ZINC000872393782	FD	On-Demand	Anodyne	NPY2R	24	44
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(F)cc1	ZINC000872393782	FD	On-Demand	Anodyne	IKBKB	45	34
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(F)cc1	ZINC000872393782	FD	On-Demand	Anodyne	IMDH_CRYPV	27	46
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(F)cc1	ZINC000872393782	FD	On-Demand	Anodyne	SLC27A1	65	45
O=C(c1ccc(C=NNCC(F)(F)C(F)(F)F)cc1)N1CCCC1	ZINC000872393792	EG	On-Demand	Mild	MLYCD	22	49
O=C(c1ccc(C=NNCC(F)(F)C(F)(F)F)cc1)N1CCCC1	ZINC000872393792	EG	On-Demand	Mild	L3MBTL3	58	37
O=c1nc(O)ccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393806	EC	On-Demand	Mild	ESR1	55	36
O=c1nc(O)ccn1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393806	EC	On-Demand	Mild	LTA4H	40	42
CS(=O)(=O)CC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872393814	EC	On-Demand	Reactive	L3MBTL3	56	36
CS(=O)(=O)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393816	FB	On-Demand	Reactive	ESR1	57	36
CS(=O)(=O)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393816	FB	On-Demand	Reactive	LTA4H	32	42
CS(=O)(=O)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393816	FB	On-Demand	Reactive	HRH3	15	43
CS(=O)(=O)CC(=O)NN=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872393816	FB	On-Demand	Reactive	EPHX2	21	45
CS(=O)(=O)CC(=O)NN=C1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000872393830	ED	On-Demand	Reactive	SIGMAR1	25	40
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000872393854	GF	On-Demand	Anodyne	TRPV1	25	42
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000872393854	GF	On-Demand	Anodyne	SLC27A1	56	37
COCC(COC)NN=Cc1ccc(C(=O)OC)c(Br)c1	ZINC000872393855	FD	On-Demand	Mild	PDE10A	18	40
COc1cncc(C=NNC[C@H]2COc3ccccc3O2)c1C	ZINC000872393873	DE	On-Demand	Mild	ADRA1B	16	46
COc1cncc(C=NNC[C@@H]2COc3ccccc3O2)c1C	ZINC000872393874	DE	On-Demand	Mild	ADRA1B	16	46
COc1ccc(OC)c2sc(NCC(=O)N(C)C)nc12	ZINC000872393879	CD	On-Demand	Anodyne	ADORA2B	19	44
Oc1nnc(Cl)cc1N1CCN(Cc2cccs2)CC1	ZINC000872393882	DE	On-Demand	Anodyne	DRD4	16	61
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872393908	FG	On-Demand	Anodyne	HTR1A	20	45
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872393908	FG	On-Demand	Anodyne	DRD2	23	45
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872393908	FG	On-Demand	Anodyne	DRD4	27	44
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872393908	FG	On-Demand	Anodyne	CACNA1G	16	40
COc1ccc(Cn2cc(C=NNCC(F)(F)C(F)(F)F)nn2)cc1	ZINC000872393909	FE	On-Demand	Mild	PROKR1	54	32
O=C(CN1CCN(c2ccnc3ncccc23)CC1)N1CCCC1	ZINC000872393972	ED	On-Demand	Anodyne	HTR1A	28	41
O=C(CN1CCN(c2ccnc3ncccc23)CC1)N1CCCC1	ZINC000872393972	ED	On-Demand	Anodyne	DRD2	15	43
CCNC(=O)CNc1nc2c(OC)ccc(OC)c2s1	ZINC000872393999	CD	On-Demand	Anodyne	ADORA2B	18	43
CCNC(=O)CNc1nc2c(OC)ccc(OC)c2s1	ZINC000872393999	CD	On-Demand	Anodyne	ENPP1	45	33
CC(CCc1c[nH]c2ccccc12)=NNC1=NCC(=O)N1	ZINC000872394003	CD	On-Demand	Mild	NMBR	40	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	ACHE	24	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	TACR1	22	40
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	MPO	41	35
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	MC5R	44	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	GHSR	40	36
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	ALOX15	15	41
CC(CCc1c[nH]c2ccccc12)=NNC(=O)CS(C)(=O)=O	ZINC000872394026	DD	On-Demand	Reactive	MMP1	16	40
Oc1nnc(Cl)cc1N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000872394055	FD	On-Demand	Anodyne	DRD4	26	42
Oc1nnc(Cl)cc1N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000872394055	FD	On-Demand	Anodyne	MCHR1	19	43
COc1cc(C=NN2CCC2)ccc1O	ZINC000872394057	BD	On-Demand	Mild	TUBB1	42	37
Nc1nc(C(F)F)nc(N2CCC(C(=O)Nc3ccccc3)CC2)n1	ZINC000872394084	EE	On-Demand	Anodyne	EPHX2	17	41
O=C(CNc1cc(-c2cccc(Cl)c2)ncn1)NC1CC1	ZINC000872394111	DE	On-Demand	Anodyne	FAAH	18	53
O=C(CNc1cc(-c2cccc(Cl)c2)ncn1)NC1CC1	ZINC000872394111	DE	On-Demand	Anodyne	VCP	29	42
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872394119	DF	On-Demand	Anodyne	TRPV1	18	50
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872394119	DF	On-Demand	Anodyne	EPHX2	24	45
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872394119	DF	On-Demand	Anodyne	LIMK2	57	67
COCC(COC)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872394127	DF	On-Demand	Mild	PDE10A	16	42
COCC(COC)NN=C(C)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000872394128	FE	On-Demand	Mild	TAAR1	15	43
Cc1c(F)ncnc1N(C)Cc1ccc2c(c1)OCO2	ZINC000872394146	CE	On-Demand	Anodyne	DYRK1A	29	44
Cc1c(F)ncnc1N(C)Cc1ccc2c(c1)OCO2	ZINC000872394146	CE	On-Demand	Anodyne	CLK1	36	45
Cc1c(F)ncnc1N(C)Cc1ccc2c(c1)OCO2	ZINC000872394146	CE	On-Demand	Anodyne	CLK2	38	45
Cc1c(F)ncnc1N(C)Cc1ccc2c(c1)OCO2	ZINC000872394146	CE	On-Demand	Anodyne	CLK4	58	45
Cc1c(F)ncnc1N(C)Cc1ccc2c(c1)OCO2	ZINC000872394146	CE	On-Demand	Anodyne	DYRK1B	24	44
CN(c1cccc2cc[nH]c12)S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2	ZINC000872394154	GG	On-Demand	Anodyne	CYP11B1	19	41
CN(c1cccc2cc[nH]c12)S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2	ZINC000872394154	GG	On-Demand	Anodyne	CYP11B2	20	41
CCN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872394156	CD	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872394164	FD	On-Demand	Anodyne	MERTK	31	47
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000872394164	FD	On-Demand	Anodyne	NAMPT	39	45
CC(=NN1CCC1)c1cccc(C)c1	ZINC000872394201	AE	On-Demand	Mild	KCNK3	50	37
CC(=NN1CCC1)c1cccc(C)c1	ZINC000872394201	AE	On-Demand	Mild	KCNK9	41	37
Oc1nnc(Cl)cc1NCCCN1CCCCC1	ZINC000872394223	CE	On-Demand	Anodyne	HRP1_PLAFA	87	39
Oc1nnc(Cl)cc1NCCCN1CCCCC1	ZINC000872394223	CE	On-Demand	Anodyne	HRH3	15	52
Oc1nnc(Cl)cc1NCCCN1CCCCC1	ZINC000872394223	CE	On-Demand	Anodyne	HNMT	95	52
Oc1nnc(Cl)cc1NCCCN1CCCC1	ZINC000872394233	CD	On-Demand	Anodyne	HRP1_PLAFA	88	40
Oc1nnc(Cl)cc1NCCCN1CCCC1	ZINC000872394233	CD	On-Demand	Anodyne	HNMT	89	50
O=C1Nc2ccccc2C1=NN1CCC1	ZINC000872394272	BD	On-Demand	Mild	GALR3	16	49
CC(CCc1cccnc1)=NNC[C@H]1COc2ccccc2O1	ZINC000872394293	DF	On-Demand	Mild	ADRA2B	15	40
CC(CCc1cccnc1)=NNC[C@@H]1COc2ccccc2O1	ZINC000872394295	DF	On-Demand	Mild	ADRA2B	15	40
COc1ccc(OC)c2sc(NCCCN3CCN(C)CC3)nc12	ZINC000872394298	FE	On-Demand	Anodyne	HTR1A	42	43
COc1ccc(OC)c2sc(NCCCN3CCN(C)CC3)nc12	ZINC000872394298	FE	On-Demand	Anodyne	DRD2	32	42
COc1ccc(OC)c2sc(NCCCN3CCN(C)CC3)nc12	ZINC000872394298	FE	On-Demand	Anodyne	ADRA1A	32	42
COc1ccc(OC)c2sc(NCCCN3CCN(C)CC3)nc12	ZINC000872394298	FE	On-Demand	Anodyne	DRD3	42	40
C(=NN1CCC1)c1cccnc1	ZINC000872394300	AD	On-Demand	Mild	CYP11B2	15	43
c1cnc2nccc(NCc3nnc4n3CCCCC4)c2c1	ZINC000872394330	CF	On-Demand	Anodyne	HNMT	56	40
O=C(c1ccc(C=Nn2ccc(O)nc2=O)cc1)N1CCCC1	ZINC000872394370	DD	On-Demand	Mild	L3MBTL3	46	36
CCOc1cc(C=NN2CCC2)ccc1OC	ZINC000872394400	BE	On-Demand	Mild	TUBB1	17	41
NC(=O)c1cc(NCCCN2CCCC2)nc(Cl)n1	ZINC000872394411	CD	On-Demand	Anodyne	HNMT	58	38
CCOc1ccccc1C=NN1CCC1	ZINC000872394465	BE	On-Demand	Mild	HCN1	50	34
CCOc1ccccc1C=NN1CCC1	ZINC000872394465	BE	On-Demand	Mild	HCN4	42	33
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)NC1CC1	ZINC000872394468	ED	On-Demand	Anodyne	DRD2	16	43
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)NC1CC1	ZINC000872394468	ED	On-Demand	Anodyne	DRD4	29	43
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)NC1CC1	ZINC000872394468	ED	On-Demand	Anodyne	SIGMAR1	15	41
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)NC1CC1	ZINC000872394468	ED	On-Demand	Anodyne	SLC27A1	50	36
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000872394500	ED	On-Demand	Anodyne	DRD4	17	52
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000872394500	ED	On-Demand	Anodyne	PDGFRB	52	39
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000872394500	ED	On-Demand	Anodyne	PRNP	47	37
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000872394500	ED	On-Demand	Anodyne	LIMK2	46	35
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000872394500	ED	On-Demand	Anodyne	SLC27A1	71	48
Oc1nnc(Cl)cc1N1CCN(Cc2ccncc2)CC1	ZINC000872394525	DD	On-Demand	Anodyne	DRD4	33	42
COc1cccc(C(C)=NN2CCC2)c1	ZINC000872394526	BE	On-Demand	Mild	DRD4	47	36
COc1cccc(C(C)=NN2CCC2)c1	ZINC000872394526	BE	On-Demand	Mild	MTNR1A	18	41
COc1cccc(C(C)=NN2CCC2)c1	ZINC000872394526	BE	On-Demand	Mild	MTNR1B	21	41
CC(=O)Nc1cccc(C(C)=NN2CCC2)c1	ZINC000872394540	BE	On-Demand	Mild	TAAR1	34	41
CC(=O)Nc1cccc(C(C)=NN2CCC2)c1	ZINC000872394540	BE	On-Demand	Mild	AKR1C3	25	45
CC(=O)Nc1cccc(C(C)=NN2CCC2)c1	ZINC000872394540	BE	On-Demand	Mild	KCNK3	109	39
CC(=O)Nc1cccc(C(C)=NN2CCC2)c1	ZINC000872394540	BE	On-Demand	Mild	KCNK9	69	39
c1csc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872394546	DG	On-Demand	Anodyne	DRD4	21	55
CNC(=O)CN1CCN(c2nc3c(OC)ccc(OC)c3s2)CC1	ZINC000872394556	FD	On-Demand	Anodyne	SLC27A1	42	38
Oc1nnc(Cl)cc1NCCN1CCCC1	ZINC000872394561	BD	On-Demand	Anodyne	HNMT	70	43
COCC(COC)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872394583	DF	On-Demand	Mild	TACR1	20	42
COCC(COC)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872394583	DF	On-Demand	Mild	MPO	16	42
COc1cc(C=NN2CCC2)cc(OC)c1OC	ZINC000872394589	CD	On-Demand	Mild	TUBB1	39	40
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCCC1	ZINC000872394596	FD	On-Demand	Anodyne	CPT1A	50	38
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCCC1	ZINC000872394596	FD	On-Demand	Anodyne	SLC27A1	50	35
COCC(COC)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872394600	EC	On-Demand	Mild	PROKR1	55	33
O=C(O)COc1ccccc1C=NN1CCC1	ZINC000872394604	BD	On-Demand	Mild	PTGIR	49	37
O=C(O)COc1ccccc1C=NN1CCC1	ZINC000872394604	BD	On-Demand	Mild	PLA2G1B	89	38
O=C(O)COc1ccccc1C=NN1CCC1	ZINC000872394604	BD	On-Demand	Mild	PLA2G2A	64	33
O=C(O)COc1ccccc1C=NN1CCC1	ZINC000872394604	BD	On-Demand	Mild	PTGDR2	20	46
CCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872394613	CG	On-Demand	Anodyne	SSTR5	48	36
CCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872394613	CG	On-Demand	Anodyne	PRKD1	43	33
CCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872394613	CG	On-Demand	Anodyne	PKNB	15	40
O=C(Nc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394617	EF	On-Demand	Anodyne	NPY2R	38	45
O=C(Nc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394617	EF	On-Demand	Anodyne	EPHX2	19	43
COc1ccc(C)cc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394622	EE	On-Demand	Anodyne	DRD2	24	43
COc1ccc(C)cc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394622	EE	On-Demand	Anodyne	DRD4	30	43
COc1ccc(C)cc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394622	EE	On-Demand	Anodyne	DRD3	23	42
COc1ccc(C)cc1CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394622	EE	On-Demand	Anodyne	HTR7	21	41
c1cnc2nccc(NCCCN3CCCCC3)c2c1	ZINC000872394628	CF	On-Demand	Anodyne	ADRA1A	16	43
c1cnc2nccc(NCCCN3CCCCC3)c2c1	ZINC000872394628	CF	On-Demand	Anodyne	HRP1_PLAFA	111	45
c1cnc2nccc(NCCCN3CCCCC3)c2c1	ZINC000872394628	CF	On-Demand	Anodyne	HRH3	42	73
c1cnc2nccc(NCCCN3CCCCC3)c2c1	ZINC000872394628	CF	On-Demand	Anodyne	HNMT	152	73
COc1ccc(C)cc1CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872394636	GD	On-Demand	Anodyne	SLC9A1	51	32
COc1cc(C=NN2CCC2)ccc1OCc1ccccc1	ZINC000872394639	CG	On-Demand	Mild	CYP1A1	15	40
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	LTA4H	17	42
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	HRH3	24	44
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	SIGMAR1	17	50
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	HNMT	97	44
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	RPS6KB1	43	35
c1ccc(-c2cc(NCCN3CCCC3)ncn2)cc1	ZINC000872394640	CF	On-Demand	Anodyne	TNK2	26	41
Cc1c(F)ncnc1N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000872394642	EE	On-Demand	Anodyne	ABCC1	62	34
CCNC(=O)CN(CC)c1nc2c(OC)ccc(OC)c2s1	ZINC000872394656	DE	On-Demand	Anodyne	ADORA2B	17	41
CS(=O)(=O)CC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872394702	DD	On-Demand	Reactive	PTPRB	42	34
NS(=O)(=O)c1cccc(C=NNCC(F)(F)C(F)(F)F)c1	ZINC000872394706	ED	On-Demand	Mild	CA2	19	41
NS(=O)(=O)c1cccc(C=NNCC(F)(F)C(F)(F)F)c1	ZINC000872394706	ED	On-Demand	Mild	CA4	19	40
CC(=NN1CCC1)c1cc(Br)ccc1O	ZINC000872394741	CF	On-Demand	Mild	PYK	82	39
CCCCNC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394750	EC	On-Demand	Anodyne	DRD2	20	42
CCCCNC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872394750	EC	On-Demand	Anodyne	DRD3	41	35
O=C(NCc1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394753	EG	On-Demand	Anodyne	EPHX2	24	52
O=C(NCc1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394753	EG	On-Demand	Anodyne	SCD	26	40
O=C(NCc1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394753	EG	On-Demand	Anodyne	NAMPT	41	37
CC(=NN1CCC1)c1cccc([N+](=O)[O-])c1	ZINC000872394779	BE	On-Demand	Mild	IRAK4	15	40
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CC2)CC1	ZINC000872394784	CC	On-Demand	Anodyne	SIRT3	68	34
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CC2)CC1	ZINC000872394784	CC	On-Demand	Anodyne	SIRT2	51	33
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CC2)CC1	ZINC000872394784	CC	On-Demand	Anodyne	SIRT1	40	33
Nc1nc(NCCc2cccc(F)c2)nc(C(F)F)n1	ZINC000872394806	CE	On-Demand	Anodyne	NOS1	20	45
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2Cl)CC1	ZINC000872394809	FE	On-Demand	Anodyne	DRD4	20	43
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2Cl)CC1	ZINC000872394809	FE	On-Demand	Anodyne	EPHB3	50	34
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2Cl)CC1	ZINC000872394809	FE	On-Demand	Anodyne	SLC27A1	57	38
O=C(Nc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872394879	DH	On-Demand	Anodyne	NPY2R	28	41
O=C(Nc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872394879	DH	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccccc1)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872394882	GH	On-Demand	Anodyne	EPHX2	17	48
Cn1ncc2c(N3CCC(C(=O)NCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872394903	GF	On-Demand	Anodyne	EPHX2	17	49
O=C(Nc1cccc2c1CCCC2)c1cc(S(=O)(=O)NC2CC2)ccc1Br	ZINC000872394921	II	On-Demand	Anodyne	CCR8	74	36
O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394934	GG	On-Demand	Anodyne	NOS2	90	35
O=C(Nc1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394957	EG	On-Demand	Anodyne	HTR1B	15	41
O=C(Nc1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872394957	EG	On-Demand	Anodyne	EPHX2	16	41
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	DYRK1A	41	44
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	CLK1	55	44
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	CLK2	47	44
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	CLK3	29	41
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	CLK4	74	44
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	DYRK2	40	32
Cc1c(F)ncnc1NCCc1ccc2c(c1)OCO2	ZINC000872394981	CE	On-Demand	Anodyne	DYRK1B	34	44
c1ccc(C2CCC(=NN3CCC3)CC2)cc1	ZINC000872394989	BG	On-Demand	Mild	SLC18A3	41	49
Nc1nc(NCCCN2CCCCC2)nc(C(F)F)n1	ZINC000872394990	CD	On-Demand	Anodyne	HNMT	75	38
COc1cc(Br)ccc1NS(=O)(=O)N1CCC1	ZINC000872395010	DD	On-Demand	Anodyne	HTR6	15	46
CC(=NN1CCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872395015	DE	On-Demand	Mild	PKM	20	40
CC(=NN1CCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000872395015	DE	On-Demand	Mild	F13A1	27	42
O=C1Nc2ccc([N+](=O)[O-])cc2C1=NN1CCC1	ZINC000872395017	BC	On-Demand	Mild	SNCA	48	35
COc1ccc(OC)c2sc(NCC(=O)NC3CC3)nc12	ZINC000872395018	DE	On-Demand	Anodyne	ADORA2B	18	42
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CC1	ZINC000872395023	DD	On-Demand	Anodyne	HTR1A	27	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CC1	ZINC000872395023	DD	On-Demand	Anodyne	DRD2	24	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CC1	ZINC000872395023	DD	On-Demand	Anodyne	DRD4	24	42
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CC1	ZINC000872395023	DD	On-Demand	Anodyne	SLC27A1	43	37
O=C(NCc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872395024	EE	On-Demand	Anodyne	PLG	57	33
O=C(NCc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872395024	EE	On-Demand	Anodyne	KLKB1	47	33
O=C(NCc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872395024	EE	On-Demand	Anodyne	TRYP_PIG	46	31
O=C(NCc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872395024	EE	On-Demand	Anodyne	EPHX2	23	52
O=C(NCc1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872395024	EE	On-Demand	Anodyne	TMPRSS11D	59	33
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	PLG	58	34
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	TRYP_PIG	46	31
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	PREP	17	41
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	EPHX2	18	51
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	TBK1	48	33
O=C(NCc1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395033	EG	On-Demand	Anodyne	NAMPT	98	38
CCC(=O)c1c(Cl)cccc1NC1CCN(C)CC1	ZINC000872395120	CG	On-Demand	Anodyne	HTR1F	42	37
NC(=O)c1cc(NCc2ccccc2CN2CCOCC2)nc(Cl)n1	ZINC000872395122	FD	On-Demand	Anodyne	STAT6	59	42
CCOc1ccc(C=NN2CCC2)cc1OC	ZINC000872395131	BE	On-Demand	Mild	TUBB1	17	41
CC(=NN1CCC1)c1ccc(-n2ccnc2)cc1	ZINC000872395144	BE	On-Demand	Mild	CYP2C19	16	40
CCOc1ccc(C=NN2CCC2)cc1	ZINC000872395164	BE	On-Demand	Mild	CACNA2D2	41	34
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000872395178	FF	On-Demand	Anodyne	LIMK2	50	51
NC(=O)c1cc(NCCCN2CCCCC2)nc(Cl)n1	ZINC000872395182	CD	On-Demand	Anodyne	HNMT	66	40
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872395194	CD	On-Demand	Anodyne	ADK	23	46
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872395194	CD	On-Demand	Anodyne	FAAH	22	44
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872395194	CD	On-Demand	Anodyne	TNKS	40	32
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872395194	CD	On-Demand	Anodyne	VCP	63	39
Cc1c(F)ncnc1NCCCN1CCCCC1	ZINC000872395198	CE	On-Demand	Anodyne	HRH3	30	45
Cc1c(F)ncnc1NCCCN1CCCCC1	ZINC000872395198	CE	On-Demand	Anodyne	HNMT	95	45
Cc1c(F)ncnc1NCCCN1CCCCC1	ZINC000872395198	CE	On-Demand	Anodyne	RPS6KB1	40	31
O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872395214	FH	On-Demand	Anodyne	NOS2	51	33
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA2	76	51
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA6	19	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA1	56	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA7	52	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA4	39	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA14	38	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA12	48	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA9	52	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CYNT	40	40
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	NCE103	23	49
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	CA15	25	41
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	MTCA1	32	42
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	P96878_MYCTU	40	42
CC(=NN1CCC1)c1ccc(S(N)(=O)=O)cc1	ZINC000872395229	CC	On-Demand	Mild	A6YCJ1_9METZ	28	41
CCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872395235	CD	On-Demand	Anodyne	SSTR5	52	37
Oc1nnc(Cl)cc1NCc1ccc(CN2CCCC2)cc1	ZINC000872395236	DG	On-Demand	Anodyne	HRH3	18	40
NC(=O)c1cc(N2CCN(Cc3ccc4c(c3)OCCO4)CC2)nc(Cl)n1	ZINC000872395237	GD	On-Demand	Anodyne	MCHR1	21	41
Cn1ncc2c(N3CCC(C(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872395242	FF	On-Demand	Anodyne	PIK3CA	26	42
Cn1ncc2c(N3CCC(C(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872395242	FF	On-Demand	Anodyne	MTOR	67	40
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	EPHX2	22	54
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	CACNA1G	55	42
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	SIRT3	55	33
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	SIRT2	50	31
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	SIRT1	49	30
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872395245	EE	On-Demand	Anodyne	LIMK2	33	51
Nc1nc(C(F)F)nc(N2CCC(C(=O)NCc3ccccc3)CC2)n1	ZINC000872395248	FD	On-Demand	Anodyne	EPHX2	17	58
Nc1nc(C(F)F)nc(N2CCC(C(=O)NCc3ccccc3)CC2)n1	ZINC000872395248	FD	On-Demand	Anodyne	TMPRSS11D	61	34
COc1cccc(C=NN2CCC2)c1	ZINC000872395250	AD	On-Demand	Mild	CYP1B1	24	41
COc1cccc(C=NN2CCC2)c1	ZINC000872395250	AD	On-Demand	Mild	G6PC	15	46
COc1cccc(C=NN2CCC2)c1	ZINC000872395250	AD	On-Demand	Mild	AHR	15	43
COc1cccc(C=NN2CCC2)c1	ZINC000872395250	AD	On-Demand	Mild	CYP1A1	21	41
COc1ccc(OC)c2sc(NC3CCN(C)CC3)nc12	ZINC000872395254	DF	On-Demand	Anodyne	ADORA2B	15	42
COc1ccc(OC)c2sc(NC3CCN(C)CC3)nc12	ZINC000872395254	DF	On-Demand	Anodyne	SSTR5	28	43
COc1ccc(OC)c2sc(NC3CCN(C)CC3)nc12	ZINC000872395254	DF	On-Demand	Anodyne	EHMT2	34	43
CCC(=O)c1c(Cl)cccc1NCC(=O)NC(C)C	ZINC000872395308	CF	On-Demand	Anodyne	CXCL8	40	35
Cc1c(F)ncnc1NCc1ccc(CN2CCOCC2)cc1	ZINC000872395310	DE	On-Demand	Anodyne	EGFR	17	43
Oc1nnc(Cl)cc1NCc1ccccc1CN1CCOCC1	ZINC000872395332	EE	On-Demand	Anodyne	STAT6	40	37
COc1ccc(OC)c2sc(NC3CCN(C(C)=O)CC3)nc12	ZINC000872395363	EF	On-Demand	Anodyne	ADORA2B	20	44
COc1ccc(OC)c2sc(NC3CCN(C(C)=O)CC3)nc12	ZINC000872395363	EF	On-Demand	Anodyne	SSTR5	27	40
Nc1nc(C(F)F)nc(N2CCN(Cc3cccc4ccccc34)CC2)n1	ZINC000872395366	FF	On-Demand	Anodyne	DRD4	23	46
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3ccccc23)CC1	ZINC000872395417	FG	On-Demand	Anodyne	HTR1A	25	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3ccccc23)CC1	ZINC000872395417	FG	On-Demand	Anodyne	DRD2	28	59
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3ccccc23)CC1	ZINC000872395417	FG	On-Demand	Anodyne	DRD4	49	59
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3ccccc23)CC1	ZINC000872395417	FG	On-Demand	Anodyne	DRD3	29	59
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3ccccc23)CC1	ZINC000872395417	FG	On-Demand	Anodyne	HTR7	23	48
NC(=O)c1cc(NCc2ccc(CN3CCOCC3)cc2)nc(Cl)n1	ZINC000872395428	FD	On-Demand	Anodyne	DPOL_VZVD	23	41
NC(=O)c1cc(NCc2ccc(CN3CCOCC3)cc2)nc(Cl)n1	ZINC000872395428	FD	On-Demand	Anodyne	STAT6	64	38
C[C@H]1CCCCN1CCCNc1cc(C(N)=O)nc(Cl)n1	ZINC000872395434	DD	On-Demand	Anodyne	HRH3	40	35
C[C@@H]1CCCCN1CCCNc1cc(C(N)=O)nc(Cl)n1	ZINC000872395435	DD	On-Demand	Anodyne	HRH3	40	35
CCC(=O)c1c(Cl)cccc1NC1CCN(C(C)=O)CC1	ZINC000872395468	DG	On-Demand	Anodyne	EPHX2	27	41
Cc1c(F)ncnc1NCc1ccccc1CN1CCOCC1	ZINC000872395489	DE	On-Demand	Anodyne	STAT6	44	36
COc1ccc(OC)c2sc(NCC(=O)NC(C)C)nc12	ZINC000872395510	DE	On-Demand	Anodyne	ADORA2B	17	44
COc1ccc(OC)c2sc(NCC(=O)NC(C)C)nc12	ZINC000872395510	DE	On-Demand	Anodyne	ENPP1	40	32
Nc1nc(NCc2ccccc2CN2CCOCC2)nc(C(F)F)n1	ZINC000872395559	FD	On-Demand	Anodyne	STAT6	48	35
CN(CC(=O)NC1CC1)c1cc(-c2ccccc2)ncn1	ZINC000872395574	CD	On-Demand	Anodyne	FASN	28	40
O=S(=O)(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCCC1	ZINC000872395656	GF	On-Demand	Anodyne	NAMPT	44	46
COc1ccc(OC)c([C@H](C)Nc2nc(N)nc(C(F)F)n2)c1	ZINC000872395663	EF	On-Demand	Anodyne	DHFR	15	43
COc1ccc(OC)c([C@H](C)Nc2nc(N)nc(C(F)F)n2)c1	ZINC000872395663	EF	On-Demand	Anodyne	DFR1	17	43
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000872395725	FD	On-Demand	Mild	PKM	19	45
Cc1c(F)ncnc1N1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000872395725	FD	On-Demand	Mild	GCK	41	34
O=C(O)COc1ccc(Br)cc1C=NN1CCC1	ZINC000872395743	DD	On-Demand	Mild	PTGDR2	23	60
CC(=NN1CCC1)c1ccccc1[N+](=O)[O-]	ZINC000872395809	BE	On-Demand	Mild	COLA	43	30
C[C@@H](OCCCNc1cc(C(N)=O)nc(Cl)n1)c1ccccc1	ZINC000872395814	EF	On-Demand	Anodyne	C3AR1	42	30
CCCn1c(C=NN2CCC2)nc2ccccc21	ZINC000872395826	BE	On-Demand	Mild	HRH1	22	42
Cc1c(F)ncnc1NCCCOC[C@H]1CCCO1	ZINC000872395889	CD	On-Demand	Anodyne	TNK2	53	35
Cc1c(F)ncnc1NCCCOC[C@@H]1CCCO1	ZINC000872395890	CD	On-Demand	Anodyne	TNK2	53	35
COc1ccc2cc(C=NN3CCC3)ccc2c1	ZINC000872395896	BF	On-Demand	Mild	CYP1B1	37	41
COc1ccc2cc(C=NN3CCC3)ccc2c1	ZINC000872395896	BF	On-Demand	Mild	AHR	35	41
COc1ccc2cc(C=NN3CCC3)ccc2c1	ZINC000872395896	BF	On-Demand	Mild	CYP1A1	33	41
c1cnc2nccc(NCCCOC[C@H]3CCCO3)c2c1	ZINC000872395904	CF	On-Demand	Anodyne	HNMT	50	36
c1cnc2nccc(NCCCOC[C@@H]3CCCO3)c2c1	ZINC000872395905	CF	On-Demand	Anodyne	HNMT	50	36
CC(=NN1CCC1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000872395911	CD	On-Demand	Mild	AKR1C3	47	36
CC(=NN1CCC1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000872395947	FD	On-Demand	Mild	EPHX2	30	51
CC(=NN1CCC1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000872395947	FD	On-Demand	Mild	TGM2	49	38
COCCOc1ccc(C(C)=NN2CCC2)cc1OC	ZINC000872395951	CE	On-Demand	Mild	ACKR3	41	34
Cn1ncc2c(N[C@@H](CN3CCOCC3)c3ccccc3)nc(Cl)nc21	ZINC000872395958	FF	On-Demand	Anodyne	ABL1	28	45
Cn1ncc2c(N[C@H](CN3CCOCC3)c3ccccc3)nc(Cl)nc21	ZINC000872395959	FF	On-Demand	Anodyne	ABL1	28	45
c1ccc2c(c1)CCC(=NN1CCC1)C2	ZINC000872395971	BE	On-Demand	Mild	DRD1	15	42
c1ccc2c(c1)CCC(=NN1CCC1)C2	ZINC000872395971	BE	On-Demand	Mild	DRD5	41	42
C[C@@H](OCCCNc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872395974	DF	On-Demand	Anodyne	HTR7	15	49
CC(=NN1CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000872395980	CC	On-Demand	Mild	CA2	22	44
CC(=NN1CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000872395980	CC	On-Demand	Mild	CA1	18	44
CC(=NN1CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000872395980	CC	On-Demand	Mild	CAH_METTE	21	40
CC(=NN1CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000872395980	CC	On-Demand	Mild	AKR1C3	50	36
CC(=NN1CCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000872395998	CD	On-Demand	Mild	PTGS2	31	43
CC(=NN1CCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000872395998	CD	On-Demand	Mild	LOX1.1	44	36
CC(=NN1CCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000872395998	CD	On-Demand	Mild	O49150_SOLTU	53	36
c1ccc(-c2cc(NCCCOC[C@@H]3CCCO3)ncn2)cc1	ZINC000872396010	DG	On-Demand	Anodyne	TNK2	62	41
c1ccc(-c2cc(NCCCOC[C@H]3CCCO3)ncn2)cc1	ZINC000872396011	DG	On-Demand	Anodyne	TNK2	62	41
Nc1nc(NCc2ccc(CN3CCCCC3)cc2)nc(C(F)F)n1	ZINC000872396012	EF	On-Demand	Anodyne	HRH3	16	44
CC(=NN1CCC1)c1nc2ccccc2s1	ZINC000872396014	BF	On-Demand	Mild	TPSAB1	17	40
CC(=NN1CCC1)c1nc2ccccc2s1	ZINC000872396014	BF	On-Demand	Mild	TMPRSS6	48	31
CC(=NN1CCC1)c1ccc2c(c1)NC(=O)CO2	ZINC000872396038	BD	On-Demand	Mild	NR3C2	29	42
Nc1nc(NC2CCN(Cc3ccc(Cl)cc3)CC2)nc(C(F)F)n1	ZINC000872396047	FG	On-Demand	Anodyne	DRD4	22	41
Nc1nc(NC2CCN(Cc3ccc(Cl)cc3)CC2)nc(C(F)F)n1	ZINC000872396047	FG	On-Demand	Anodyne	SIGMAR1	19	42
Nc1nc(NC2CCN(Cc3ccc(Cl)cc3)CC2)nc(C(F)F)n1	ZINC000872396047	FG	On-Demand	Anodyne	SSTR5	51	41
Nc1nc(NC2CCN(Cc3ccc(Cl)cc3)CC2)nc(C(F)F)n1	ZINC000872396047	FG	On-Demand	Anodyne	MCHR1	25	46
COc1cc(C=NN2CCC2)ccc1OC(C)=O	ZINC000872396057	BD	On-Demand	Mild	TUBB1	45	33
CC(=NN1CCC1)c1ccc(OCC(=O)N2CCCC2)cc1	ZINC000872396097	DE	On-Demand	Mild	CPT1A	55	37
COCCOc1ccc(C(C)=NN2CCC2)cc1	ZINC000872396120	BE	On-Demand	Mild	HRH3	22	42
COCCOc1ccc(C(C)=NN2CCC2)cc1	ZINC000872396120	BE	On-Demand	Mild	PSMB2	40	38
COCCOc1ccc(C(C)=NN2CCC2)cc1	ZINC000872396120	BE	On-Demand	Mild	PSMB1	43	38
c1ccc(CN2CCC(=NN3CCC3)C2)cc1	ZINC000872396128	BD	On-Demand	Mild	DRD4	15	40
c1ccc(CN2CCC(=NN3CCC3)C2)cc1	ZINC000872396128	BD	On-Demand	Mild	SIGMAR1	48	47
Oc1nnc(Cl)cc1NCc1ccc(CN2CCCCC2)cc1	ZINC000872396133	EG	On-Demand	Anodyne	HRH3	21	43
CC(=NN1CCC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872396148	CE	On-Demand	Mild	EPHX2	64	49
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	ESR1	78	38
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	KCNH2	16	41
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	ESR2	55	40
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	LTA4H	66	52
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	HRH3	67	52
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	PSMB2	54	54
C(=NN1CCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000872396152	CE	On-Demand	Mild	PSMB1	59	54
COc1cc(C=NN2CCC2)cc(OC)c1OCc1ccccc1	ZINC000872396180	EG	On-Demand	Mild	ADCYAP1R1	30	47
NC(=O)c1cc(N[C@@H](CN2CCOCC2)c2ccccc2)nc(Cl)n1	ZINC000872396211	FD	On-Demand	Anodyne	CASR	55	43
NC(=O)c1cc(N[C@H](CN2CCOCC2)c2ccccc2)nc(Cl)n1	ZINC000872396212	FD	On-Demand	Anodyne	CASR	55	43
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872396214	FH	On-Demand	Anodyne	DRD4	43	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872396214	FH	On-Demand	Anodyne	SIGMAR1	25	47
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872396214	FH	On-Demand	Anodyne	SSTR5	75	42
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872396214	FH	On-Demand	Anodyne	CXCR3	36	46
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000872396214	FH	On-Demand	Anodyne	MCHR1	39	51
CCOc1cc(C=NN2CCC2)ccc1OCC(=O)Nc1ccccc1	ZINC000872396219	FG	On-Demand	Mild	HCN1	49	33
CCOc1cc(C=NN2CCC2)ccc1OCC(=O)Nc1ccccc1	ZINC000872396219	FG	On-Demand	Mild	HCN4	41	32
Fc1ccc2c(C=NN3CCC3)c[nH]c2c1	ZINC000872396221	BE	On-Demand	Mild	MPO	70	39
COc1cc(C=NN2CCC2)cc(OC)c1	ZINC000872396226	BD	On-Demand	Mild	CYP1A1	15	45
COc1ccc(OCCNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872396229	DD	On-Demand	Anodyne	HTR7	15	55
c1ccc(N2CCC(=NN3CCC3)CC2)nc1	ZINC000872396253	BD	On-Demand	Mild	EBP	27	43
CC(=NN1CCC1)c1ccc(-n2cccn2)cc1	ZINC000872396264	BE	On-Demand	Mild	AMP1_PLAFQ	53	37
O=C(O)COc1ccc(C=NN2CCC2)cc1	ZINC000872396267	BD	On-Demand	Mild	PLA2G4B	50	33
COc1ccc2[nH]cc(C=NN3CCC3)c2c1	ZINC000872396303	BE	On-Demand	Mild	HTR1E	15	42
O=C(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCCC1	ZINC000872396324	EG	On-Demand	Anodyne	DPP7	45	38
O=C(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCCC1	ZINC000872396324	EG	On-Demand	Anodyne	L3MBTL3	58	42
CC(C)(C)OC(=O)N1CCC(C=NN2CCC2)CC1	ZINC000872396333	CE	On-Demand	Mild	GPR119	32	41
O=S(=O)(c1ccc(F)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872396403	GD	On-Demand	Anodyne	HSD11B1	16	47
O=S(=O)(c1ccc(F)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872396403	GD	On-Demand	Anodyne	PKM	34	41
O=S(=O)(c1ccc(F)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872396403	GD	On-Demand	Anodyne	GCK	40	33
c1cnc2nccc(N3CCN(Cc4cn5ccccc5n4)CC3)c2c1	ZINC000872396406	EF	On-Demand	Anodyne	DRD4	34	58
CC(CCCOc1ccccc1C(N)=O)=NN1CCC1	ZINC000872396420	CE	On-Demand	Mild	ABCB1	19	41
CC(CCCOc1ccccc1C(N)=O)=NN1CCC1	ZINC000872396420	CE	On-Demand	Mild	HCN1	52	33
CC(CCCOc1ccccc1C(N)=O)=NN1CCC1	ZINC000872396420	CE	On-Demand	Mild	HCN4	41	33
CN(Cc1ccc(N2CCOCC2)cc1)c1ccnc2ncccc12	ZINC000872396444	EG	On-Demand	Clean	EPHB4	78	36
NC(=O)c1cc(N2CCN(Cc3cn4ccccc4n3)CC2)nc(Cl)n1	ZINC000872396449	FD	On-Demand	Anodyne	DRD4	17	58
CN(Cc1ccc(N2CCOCC2)cc1)c1cc(Cl)nnc1O	ZINC000872396454	EE	On-Demand	Clean	EPHB4	52	34
COc1ccc(OC)c2sc(N(C)CC(=O)N3CCCC3)nc12	ZINC000872396471	EE	On-Demand	Anodyne	ADORA2B	17	44
CC(=NN1CCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872396508	DD	On-Demand	Mild	PKM	42	40
CC(=NN1CCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000872396508	DD	On-Demand	Mild	AKR1C3	64	46
CN(Cc1ccc(N2CCOCC2)cc1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872396514	FD	On-Demand	Clean	EPHB4	64	34
CN(Cc1ccc(N2CCOCC2)cc1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872396514	FD	On-Demand	Clean	STAT6	57	36
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000872396539	FG	On-Demand	Anodyne	DRD4	29	46
c1ccc(CN2[C@H]3CC[C@@H]2CC(=NN2CCC2)C3)cc1	ZINC000872396554	CF	On-Demand	Mild	SIGMAR1	32	50
c1ccc(CN2[C@H]3CC[C@H]2CC(=NN2CCC2)C3)cc1	ZINC000872396555	CF	On-Demand	Mild	SIGMAR1	32	50
COc1ccc(OC)c2sc(N[C@@H](C)C(N)=O)nc12	ZINC000872396569	CD	On-Demand	Anodyne	ADORA2B	17	45
COc1ccc(OC)c2sc(N[C@H](C)C(N)=O)nc12	ZINC000872396570	CD	On-Demand	Anodyne	ADORA2B	17	45
Nc1nc(C(F)F)nc(N2CCN(Cc3ccco3)CC2)n1	ZINC000872396578	DD	On-Demand	Anodyne	ADORA2A	17	53
C(=NN1CCC1)c1ccc(OCC2CC2)cc1	ZINC000872396592	BF	On-Demand	Mild	HPGD	18	43
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	CELA1	19	45
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	GRIN2B	38	50
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	PREP	43	47
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	LGMN	50	39
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	TGM2	39	45
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	F13A1	45	45
O=C(OCc1ccccc1)N1CCC(C=NN2CCC2)CC1	ZINC000872396598	DF	On-Demand	Mild	SLC12A5	74	42
O=C(O)COc1cccc(C=NN2CCC2)c1	ZINC000872396619	BD	On-Demand	Mild	FABP4	47	35
O=C(O)COc1cccc(C=NN2CCC2)c1	ZINC000872396619	BD	On-Demand	Mild	CPT1A	48	38
c1ccc(-c2cc(Sc3nnnn3C[C@H]3CCCO3)ncn2)cc1	ZINC000872396620	EE	On-Demand	Anodyne	TNK2	50	36
c1ccc(-c2cc(Sc3nnnn3C[C@H]3CCCO3)ncn2)cc1	ZINC000872396620	EE	On-Demand	Anodyne	PDE8B	35	41
c1ccc(-c2cc(Sc3nnnn3C[C@@H]3CCCO3)ncn2)cc1	ZINC000872396621	EE	On-Demand	Anodyne	TNK2	50	36
c1ccc(-c2cc(Sc3nnnn3C[C@@H]3CCCO3)ncn2)cc1	ZINC000872396621	EE	On-Demand	Anodyne	PDE8B	35	41
Nc1nc(NCc2ccc(C(=O)N3CCCCC3)cc2)nc(C(F)F)n1	ZINC000872396693	FF	On-Demand	Anodyne	DPP7	47	37
Nc1nc(NCc2ccc(C(=O)N3CCCCC3)cc2)nc(C(F)F)n1	ZINC000872396693	FF	On-Demand	Anodyne	PTR1	41	39
Nc1nc(NCc2ccc(C(=O)N3CCCCC3)cc2)nc(C(F)F)n1	ZINC000872396693	FF	On-Demand	Anodyne	L3MBTL3	57	37
C(=NN1CCC1)c1c[nH]c2ncccc12	ZINC000872396700	BD	On-Demand	Mild	CDC7	51	49
CN(CC(=O)N1CCCC1)c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872396707	EF	On-Demand	Anodyne	GRM5	15	41
COc1cc2c(cc1OC)C(=NN1CCC1)CC2	ZINC000872396736	BE	On-Demand	Mild	PDE3A	19	40
COc1ccc2[nH]c3c(c2c1)CC(=NN1CCC1)CC3	ZINC000872396738	CF	On-Demand	Mild	DRD5	22	49
Oc1nnc(Cl)cc1N1CCN(Cc2cn3ccccc3n2)CC1	ZINC000872396740	ED	On-Demand	Anodyne	DRD4	26	63
O=C(c1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872396819	EG	On-Demand	Anodyne	EPHX2	15	46
O=C(c1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872396819	EG	On-Demand	Anodyne	CCR8	45	41
O=C(c1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872396819	EG	On-Demand	Anodyne	SMO	46	43
O=C(c1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872396819	EG	On-Demand	Anodyne	L3MBTL3	62	35
CC(=NN1CCC1)c1ccc(N2CCOCC2)cc1Cl	ZINC000872396847	CF	On-Demand	Mild	BCL2A1	15	40
O=C(c1ccccc1)N1CCC(N=c2cc[nH]cc2C2CC2)CC1	ZINC000872396859	DG	On-Demand	Anodyne	SLC9A1	22	40
O=C(c1ccccc1)N1CCC(N=c2cc[nH]cc2C2CC2)CC1	ZINC000872396859	DG	On-Demand	Anodyne	L3MBTL3	64	35
CCN(CC)C(=O)CN1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872396890	FC	On-Demand	Anodyne	MRGPRX1	40	39
CC(=NN1CCC1)c1cccc(NS(C)(=O)=O)c1	ZINC000872396905	CD	On-Demand	Mild	NR3C2	19	45
O=C1C(=NN2CCC2)c2cc(Br)ccc2N1Cc1ncon1	ZINC000872396919	FD	On-Demand	Mild	UCHL1	36	40
Nc1nc(NCCCOc2ccccc2)nc(C(F)F)n1	ZINC000872396944	CE	On-Demand	Anodyne	DRD4	17	40
Nc1nc(NCCCOc2ccccc2)nc(C(F)F)n1	ZINC000872396944	CE	On-Demand	Anodyne	HTR7	15	57
CC(=NN1CCC1)c1ccc(OCCN(C)C)cc1	ZINC000872396946	CE	On-Demand	Mild	HRH3	18	50
CC(=NN1CCC1)c1ccc(OCCN(C)C)cc1	ZINC000872396946	CE	On-Demand	Mild	ESRRG	55	42
CC(=NN1CCC1)c1ccc(OCCN(C)C)cc1	ZINC000872396946	CE	On-Demand	Mild	PSMB1	41	37
CC(CSc1ccccc1[N+](=O)[O-])=NN1CCC1	ZINC000872396971	CF	On-Demand	Mild	GSTM2	49	32
CC(CSc1ccccc1[N+](=O)[O-])=NN1CCC1	ZINC000872396971	CF	On-Demand	Mild	COLA	78	38
CC(=NN1CCC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872396985	CD	On-Demand	Mild	DRD4	32	49
CC(=NN1CCC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872396985	CD	On-Demand	Mild	SIGMAR1	44	44
CC(=NN1CCC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872396987	CD	On-Demand	Mild	DRD4	32	49
CC(=NN1CCC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872396987	CD	On-Demand	Mild	SIGMAR1	44	44
CC(=NN1CCC1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000872396993	CF	On-Demand	Mild	WDR5	19	40
Cc1c(F)ncnc1N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872397003	FD	On-Demand	Anodyne	HSD11B1	15	51
Cc1c(F)ncnc1N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872397003	FD	On-Demand	Anodyne	PKM	29	40
Cc1c(F)ncnc1N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872397003	FD	On-Demand	Anodyne	GCK	42	34
O=C(CN1CCN(c2ccnc3ncccc23)CC1)N1CCCCCC1	ZINC000872397019	FE	On-Demand	Anodyne	HTR1A	25	43
NC(=O)c1cc(N2CCC(OCc3ccccc3)CC2)nc(Cl)n1	ZINC000872397027	EE	On-Demand	Anodyne	GRIN2B	19	43
NC(=O)c1cc(N2CCC(OCc3ccccc3)CC2)nc(Cl)n1	ZINC000872397027	EE	On-Demand	Anodyne	SCD1	51	50
NC(=O)c1cc(N2CCC(OCc3ccccc3)CC2)nc(Cl)n1	ZINC000872397027	EE	On-Demand	Anodyne	SLC12A5	48	33
O=C(C(=O)N1CCN(c2cc(Cl)nnc2O)CC1)N1CCOCC1	ZINC000872397047	FB	On-Demand	Anodyne	AKR1C3	15	48
Cc1c(F)ncnc1N1CCN(Cc2ccccn2)CC1	ZINC000872397053	CD	On-Demand	Anodyne	ABCC1	44	37
O=C1Nc2cccc(C(F)(F)F)c2C1=NN1CCC1	ZINC000872397073	CE	On-Demand	Mild	GALR3	15	40
Cc1c(F)ncnc1N1CCN(Cc2cn3ccccc3n2)CC1	ZINC000872397117	ED	On-Demand	Anodyne	DRD4	23	56
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3cc(Cl)nnc3O)CC2)C1	ZINC000872397118	FD	On-Demand	Anodyne	DRD4	19	40
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3cc(Cl)nnc3O)CC2)C1	ZINC000872397119	FD	On-Demand	Anodyne	DRD4	19	40
O=C(c1ccccc1)N1CCC(Nc2nc(Cl)nc3sccc23)CC1	ZINC000872397147	FI	On-Demand	Anodyne	L3MBTL3	43	32
O=C(O)c1ccc2c(C=NN3CCC3)n[nH]c2c1	ZINC000872397156	BD	On-Demand	Mild	PLK4	42	39
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCCC1	ZINC000872397176	EH	On-Demand	Anodyne	HNMT	60	38
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCCC1	ZINC000872397176	EH	On-Demand	Anodyne	L3MBTL3	49	42
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCCC1	ZINC000872397176	EH	On-Demand	Anodyne	NAMPT	21	48
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA2	15	46
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA6	24	46
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA1	16	46
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA7	25	46
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA13	46	46
CCC(=NN1CCC1)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000872397182	DD	On-Demand	Mild	CA4	15	43
Nc1nc(NCc2ccc(C(F)(F)F)cc2)nc(C(F)F)n1	ZINC000872397212	DG	On-Demand	Anodyne	TPH1	30	53
O=C(C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCOCC1	ZINC000872397217	GC	On-Demand	Anodyne	PIK3CA	17	45
O=C(C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCOCC1	ZINC000872397217	GC	On-Demand	Anodyne	PIK3CB	17	40
O=C(C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCOCC1	ZINC000872397217	GC	On-Demand	Anodyne	AKR1C3	15	43
NS(=O)(=O)c1ccc2c(c1)C(=NN1CCC1)CCC2	ZINC000872397222	CD	On-Demand	Mild	CA7	26	53
NS(=O)(=O)c1ccc2c(c1)C(=NN1CCC1)CCC2	ZINC000872397222	CD	On-Demand	Mild	CA14	20	53
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872397234	EG	On-Demand	Anodyne	L3MBTL3	48	36
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000872397234	EG	On-Demand	Anodyne	HPGD	45	39
Cc1c(F)ncnc1N(C)Cc1ccc(N2CCOCC2)cc1	ZINC000872397240	DE	On-Demand	Clean	EPHB4	50	32
Oc1nnc(Cl)cc1N1CCN(Cc2ccsc2)CC1	ZINC000872397260	DE	On-Demand	Anodyne	DRD4	17	41
CC(CCc1ccccc1[N+](=O)[O-])=NN1CCC1	ZINC000872397271	BF	On-Demand	Mild	COLA	114	37
CC(=NN1CCC1)c1cccc(OCCN(C)C)c1	ZINC000872397285	CE	On-Demand	Mild	ESRRG	48	36
NS(=O)(=O)c1cc(C(=NN2CCC2)C2CC2)ccc1Cl	ZINC000872397296	DD	On-Demand	Mild	CA6	20	40
NS(=O)(=O)c1cc(C(=NN2CCC2)C2CC2)ccc1Cl	ZINC000872397296	DD	On-Demand	Mild	CA7	17	41
NS(=O)(=O)c1cc(C(=NN2CCC2)C2CC2)ccc1Cl	ZINC000872397296	DD	On-Demand	Mild	CA13	32	41
Oc1nnc(Cl)cc1Sc1nnnn1C[C@@H]1CCCO1	ZINC000872397326	DD	On-Demand	Anodyne	PDE8B	48	35
Oc1nnc(Cl)cc1Sc1nnnn1C[C@H]1CCCO1	ZINC000872397329	DD	On-Demand	Anodyne	PDE8B	48	35
Nc1nc(N[C@@H]2CCc3ccccc32)nc(C(F)F)n1	ZINC000872397332	CE	On-Demand	Anodyne	KCNN3	22	46
Nc1nc(N[C@H]2CCc3ccccc32)nc(C(F)F)n1	ZINC000872397335	CE	On-Demand	Anodyne	KCNN3	22	46
CCOC(=O)N1CCN(S(=O)(=O)Nc2csc(C)c2)CC1	ZINC000872397358	ED	On-Demand	Anodyne	TGM2	42	47
CCOC(=O)N1CCN(S(=O)(=O)Nc2csc(C)c2)CC1	ZINC000872397358	ED	On-Demand	Anodyne	F13A1	54	47
c1ccc(-c2cc(N3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872397370	EF	On-Demand	Anodyne	DRD2	20	42
c1ccc(-c2cc(N3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872397370	EF	On-Demand	Anodyne	DRD4	50	50
c1ccc(-c2cc(N3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872397370	EF	On-Demand	Anodyne	DRD3	19	42
CC(=O)c1ccc(N2CCN(c3nc(N)nc(C(F)F)n3)CC2)c(F)c1	ZINC000872397385	FE	On-Demand	Anodyne	NPY2R	56	33
CC(=O)c1ccc(N2CCN(c3nc(N)nc(C(F)F)n3)CC2)c(F)c1	ZINC000872397385	FE	On-Demand	Anodyne	SLC6A9	20	45
CC(=O)c1ccc(N2CCN(c3ncnc(F)c3C)CC2)c(F)c1	ZINC000872397386	EF	On-Demand	Anodyne	NPY2R	60	35
CC(=O)c1ccc(N2CCN(c3ncnc(F)c3C)CC2)c(F)c1	ZINC000872397386	EF	On-Demand	Anodyne	SLC6A9	20	45
NC(=O)c1cc(N2CCN(Cc3ccccn3)CC2)nc(Cl)n1	ZINC000872397400	EC	On-Demand	Anodyne	DRD4	39	43
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872397418	DF	On-Demand	Anodyne	HTR2B	15	43
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872397418	DF	On-Demand	Anodyne	EPHX2	20	46
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872397418	DF	On-Demand	Anodyne	CD38	24	40
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872397418	DF	On-Demand	Anodyne	SMO	41	40
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2)CC1	ZINC000872397418	DF	On-Demand	Anodyne	L3MBTL3	67	35
O=C(CN1CCN(c2ccnc3ncccc23)CC1)N1CCCCC1	ZINC000872397423	ED	On-Demand	Anodyne	HTR1A	25	43
Cn1ncc2c(N3CCN(Cc4cn5ccccc5n4)CC3)nc(Cl)nc21	ZINC000872397431	GD	On-Demand	Anodyne	DRD4	21	41
Fc1ccc2[nH]cc(C=NN3CCC3)c2c1	ZINC000872397436	BE	On-Demand	Mild	MPO	89	46
O=C1Nc2ccc(C(F)(F)F)cc2C1=NN1CCC1	ZINC000872397448	CE	On-Demand	Mild	GALR3	16	46
O=C(c1ccc(CN=c2cc[nH]cc2C2CC2)cc1)N1CCCCC1	ZINC000872397452	EH	On-Demand	Anodyne	L3MBTL3	84	40
CC(=NN1CCC1)c1ccc(Br)cc1O	ZINC000872397474	CF	On-Demand	Mild	PYK	41	32
O=C(O)COc1ccc(C=NN2CCC2)cc1Br	ZINC000872397480	DD	On-Demand	Mild	PTGDR2	25	41
c1ccc(CN2CCN(c3ccncc3C3CC3)CC2)nc1	ZINC000872397492	CF	On-Demand	Anodyne	DRD2	16	41
c1ccc(CN2CCN(c3ccncc3C3CC3)CC2)nc1	ZINC000872397492	CF	On-Demand	Anodyne	DRD4	41	41
c1ccc(CN2CCN(c3ccncc3C3CC3)CC2)nc1	ZINC000872397492	CF	On-Demand	Anodyne	DRD3	16	41
c1cnc2nccc(N3CCN(Cc4ccsc4)CC3)c2c1	ZINC000872397498	DG	On-Demand	Anodyne	DRD4	25	52
FC(F)(F)c1cnc(C=NN2CCC2)s1	ZINC000872397552	BE	On-Demand	Mild	MLYCD	60	37
O=C(O)c1cc(C=NN2CCC2)ccc1O	ZINC000872397553	BD	On-Demand	Mild	APP	36	44
CCOc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872397575	FG	On-Demand	Anodyne	SSTR5	45	37
CCOc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872397575	FG	On-Demand	Anodyne	GPR119	47	39
CCOc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872397575	FG	On-Demand	Anodyne	L3MBTL3	47	34
CCOc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1	ZINC000872397589	GF	On-Demand	Anodyne	PRSS2	45	31
CCOc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1	ZINC000872397589	GF	On-Demand	Anodyne	SSTR5	56	38
CCOc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1	ZINC000872397589	GF	On-Demand	Anodyne	CHEK2	40	40
CCOc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1	ZINC000872397589	GF	On-Demand	Anodyne	L3MBTL3	57	34
CC(=O)c1ccc(N2CCN(c3cc(Cl)nnc3O)CC2)c(F)c1	ZINC000872397647	FF	On-Demand	Anodyne	NPY2R	61	37
CC(=O)c1ccc(N2CCN(c3cc(Cl)nnc3O)CC2)c(F)c1	ZINC000872397647	FF	On-Demand	Anodyne	SLC6A9	21	46
COc1cc(NC(C)=O)ccc1C(C)=NN1CCC1	ZINC000872397651	CE	On-Demand	Mild	ENPP1	60	31
O=C(c1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872397654	EF	On-Demand	Anodyne	NPY2R	23	41
O=C(c1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872397654	EF	On-Demand	Anodyne	EPHX2	18	44
O=C(c1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872397654	EF	On-Demand	Anodyne	SMO	40	39
O=C(c1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872397654	EF	On-Demand	Anodyne	L3MBTL3	68	37
O=[N+]([O-])c1ccccc1CC(=NN1CCC1)C1CC1	ZINC000872397662	CF	On-Demand	Mild	COLA	98	34
NC(=O)c1cccc(C=NN2CCC2)c1	ZINC000872397671	BC	On-Demand	Mild	AMD1	18	41
CC(=O)c1ccc(N2CCN(c3nc(Cl)nc4c3cnn4C)CC2)c(F)c1	ZINC000872397677	GF	On-Demand	Anodyne	Q9M629_MAIZE	47	35
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	DRD2	16	43
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	DRD4	42	43
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	ACHE	39	48
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	SLC6A1	72	33
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	HRH3	16	42
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	SIGMAR1	69	47
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	SLC18A3	31	42
CC(=NN1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872397702	CF	On-Demand	Mild	BIRC2	17	42
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	DRD2	16	43
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	DRD4	42	43
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	ACHE	39	48
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	SLC6A1	72	33
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	HRH3	16	42
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	SIGMAR1	69	47
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	SLC18A3	31	42
CC(=NN1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872397703	CF	On-Demand	Mild	BIRC2	17	42
Nc1nc(NC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872397709	EE	On-Demand	Anodyne	GRIN2B	21	41
Nc1nc(NC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872397709	EE	On-Demand	Anodyne	L3MBTL3	64	36
Oc1ccc2c(c1)CCC2=NN1CCC1	ZINC000872397717	BD	On-Demand	Mild	MAPK3	45	30
C(=NN1CCC1)c1ccc2occc2c1	ZINC000872397720	BE	On-Demand	Mild	CYP2A6	15	50
O=C(C(=O)N1CCN(c2ccnc3ncccc23)CC1)N1CCOCC1	ZINC000872397724	FC	On-Demand	Anodyne	AKR1C3	15	42
CCOc1ccc(C(=O)N2CCC(Nc3ccnc4ncccc34)CC2)cc1	ZINC000872397776	GH	On-Demand	Anodyne	SSTR5	53	35
CCOc1ccc(C(=O)N2CCC(Nc3ccnc4ncccc34)CC2)cc1	ZINC000872397776	GH	On-Demand	Anodyne	CCR8	50	37
CCOc1ccc(C(=O)N2CCC(Nc3ccnc4ncccc34)CC2)cc1	ZINC000872397776	GH	On-Demand	Anodyne	L3MBTL3	51	34
C=CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872397778	ED	On-Demand	Mild	PRNP	40	35
C=CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872397778	ED	On-Demand	Mild	SLC27A1	43	35
Oc1nnc(Cl)cc1N1CCN(Cc2ccccn2)CC1	ZINC000872397781	DD	On-Demand	Anodyne	DRD2	22	41
Oc1nnc(Cl)cc1N1CCN(Cc2ccccn2)CC1	ZINC000872397781	DD	On-Demand	Anodyne	DRD4	56	38
c1ccn2cc(CN3CCN(c4ccncc4C4CC4)CC3)nc2c1	ZINC000872397826	EF	On-Demand	Anodyne	DRD4	27	44
CC(=NN1CCC1)[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC000872397833	CF	On-Demand	Mild	COLA	134	42
CC(=NN1CCC1)[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC000872397834	CF	On-Demand	Mild	COLA	134	42
CCCOc1ccc2[nH]cc(C=NN3CCC3)c2c1	ZINC000872397838	CF	On-Demand	Mild	HTR1D	21	42
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccn3)CC2)n1	ZINC000872397890	DD	On-Demand	Anodyne	DRD4	30	40
Nc1nc(C(F)F)nc(N2CCN(Cc3cn4ccccc4n3)CC2)n1	ZINC000872397900	FD	On-Demand	Anodyne	DRD4	18	60
Cn1ncc2c(NCCCOc3ccccc3)nc(Cl)nc21	ZINC000872397901	DF	On-Demand	Anodyne	ABL1	23	40
NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872397931	CC	On-Demand	Anodyne	HTR1A	33	43
NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872397931	CC	On-Demand	Anodyne	DRD2	20	43
c1coc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872397933	CF	On-Demand	Anodyne	DRD4	23	40
c1ccc(CN2CCN(c3ccnc4ncccc34)CC2)nc1	ZINC000872397963	DE	On-Demand	Anodyne	HTR1A	20	44
c1ccc(CN2CCN(c3ccnc4ncccc34)CC2)nc1	ZINC000872397963	DE	On-Demand	Anodyne	DRD2	24	43
c1ccc(CN2CCN(c3ccnc4ncccc34)CC2)nc1	ZINC000872397963	DE	On-Demand	Anodyne	DRD4	52	44
c1ccc(CN2CCN(c3ccnc4ncccc34)CC2)nc1	ZINC000872397963	DE	On-Demand	Anodyne	DRD3	21	41
CC(=NN1CCC1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872397968	BD	On-Demand	Mild	CELA1	24	42
CC(=NN1CCC1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000872397968	BD	On-Demand	Mild	CTSK	17	47
CC(=NN1CCC1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000872397969	BD	On-Demand	Mild	CELA1	24	42
CC(=NN1CCC1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000872397969	BD	On-Demand	Mild	CTSK	17	47
CCOc1ccc(C(=O)N2CCC(Nc3cc(C)nc4c3cnn4C)CC2)cc1	ZINC000872397982	GG	On-Demand	Anodyne	SSTR5	42	35
COc1ccc(OC)c2sc(N3CCC[C@H]3C(=O)N(C)C)nc12	ZINC000872397986	EE	On-Demand	Anodyne	AVPR1B	41	34
COc1ccc(OC)c2sc(N3CCC[C@@H]3C(=O)N(C)C)nc12	ZINC000872397987	EE	On-Demand	Anodyne	AVPR1B	41	34
NS(=O)(=O)c1ccc(C=NN2CCC2)cc1	ZINC000872397988	BC	On-Demand	Mild	CA2	37	46
NS(=O)(=O)c1ccc(C=NN2CCC2)cc1	ZINC000872397988	BC	On-Demand	Mild	CA1	31	46
NS(=O)(=O)c1ccc(C=NN2CCC2)cc1	ZINC000872397988	BC	On-Demand	Mild	CA9	31	41
NS(=O)(=O)c1ccc(C=NN2CCC2)cc1	ZINC000872397988	BC	On-Demand	Mild	CAH_METTE	40	38
Oc1nnc(Cl)cc1N1CCC(OCc2ccccc2)CC1	ZINC000872397997	DG	On-Demand	Anodyne	GRIN2B	16	42
NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872398019	GD	On-Demand	Anodyne	NPY2R	46	39
NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872398020	GD	On-Demand	Anodyne	NPY2R	46	39
c1ccc(C[C@@H]2CCC(=NN3CCC3)C2)cc1	ZINC000872398023	BG	On-Demand	Mild	GRIN2B	38	44
c1ccc(C[C@H]2CCC(=NN3CCC3)C2)cc1	ZINC000872398024	BG	On-Demand	Mild	GRIN2B	38	44
CC(CCc1ccc(OCC(=O)O)cc1)=NN1CCC1	ZINC000872398028	CE	On-Demand	Mild	PLA2G4A	41	34
CC(CCc1ccc(OCC(=O)O)cc1)=NN1CCC1	ZINC000872398028	CE	On-Demand	Mild	PLA2G4B	71	38
CC(CCc1ccc(OCC(=O)O)cc1)=NN1CCC1	ZINC000872398028	CE	On-Demand	Mild	FFAR1	60	42
CC(CCc1ccc(OCC(=O)O)cc1)=NN1CCC1	ZINC000872398028	CE	On-Demand	Mild	PPO2	38	57
CC(CCc1ccc(OCC(=O)O)cc1)=NN1CCC1	ZINC000872398028	CE	On-Demand	Mild	FFAR4	51	36
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	LTA4H	48	41
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	CYSLTR2	46	32
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	HRH3	20	44
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	PLA2G4B	68	37
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	FFAR1	67	44
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	PPO2	40	51
CC(CCc1ccc(OCCC(=O)O)cc1)=NN1CCC1	ZINC000872398071	CF	On-Demand	Mild	FFAR4	53	38
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	HTR1A	23	44
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	DRD2	27	42
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	DRD4	53	42
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	DRD3	23	41
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	SIGMAR1	43	42
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	FAAH	19	43
NC(=O)c1cc(N2CCCN(Cc3ccccc3)CC2)nc(Cl)n1	ZINC000872398081	ED	On-Demand	Anodyne	NPFFR1	42	39
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	DRD2	20	42
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	DRD4	48	39
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	HTR2A	20	41
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	HTR2C	18	41
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	DRD3	28	42
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	HTR4	18	44
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C)CC1	ZINC000872398092	DF	On-Demand	Anodyne	FGFR1	26	41
COc1ccc(OC)c2sc(NCCN3CCN(C)CC3)nc12	ZINC000872398105	ED	On-Demand	Anodyne	HTR1A	27	41
Cc1c(F)ncnc1N1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000872398140	EF	On-Demand	Mild	ABCC1	54	38
Cn1ncc2c(N3CCCN(Cc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398145	FF	On-Demand	Anodyne	DRD4	27	40
O=C(O)c1cccc(C=NN2CCC2)c1	ZINC000872398146	BD	On-Demand	Mild	AKR1C3	54	35
O=C(O)c1cccc(C=NN2CCC2)c1	ZINC000872398146	BD	On-Demand	Mild	CYSK1	56	32
O=C(OCc1ccccc1)c1ccc(C=NN2CCC2)[nH]1	ZINC000872398170	CE	On-Demand	Mild	SLC12A5	68	36
Oc1nnc(Cl)cc1N1CCCN(Cc2ccccc2)CC1	ZINC000872398178	DF	On-Demand	Anodyne	HTR1A	26	45
Oc1nnc(Cl)cc1N1CCCN(Cc2ccccc2)CC1	ZINC000872398178	DF	On-Demand	Anodyne	DRD2	40	55
Oc1nnc(Cl)cc1N1CCCN(Cc2ccccc2)CC1	ZINC000872398178	DF	On-Demand	Anodyne	DRD4	70	48
Oc1nnc(Cl)cc1N1CCCN(Cc2ccccc2)CC1	ZINC000872398178	DF	On-Demand	Anodyne	DRD3	30	48
Oc1nnc(Cl)cc1N1CCCN(Cc2ccccc2)CC1	ZINC000872398178	DF	On-Demand	Anodyne	SIGMAR1	53	46
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	HTR1A	30	44
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	DRD2	38	49
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	DRD4	64	47
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	DRD3	27	47
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	HTR7	20	42
c1ccc(CN2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872398180	DG	On-Demand	Anodyne	SIGMAR1	44	46
CN(C)C(=O)c1ccc(NS(=O)(=O)c2cnn(CC3CC3)c2)c(F)c1	ZINC000872398189	FD	On-Demand	Anodyne	TRPV1	59	34
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000872398203	GH	On-Demand	Anodyne	DRD4	17	43
CCOc1cc(C=NN2CCC2)ccc1OC(=O)CC	ZINC000872398207	CE	On-Demand	Mild	AKR1C3	16	43
CC(=NN1CCC1)c1cccc(OCCCC(=O)O)c1	ZINC000872398213	CE	On-Demand	Mild	PPARG	15	41
CC(=NN1CCC1)c1cccc(OCCCC(=O)O)c1	ZINC000872398213	CE	On-Demand	Mild	PPARA	15	41
CC(=NN1CCC1)c1cccc(OCCCC(=O)O)c1	ZINC000872398213	CE	On-Demand	Mild	CYSLTR2	42	35
CC(=NN1CCC1)c1cccc(OCCCC(=O)O)c1	ZINC000872398213	CE	On-Demand	Mild	LTB4R2	41	33
CC(=NN1CCC1)c1cccc(OCCCC(=O)O)c1	ZINC000872398213	CE	On-Demand	Mild	PLA2G4B	70	43
c1ccc([C@@H]2CCC(=NN3CCC3)C2)cc1	ZINC000872398222	BG	On-Demand	Mild	SLC18A3	29	43
c1ccc([C@H]2CCC(=NN3CCC3)C2)cc1	ZINC000872398223	BG	On-Demand	Mild	SLC18A3	29	43
c1ccc2c3c([nH]c2c1)CC(=NN1CCC1)C3	ZINC000872398236	BE	On-Demand	Mild	DRD5	23	45
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA2	23	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA1	18	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA7	17	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA4	20	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA9	15	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CAH_METTE	31	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	CA15	17	44
NS(=O)(=O)c1ccc(C=NN2CCC2)c(F)c1	ZINC000872398315	CC	On-Demand	Mild	A6YCJ1_9METZ	15	44
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR1A	62	51
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	DRD2	57	60
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	DRD4	53	47
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR1D	41	44
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR1B	36	44
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR2A	37	60
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR2C	17	44
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	SLC6A4	15	52
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	DRD3	50	40
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	SLC6A3	22	52
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	HTR7	46	42
Oc1nnc(Cl)cc1N1CCN(CCc2ccccc2)CC1	ZINC000872398321	DE	On-Demand	Anodyne	SIGMAR1	44	60
O=C(OCc1ccccc1)c1cc(C=NN2CCC2)c[nH]1	ZINC000872398363	CE	On-Demand	Mild	SLC12A5	64	35
Oc1nnc(Cl)cc1NCCCCc1ccccc1	ZINC000872398367	CG	On-Demand	Anodyne	SCNN1A	53	39
Oc1nnc(Cl)cc1NCCCCc1ccccc1	ZINC000872398367	CG	On-Demand	Anodyne	FAAH	16	40
CC(=NN1CCC1)c1cn(-c2ccccc2)nn1	ZINC000872398389	BD	On-Demand	Mild	ESRRA	23	44
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	HTR1A	22	46
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	DRD2	21	48
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	DRD4	19	40
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	SLC6A3	19	44
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	SIGMAR1	30	48
Cn1ncc2c(N3CCN(CCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872398395	FE	On-Demand	Anodyne	ABCC1	56	37
CCC(=NN1CCC1)c1ccccc1OCC(=O)N(C)C	ZINC000872398403	CD	On-Demand	Mild	HCN1	52	36
CCC(=NN1CCC1)c1ccccc1OCC(=O)N(C)C	ZINC000872398403	CD	On-Demand	Mild	HCN4	44	36
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	HTR1A	33	51
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	DRD2	35	51
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	DRD4	38	44
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	HTR2A	30	47
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	DRD3	17	42
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	SLC6A3	21	43
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	HTR7	18	42
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	SIGMAR1	38	49
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	ABCC1	118	48
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	ABCB1A	61	44
Cc1c(F)ncnc1N1CCN(CCc2ccccc2)CC1	ZINC000872398471	DE	On-Demand	Anodyne	RPS6KB1	46	35
c1ccc(C2CC(=NN3CCC3)C2)cc1	ZINC000872398476	BF	On-Demand	Mild	SLC18A3	28	44
CC(CCCc1cccnc1)=NN1CCC1	ZINC000872398477	BE	On-Demand	Mild	FKBP1A	16	42
CC(CCCc1cccnc1)=NN1CCC1	ZINC000872398477	BE	On-Demand	Mild	TBXAS1	28	46
CC(CCCc1cccnc1)=NN1CCC1	ZINC000872398477	BE	On-Demand	Mild	CHRNA7	41	34
CC(=NN1CCC1)c1cc(Br)ccc1OCC(=O)O	ZINC000872398492	EE	On-Demand	Mild	PTGDR2	33	64
Nc1nc(C(F)F)nc(N2CCCN(Cc3ccccc3)CC2)n1	ZINC000872398502	EE	On-Demand	Anodyne	DRD4	36	47
Nc1nc(C(F)F)nc(N2CCCN(Cc3ccccc3)CC2)n1	ZINC000872398502	EE	On-Demand	Anodyne	SIGMAR1	27	43
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	HTR1A	50	46
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	DRD2	39	50
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	DRD4	37	48
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	HTR2A	40	50
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	HTR2C	21	40
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	SLC6A4	15	50
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	DRD3	37	40
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	SLC6A3	21	50
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	KCNH2	15	40
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	SIGMAR1	40	50
NC(=O)c1cc(N2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872398516	ED	On-Demand	Anodyne	ABCC1	42	36
N#Cc1ccc(CN2CCCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872398540	EE	On-Demand	Mild	DRD4	17	41
CCC(=NN1CCC1)c1ccc(OCCCCC(=O)O)cc1	ZINC000872398554	DG	On-Demand	Mild	CYSLTR2	79	33
CCC(=NN1CCC1)c1ccc(OCCCCC(=O)O)cc1	ZINC000872398554	DG	On-Demand	Mild	HRH3	31	41
CCC(=NN1CCC1)c1ccc(OCCCCC(=O)O)cc1	ZINC000872398554	DG	On-Demand	Mild	PLA2G4A	25	42
CCC(=NN1CCC1)c1ccc(OCCCCC(=O)O)cc1	ZINC000872398554	DG	On-Demand	Mild	PLA2G4B	104	44
CC(=NN1CCC1)c1csc(-c2ccccc2)n1	ZINC000872398558	CG	On-Demand	Mild	PTGER1	20	42
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	HTR1A	21	53
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	DRD2	20	53
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	DRD4	24	43
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	HTR2A	20	51
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	SLC6A3	21	45
Nc1nc(C(F)F)nc(N2CCN(CCc3ccccc3)CC2)n1	ZINC000872398595	ED	On-Demand	Anodyne	SIGMAR1	34	51
Cc1c(F)ncnc1N1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398623	FD	On-Demand	Anodyne	AKT2	49	40
Cc1c(F)ncnc1N1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398623	FD	On-Demand	Anodyne	AKT3	74	40
Cc1c(F)ncnc1N1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398623	FD	On-Demand	Anodyne	AKT1	49	41
Cc1c(F)ncnc1N1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398624	FD	On-Demand	Anodyne	AKT2	49	40
Cc1c(F)ncnc1N1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398624	FD	On-Demand	Anodyne	AKT3	74	40
Cc1c(F)ncnc1N1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000872398624	FD	On-Demand	Anodyne	AKT1	49	41
Cc1ncsc1-c1ccc(C=NN2CCC2)cc1	ZINC000872398836	CG	On-Demand	Mild	VHL	42	34
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	ESR1	75	37
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	ESR2	51	37
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	LTA4H	52	52
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	HRH3	34	47
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	PSMB2	43	43
C(=NN1CCC1)c1ccc(OCCN2CCOCC2)cc1	ZINC000872398842	CD	On-Demand	Mild	PSMB1	47	43
c1ccc(CN2C[C@H]3C(=NN4CCC4)CC[C@H]3C2)cc1	ZINC000872398891	CF	On-Demand	Mild	SIGMAR1	47	50
CO[C@@H](CS(=O)(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000872398909	FD	On-Demand	Mild	PANC	43	34
C(=NN1CCC1)c1cc2ccncc2s1	ZINC000872399002	BE	On-Demand	Mild	CYP2A6	18	55
CC(CCOCc1ccccc1)=NN1CCC1	ZINC000872399051	BF	On-Demand	Mild	SLC12A5	68	37
CC(CCc1c[nH]c2ccccc12)=NN1CCC1	ZINC000872399069	BG	On-Demand	Mild	HTR1D	49	47
CC(CCc1c[nH]c2ccccc12)=NN1CCC1	ZINC000872399069	BG	On-Demand	Mild	HTR1B	36	47
CC(CCc1c[nH]c2ccccc12)=NN1CCC1	ZINC000872399069	BG	On-Demand	Mild	MPO	44	47
CC(CCc1c[nH]c2ccccc12)=NN1CCC1	ZINC000872399069	BG	On-Demand	Mild	MC5R	28	42
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	DRD4	18	40
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	SSTR5	43	36
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	PRNP	44	33
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	MAPK13	83	35
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	MCHR1	16	44
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	SIRT3	64	37
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	SIRT2	68	37
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	SIRT1	57	37
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	LIMK2	28	42
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872399114	DE	On-Demand	Anodyne	HPGDS	34	40
O=C(c1ccc(C=NN2CCC2)cc1)N1CCCC1	ZINC000872399131	CD	On-Demand	Mild	MLYCD	23	51
O=C(c1ccc(C=NN2CCC2)cc1)N1CCCC1	ZINC000872399131	CD	On-Demand	Mild	L3MBTL3	84	44
COCCOCC(=O)NN=Cc1cn(Cc2ccc(OC)cc2)nn1	ZINC000872399134	EC	On-Demand	Reactive	PROKR1	57	34
CS(=O)(=O)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872399146	DD	On-Demand	Anodyne	MAPK9	15	46
CS(=O)(=O)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872399146	DD	On-Demand	Anodyne	MAPK8	20	46
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccccc1	ZINC000872399168	DG	On-Demand	Anodyne	DRD4	19	45
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccccc1	ZINC000872399168	DG	On-Demand	Anodyne	SSTR5	43	41
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccccc1	ZINC000872399168	DG	On-Demand	Anodyne	CHRNA7	29	44
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccccc1	ZINC000872399168	DG	On-Demand	Anodyne	TGM2	26	42
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccccc1	ZINC000872399168	DG	On-Demand	Anodyne	ACHP_LYMST	15	44
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000872399169	FG	On-Demand	Anodyne	DRD2	16	42
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000872399169	FG	On-Demand	Anodyne	DRD4	54	40
O=C(C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCCC1	ZINC000872399170	FH	On-Demand	Anodyne	GRM5	25	49
FC(F)(F)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872399180	CE	On-Demand	Anodyne	DRD4	24	41
COCCOCC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872399188	DE	On-Demand	Reactive	PDE10A	25	46
COCCOCC(=O)NN=Cc1ccc(OC)c(C(C)(C)C)c1	ZINC000872399188	DE	On-Demand	Reactive	ADCYAP1R1	43	37
COCCOCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872399191	DD	On-Demand	Reactive	GCGR	35	47
COCCOCC(=O)NN=Cc1cc(OC)c(O)cc1Cl	ZINC000872399191	DD	On-Demand	Reactive	ADCYAP1R1	66	39
COCCOCC(=O)NN=C1CCc2cc(OC)ccc21	ZINC000872399192	CD	On-Demand	Reactive	NQO2	18	42
COCCOCC(=O)NN=Cc1ccc(CC(F)(F)F)cc1	ZINC000872399194	DD	On-Demand	Reactive	ADCYAP1R1	57	35
Oc1nnc(Cl)cc1N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000872399199	FD	On-Demand	Anodyne	HTR1A	15	49
Oc1nnc(Cl)cc1N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000872399199	FD	On-Demand	Anodyne	HTR7	23	49
Cc1cc(N2CCc3[nH]c4ccccc4c3C2)c2cnn(C)c2n1	ZINC000872399208	DG	On-Demand	Anodyne	DRD5	19	41
c1ccc(CCC(=NN2CCC2)c2ccccn2)cc1	ZINC000872399219	CG	On-Demand	Mild	PREP	18	42
NS(=O)(=O)c1cccc(C=NN2CCC2)c1	ZINC000872399240	BC	On-Demand	Mild	CAH_METTE	26	41
CC(CCc1cccnc1)=NN1CCC1	ZINC000872399242	BE	On-Demand	Mild	TBXAS1	20	41
CC(CCc1cccnc1)=NN1CCC1	ZINC000872399242	BE	On-Demand	Mild	CHRNA7	43	35
CC(CCc1cccnc1)=NN1CCC1	ZINC000872399242	BE	On-Demand	Mild	C3AR1	39	41
CC(CCc1cccnc1)=NN1CCC1	ZINC000872399242	BE	On-Demand	Mild	ACHP_LYMST	24	40
CS(=O)(=O)NC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872399244	ED	On-Demand	Anodyne	HRH4	21	57
COCCOCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872399257	DE	On-Demand	Reactive	TACR1	22	41
COCCOCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872399257	DE	On-Demand	Reactive	MC5R	44	36
COCCOCC(=O)NN=C(C)CCc1c[nH]c2ccccc12	ZINC000872399257	DE	On-Demand	Reactive	GHSR	42	35
NC(=O)c1cc(N2CCCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872399268	FE	On-Demand	Anodyne	IKBKB	41	35
NC(=O)c1cc(N2CCCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872399268	FE	On-Demand	Anodyne	SLC27A1	52	34
COCCOCC(=O)NN=Cc1ccc(Cl)c(OC)c1	ZINC000872399307	DD	On-Demand	Reactive	GCGR	19	45
COCCOCC(=O)NN=Cc1ccc(Cl)c(OC)c1	ZINC000872399307	DD	On-Demand	Reactive	PDE10A	27	52
COCCOCC(=O)NN=Cc1ccc(Cl)c(OC)c1	ZINC000872399307	DD	On-Demand	Reactive	ADCYAP1R1	73	43
CS(=O)(=O)NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872399308	FE	On-Demand	Anodyne	HRH4	19	44
COCCOCC(=O)NN=Cc1cccc(Cl)c1C	ZINC000872399314	CD	On-Demand	Reactive	ADCYAP1R1	73	33
COCCOCC(=O)NN=Cc1ccc2nccnc2c1	ZINC000872399317	CC	On-Demand	Reactive	PDE10A	19	40
COCCOCC(=O)NN=Cc1ccc2nccnc2c1	ZINC000872399317	CC	On-Demand	Reactive	ADCYAP1R1	57	32
Nc1nc(C(F)F)nc(N2CCC(CCc3ccccc3)CC2)n1	ZINC000872399318	EG	On-Demand	Anodyne	SLC18A2	44	38
Nc1nc(C(F)F)nc(N2CCC(CCc3ccccc3)CC2)n1	ZINC000872399318	EG	On-Demand	Anodyne	GRIN2B	17	41
COCCOCC(=O)NN=C1CCCCc2ccccc2C1	ZINC000872399321	DE	On-Demand	Reactive	ABAT	17	51
COCCOCC(=O)NN=Cc1cccc(F)c1I	ZINC000872399322	GD	On-Demand	Reactive	ABAT	20	44
Cc1c(F)ncnc1N1CCc2[nH]c3ccccc3c2C1	ZINC000872399335	CF	On-Demand	Anodyne	DRD5	18	43
COCCOCC(=O)NN=C(CCc1ccccc1)c1ccccn1	ZINC000872399338	EE	On-Demand	Reactive	FAAH	55	36
COCCOCC(=O)NN=C(CCc1ccccc1)c1ccccn1	ZINC000872399338	EE	On-Demand	Reactive	CES1	46	35
COCCS(=O)(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000872399339	DD	On-Demand	Mild	ITK	15	48
COc1ccc(OC)c2sc(N3CCC(C(=O)N4CCCC4)CC3)nc12	ZINC000872399353	GG	On-Demand	Anodyne	ADORA2B	15	41
COCCOCC(=O)NN=Cc1ccnc(F)c1	ZINC000872399374	CC	On-Demand	Reactive	ADCYAP1R1	59	32
COCCOCC(=O)NN=Cc1cccc(OC(C)(C)C)c1	ZINC000872399390	DD	On-Demand	Reactive	ADCYAP1R1	47	38
COCCOCC(=O)NN=Cc1cc(C)n(Cc2ccccc2)c1C	ZINC000872399394	EE	On-Demand	Reactive	PLA2G2A	52	36
Oc1nnc(Cl)cc1N1CCN(Cc2csc(-c3ccccc3)n2)CC1	ZINC000872399395	GG	On-Demand	Anodyne	DRD2	15	43
Oc1nnc(Cl)cc1N1CCN(Cc2csc(-c3ccccc3)n2)CC1	ZINC000872399395	GG	On-Demand	Anodyne	DRD3	15	44
COCCOCC(=O)NN=Cc1cc2cc(Br)ccc2o1	ZINC000872399408	FE	On-Demand	Reactive	PYK	22	40
COCCOCC(=O)NN=C(C)c1ccc(OC)cc1C	ZINC000872399415	CD	On-Demand	Reactive	MTNR1A	42	35
COCCOCC(=O)NN=Cc1ccc(C(=O)O)c(F)c1	ZINC000872399416	CC	On-Demand	Reactive	PDE10A	15	41
COCCOCC(=O)NN=Cc1ccc(C(=O)O)c(F)c1	ZINC000872399416	CC	On-Demand	Reactive	ADCYAP1R1	54	33
c1cnc2nccc(NCc3ccc(N4CCOCC4)nc3)c2c1	ZINC000872399421	DE	On-Demand	Anodyne	ADK	39	41
COCCOCC(=O)NN=Cc1cccc(F)c1OCC(F)(F)F	ZINC000872399423	FD	On-Demand	Reactive	ADCYAP1R1	49	33
COCCOCC(=O)NN=Cc1c(O)cc(C)cc1Cl	ZINC000872399424	DD	On-Demand	Reactive	ADCYAP1R1	59	33
COCCOCC(=O)NN=Cc1cc(Cl)c(C)cc1O	ZINC000872399434	DD	On-Demand	Reactive	GCGR	33	41
COCCOCC(=O)NN=Cc1cc(Cl)c(C)cc1O	ZINC000872399434	DD	On-Demand	Reactive	ADCYAP1R1	74	35
COCCOCC(=O)NN=Cc1cc(F)cc(OC)c1	ZINC000872399435	CC	On-Demand	Reactive	PDE10A	17	41
COCCOCC(=O)NN=Cc1cc(F)cc(OC)c1	ZINC000872399435	CC	On-Demand	Reactive	ADCYAP1R1	44	32
COCCOCC(=O)NN=C1CCN(C(=O)OCc2ccccc2)C1	ZINC000872399437	ED	On-Demand	Reactive	PREP	25	40
COCCOCC(=O)NN=C1CCN(C(=O)OCc2ccccc2)C1	ZINC000872399437	ED	On-Demand	Reactive	SLC12A5	61	39
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	HTR1A	83	41
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	DRD2	78	44
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	DRD1	26	44
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	DRD4	52	37
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	HTR2A	41	40
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	HTR2C	24	42
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	DRD3	80	42
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	HTR4	18	43
Oc1nnc(Cl)cc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000872399454	FF	On-Demand	Anodyne	HTR7	52	36
COCCOCC(=O)NN=Cc1ccc(O)nc1	ZINC000872399456	CB	On-Demand	Reactive	ADCYAP1R1	45	33
CC(C)(C)OC(=O)N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872399459	ED	On-Demand	Anodyne	GPR119	29	46
COCCOCC(=O)NN=C1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000872399485	EC	On-Demand	Reactive	PROKR1	57	31
Cc1c(F)ncnc1N1CCN([C@H](C)C(=O)NC2CC2)CC1	ZINC000872399490	DC	On-Demand	Anodyne	SIRT3	61	32
Cc1c(F)ncnc1N1CCN([C@H](C)C(=O)NC2CC2)CC1	ZINC000872399490	DC	On-Demand	Anodyne	SIRT2	45	31
Cc1c(F)ncnc1N1CCN([C@@H](C)C(=O)NC2CC2)CC1	ZINC000872399491	DC	On-Demand	Anodyne	SIRT3	61	32
Cc1c(F)ncnc1N1CCN([C@@H](C)C(=O)NC2CC2)CC1	ZINC000872399491	DC	On-Demand	Anodyne	SIRT2	45	31
COCCOCC(=O)NN=Cc1ccc(OC)c(Cn2cccn2)c1	ZINC000872399514	ED	On-Demand	Reactive	PDE10A	23	42
Oc1nnc(Cl)cc1N1CCC(CCc2ccccc2)CC1	ZINC000872399522	DH	On-Demand	Anodyne	ACHE	33	42
Oc1nnc(Cl)cc1N1CCC(CCc2ccccc2)CC1	ZINC000872399522	DH	On-Demand	Anodyne	SLC18A2	42	35
Oc1nnc(Cl)cc1N1CCC(CCc2ccccc2)CC1	ZINC000872399522	DH	On-Demand	Anodyne	GRIN2B	26	40
CCC(=NNC(=O)COCCOC)c1cccc(OC)c1OC	ZINC000872399529	DD	On-Demand	Reactive	KCNK3	43	38
COCCOCC(=O)NN=Cc1cnc2c(F)cccc2c1	ZINC000872399534	DD	On-Demand	Reactive	ADCYAP1R1	48	31
COCCOCC(=O)NN=Cc1cnc(Cl)c(F)c1	ZINC000872399546	CC	On-Demand	Reactive	ADCYAP1R1	60	33
CS(=O)(=O)NC1CCN(c2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872399560	FF	On-Demand	Anodyne	HRH4	24	40
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)nc1	ZINC000872399572	DD	On-Demand	Anodyne	ADK	40	37
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)nc1	ZINC000872399572	DD	On-Demand	Anodyne	STAT6	55	36
COCCOCC(=O)NN=Cc1ccc2ccccc2c1O	ZINC000872399581	DD	On-Demand	Reactive	GCGR	35	44
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872399630	EF	On-Demand	Anodyne	DRD2	20	41
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872399630	EF	On-Demand	Anodyne	DRD4	38	40
Oc1nnc(Cl)cc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872399630	EF	On-Demand	Anodyne	SIGMAR1	18	40
Nc1nc(C(F)F)nc(N2CCN(Cc3cccnc3)CC2)n1	ZINC000872399649	DD	On-Demand	Anodyne	DRD4	19	47
Cc1c(F)ncnc1N[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000872399672	DH	On-Demand	Anodyne	PIK3CD	19	43
Cc1c(F)ncnc1N[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000872399673	DH	On-Demand	Anodyne	PIK3CD	19	43
COCCOCC(=O)NN=C(C)c1ccc(Br)cn1	ZINC000872399679	ED	On-Demand	Reactive	PYK	46	33
COCCOCC(=O)NN=Cc1c(O)cccc1OC(F)(F)F	ZINC000872399681	ED	On-Demand	Reactive	GCGR	16	40
COCCOCC(=O)NN=Cc1c(O)cccc1OC(F)(F)F	ZINC000872399681	ED	On-Demand	Reactive	ADCYAP1R1	66	35
COCCOCC(=O)NN=C(C)c1ccc(O)c(Br)c1	ZINC000872399696	ED	On-Demand	Reactive	PYK	79	37
CCC(=O)c1c(Cl)cccc1NC1CCN(S(C)(=O)=O)CC1	ZINC000872399701	EF	On-Demand	Anodyne	EPHX2	37	40
c1cncc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872399706	CF	On-Demand	Anodyne	DRD2	15	58
c1cncc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872399706	CF	On-Demand	Anodyne	DRD4	30	58
c1cncc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872399706	CF	On-Demand	Anodyne	CHRNA7	33	40
COCCOCC(=O)NN=Cc1ccc(OC(F)(F)F)c(Br)c1	ZINC000872399707	GE	On-Demand	Reactive	PDE10A	21	42
COCCOCC(=O)NN=Cc1ccc(OC(F)(F)F)c(Br)c1	ZINC000872399707	GE	On-Demand	Reactive	ADCYAP1R1	49	36
COCCOCC(=O)NN=CC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872399720	GD	On-Demand	Reactive	P2RY12	46	35
COCCOCC(=O)NN=CC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872399720	GD	On-Demand	Reactive	GRIN2B	24	45
COCCOCC(=O)NN=CC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872399720	GD	On-Demand	Reactive	TGM2	41	43
COCCOCC(=O)NN=CC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872399720	GD	On-Demand	Reactive	F13A1	44	43
COCCOCC(=O)NN=C1CCc2ccccc2CC1	ZINC000872399723	CD	On-Demand	Reactive	ABAT	15	50
COCCOCC(=O)NN=Cc1cccc(I)c1	ZINC000872399783	FD	On-Demand	Reactive	ABAT	17	59
COCCOCC(=O)NN=Cc1cccc(I)c1	ZINC000872399783	FD	On-Demand	Reactive	ADCYAP1R1	60	33
FC(F)(F)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872399793	DF	On-Demand	Anodyne	DRD4	22	40
FC(F)(F)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872399793	DF	On-Demand	Anodyne	HPGDS	32	42
COCCOCC(=O)NN=Cc1cccc(NC(C)=O)c1	ZINC000872399796	CC	On-Demand	Reactive	ADCYAP1R1	49	32
COCCOCC(=O)NN=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872399817	ED	On-Demand	Reactive	L3MBTL3	47	34
Cc1c(F)ncnc1N1CCN(Cc2cccnc2)CC1	ZINC000872399818	CD	On-Demand	Anodyne	DRD4	27	51
Cc1c(F)ncnc1N1CCN(Cc2cccnc2)CC1	ZINC000872399818	CD	On-Demand	Anodyne	ABCC1	61	40
Cc1c(F)ncnc1N1CCN(Cc2cccnc2)CC1	ZINC000872399818	CD	On-Demand	Anodyne	ABCB1A	36	40
COCCOCC(=O)NN=Cc1cc2ccc(C)cc2[nH]1	ZINC000872399828	CD	On-Demand	Reactive	ITK	19	43
COCCOCC(=O)NN=C(C)c1cccc(CN(C)C)c1	ZINC000872399835	DD	On-Demand	Reactive	ABAT	19	40
COCCOCC(=O)NN=Cc1cccc(OC)c1F	ZINC000872399844	CC	On-Demand	Reactive	PDE10A	16	40
COCCOCC(=O)NN=Cc1cccc(OC)c1F	ZINC000872399844	CC	On-Demand	Reactive	ADCYAP1R1	50	33
CCOc1ccc([C@@H](C)Nc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872399864	DF	On-Demand	Anodyne	ACACB	20	45
Cn1ncc2c(N3CCC(NC(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872399870	FE	On-Demand	Anodyne	DRD4	17	40
Cn1ncc2c(N3CCC(NC(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872399870	FE	On-Demand	Anodyne	PIK3CA	19	40
Cn1ncc2c(N3CCC(NC(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872399870	FE	On-Demand	Anodyne	MTOR	40	35
COCCOCC(=O)NN=Cc1oc2ccccc2c1Br	ZINC000872399880	FE	On-Demand	Reactive	FAS	16	40
CCOc1ccc([C@@H](C)Nc2nc(N)nc(C(F)F)n2)cc1	ZINC000872399883	DF	On-Demand	Anodyne	HTR7	16	56
O=C(NC1CCN(c2nc(Cl)nc3sccc23)CC1)c1ccccc1	ZINC000872399892	FH	On-Demand	Anodyne	DRD4	18	41
COCCOCC(=O)NN=Cc1cccc(S(C)(=O)=O)c1	ZINC000872399923	DC	On-Demand	Reactive	ADCYAP1R1	54	33
COCCOCC(=O)NN=Cc1cc2ccccc2cc1OC	ZINC000872399935	DD	On-Demand	Reactive	GCGR	25	41
COCCOCC(=O)NN=Cc1cc2ccccc2cc1OC	ZINC000872399935	DD	On-Demand	Reactive	PDE10A	21	41
COCCOCC(=O)NN=Cc1cc2ccccc2cc1OC	ZINC000872399935	DD	On-Demand	Reactive	ADCYAP1R1	40	35
COCCOCC(=O)NN=C(C)Cn1cncn1	ZINC000872399941	CB	On-Demand	Reactive	HIS3	56	35
COCCOCC(=O)NN=Cc1ccc(C(F)(F)F)c(C)c1	ZINC000872399948	DE	On-Demand	Reactive	PDE10A	15	45
COCCOCC(=O)NN=Cc1ccc(C(F)(F)F)c(C)c1	ZINC000872399948	DE	On-Demand	Reactive	ADCYAP1R1	57	36
COCCOCC(=O)NN=Cc1cc2c(O)cccc2s1	ZINC000872399960	DD	On-Demand	Reactive	ADCYAP1R1	47	32
N#Cc1ccc(Cn2cc(NS(=O)(=O)C[C@@H]3CCCCO3)cn2)cc1	ZINC000872399964	FE	On-Demand	Mild	PANC	43	33
N#Cc1ccc(Cn2cc(NS(=O)(=O)C[C@H]3CCCCO3)cn2)cc1	ZINC000872399966	FE	On-Demand	Mild	PANC	43	33
Cc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1F	ZINC000872399968	CE	On-Demand	Anodyne	TPH1	25	43
COCCOCC(=O)NN=Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000872399973	ED	On-Demand	Reactive	ADCYAP1R1	63	35
COCCOCC(=O)NN=Cc1cccc(O)c1Cl	ZINC000872399992	CD	On-Demand	Reactive	GCGR	37	44
COCCOCC(=O)NN=Cc1cccc(O)c1Cl	ZINC000872399992	CD	On-Demand	Reactive	ADCYAP1R1	78	36
COCCOCC(=O)NN=Cc1cc2ccccc2[nH]1	ZINC000872400002	CD	On-Demand	Reactive	PYK	42	60
COCCOCC(=O)NN=C(C)c1c[nH]c2ccc(Br)cc2c1=O	ZINC000872400003	GD	On-Demand	Reactive	PYK	88	36
COCCOCC(=O)NN=C(C)c1ccc(Cl)c(N)c1	ZINC000872400004	CD	On-Demand	Reactive	ABAT	26	41
COCCOCC(=O)NN=Cc1ccc(C#N)c(OC)c1	ZINC000872400006	CC	On-Demand	Reactive	GCGR	18	44
COCCOCC(=O)NN=Cc1ccc(C#N)c(OC)c1	ZINC000872400006	CC	On-Demand	Reactive	PDE10A	25	54
COCCOCC(=O)NN=Cc1ccc(C#N)c(OC)c1	ZINC000872400006	CC	On-Demand	Reactive	ADCYAP1R1	50	38
O=C(c1ccccc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872400010	DF	On-Demand	Anodyne	SLC18A3	41	45
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872400011	EH	On-Demand	Anodyne	HTR1D	18	43
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872400011	EH	On-Demand	Anodyne	HTR1B	15	43
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872400011	EH	On-Demand	Anodyne	CCR2	27	43
COCCOCC(=O)NN=Cc1sc2c(Cl)cccc2c1C	ZINC000872400018	EF	On-Demand	Reactive	ADCYAP1R1	63	33
COCCOCC(=O)NN=C(C)c1cccc(N2CCC2=O)c1	ZINC000872400031	DC	On-Demand	Reactive	DRD4	40	31
COCCOCC(=O)NN=Cc1ccc2cnccc2c1	ZINC000872400039	CD	On-Demand	Reactive	PDE10A	18	42
COCCOCC(=O)NN=Cc1cc(Cl)c(F)cc1O	ZINC000872400042	DD	On-Demand	Reactive	GCGR	34	40
COCCOCC(=O)NN=Cc1cc(Cl)c(F)cc1O	ZINC000872400042	DD	On-Demand	Reactive	ADCYAP1R1	70	33
CCC(=NNC(=O)COCCOC)c1cccc(C)c1	ZINC000872400055	CD	On-Demand	Reactive	KCNK3	66	42
CCC(=NNC(=O)COCCOC)c1cccc(C)c1	ZINC000872400055	CD	On-Demand	Reactive	KCNK9	48	42
COCCOCC(=O)NN=Cc1cn(CC(=O)OC)c2ccccc12	ZINC000872400062	EC	On-Demand	Reactive	GCGR	16	45
COCCOCC(=O)NN=Cc1cc(OC)c2ccccc2c1	ZINC000872400071	DD	On-Demand	Reactive	GCGR	18	43
COCCOCC(=O)NN=Cc1cc(OC)c2ccccc2c1	ZINC000872400071	DD	On-Demand	Reactive	PDE10A	31	53
COCCOCC(=O)NN=Cc1cc(OC)c2ccccc2c1	ZINC000872400071	DD	On-Demand	Reactive	ADCYAP1R1	49	46
COCCOCC(=O)NN=Cc1cc(C)cc(Cl)c1	ZINC000872400089	CD	On-Demand	Reactive	ADCYAP1R1	41	34
Cn1ncc2c(N3CCN(Cc4cccnc4)CC3)nc(Cl)nc21	ZINC000872400093	ED	On-Demand	Anodyne	DRD4	20	49
c1ccc(-c2cc(NCc3ccc(N4CCOCC4)nc3)ncn2)cc1	ZINC000872400096	EF	On-Demand	Anodyne	ADK	55	47
c1ccc(-c2cc(NCc3ccc(N4CCOCC4)nc3)ncn2)cc1	ZINC000872400096	EF	On-Demand	Anodyne	PIK3CA	18	43
c1ccc(-c2cc(NCc3ccc(N4CCOCC4)nc3)ncn2)cc1	ZINC000872400096	EF	On-Demand	Anodyne	DGAT1	18	40
Cc1c(F)ncnc1N[C@H](C)c1ccc2c(c1)OCO2	ZINC000872400107	CF	On-Demand	Anodyne	CLK4	47	37
Cc1c(F)ncnc1N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000872400109	CF	On-Demand	Anodyne	CLK4	47	37
Nc1nc(C(F)F)nc(N2CCN(CCOc3ccccc3Cl)CC2)n1	ZINC000872400126	GE	On-Demand	Anodyne	DRD2	17	40
Nc1nc(C(F)F)nc(N2CCC(NC(=O)c3ccccc3)CC2)n1	ZINC000872400130	ED	On-Demand	Anodyne	DRD4	18	41
Nc1nc(C(F)F)nc(N2CCC(NC(=O)c3ccccc3)CC2)n1	ZINC000872400130	ED	On-Demand	Anodyne	MCHR1	16	43
COCCOCC(=O)NN=Cc1ccnn1-c1ccccc1OC	ZINC000872400136	EC	On-Demand	Reactive	PDE10A	21	41
O=C(C1CCN(c2ccnc3ncccc23)CC1)N1CCCC1	ZINC000872400144	DE	On-Demand	Anodyne	PREP	40	36
COCCOCC(=O)NN=C(C)CCCc1cccnc1	ZINC000872400169	CD	On-Demand	Reactive	TBXAS1	30	43
COCCOCC(=O)NN=Cc1cc(OC)cc(C(F)(F)F)c1	ZINC000872400199	ED	On-Demand	Reactive	ADCYAP1R1	60	39
COCCOCC(=O)NN=Cc1ccnc(C)c1	ZINC000872400207	CC	On-Demand	Reactive	ADCYAP1R1	54	32
Nc1nc(C(F)F)nc(N2CCCN(Cc3ccc(F)cc3)CC2)n1	ZINC000872400218	FE	On-Demand	Anodyne	DRD4	21	41
COCCOCC(=O)NN=Cc1ccc(C)cc1O	ZINC000872400234	CC	On-Demand	Reactive	GCGR	30	40
CC(C)(C)OC(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872400245	DD	On-Demand	Anodyne	GPR119	43	42
N#Cc1ccc(Cn2cc(NS(=O)(=O)C[C@@H]3CCCO3)cn2)cc1	ZINC000872400247	ED	On-Demand	Mild	PANC	44	34
N#Cc1ccc(Cn2cc(NS(=O)(=O)C[C@H]3CCCO3)cn2)cc1	ZINC000872400249	ED	On-Demand	Mild	PANC	44	34
COCCOCC(=O)NN=Cc1ccnc(O)c1	ZINC000872400251	CB	On-Demand	Reactive	ADCYAP1R1	61	34
COCCOCC(=O)NN=Cc1cccc(CC2CCC2)c1	ZINC000872400276	DE	On-Demand	Reactive	ADCYAP1R1	51	35
Cc1c(F)ncnc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872400284	DF	On-Demand	Anodyne	DRD4	29	40
Cc1c(F)ncnc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872400284	DF	On-Demand	Anodyne	ABCC1	72	35
Cc1c(F)ncnc1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000872400284	DF	On-Demand	Anodyne	RPS6KB1	52	32
COCCOCC(=O)NN=Cc1ccc2c(c1)OCCCCO2	ZINC000872400285	DD	On-Demand	Reactive	PDE10A	18	50
COCCOCC(=O)NN=Cc1cccc(Cl)c1Br	ZINC000872400293	EE	On-Demand	Reactive	ADCYAP1R1	67	33
Cn1ncc2c(N3CCN(C(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872400295	FE	On-Demand	Anodyne	MTOR	20	42
Cn1ncc2c(N3CCN(C(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872400295	FE	On-Demand	Anodyne	GPR119	26	40
COCCOCC(=O)NN=Cc1ccc(C)cc1Cl	ZINC000872400299	CD	On-Demand	Reactive	GCGR	33	42
COCCOCC(=O)NN=Cc1ccc(C)cc1Cl	ZINC000872400299	CD	On-Demand	Reactive	ADCYAP1R1	44	32
Cc1c(F)ncnc1N1CCC(C(=O)c2ccccc2)CC1	ZINC000872400332	CG	On-Demand	Anodyne	SLC18A3	47	42
Cc1c(F)ncnc1N1CCC(C(=O)c2ccccc2)CC1	ZINC000872400332	CG	On-Demand	Anodyne	LIMK2	21	46
CCC(=NNC(=O)COCCOC)c1ccc(OC(F)(F)F)cc1	ZINC000872400336	EE	On-Demand	Reactive	SHH	45	36
NC(=O)CN1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872400337	EE	On-Demand	Anodyne	PRKD1	45	36
NC(=O)CN1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872400337	EE	On-Demand	Anodyne	GRM5	15	41
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872400354	ED	On-Demand	Reactive	GCGR	26	44
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1Cl	ZINC000872400354	ED	On-Demand	Reactive	ADCYAP1R1	49	37
Nc1nc(C(F)F)nc(N2CCCN(Cc3ccc(Cl)cc3)CC2)n1	ZINC000872400357	FF	On-Demand	Anodyne	DRD4	34	41
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872400361	EE	On-Demand	Anodyne	DRD2	15	45
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872400361	EE	On-Demand	Anodyne	DRD4	28	43
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872400361	EE	On-Demand	Anodyne	SSTR5	40	37
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872400361	EE	On-Demand	Anodyne	MAPK13	45	35
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872400361	EE	On-Demand	Anodyne	MCHR1	17	45
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	DRD4	24	43
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	DRD3	17	42
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	SSTR5	42	38
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	CHRNA7	22	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	SMO	17	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872400365	EG	On-Demand	Anodyne	HPGDS	41	44
C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872400367	CG	On-Demand	Anodyne	STK3	17	45
Cc1c(F)ncnc1N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000872400368	FD	On-Demand	Anodyne	SORD	22	42
COCCOCC(=O)NN=Cc1ccc(C#N)cc1C(F)(F)F	ZINC000872400371	ED	On-Demand	Reactive	GCGR	17	41
COCCOCC(=O)NN=Cc1ccc(Br)cc1O	ZINC000872400384	ED	On-Demand	Reactive	PYK	49	37
COCCOCC(=O)NN=Cc1cccc(F)c1OC(F)(F)F	ZINC000872400411	ED	On-Demand	Reactive	GCGR	22	41
COCCOCC(=O)NN=Cc1cccc(F)c1OC(F)(F)F	ZINC000872400411	ED	On-Demand	Reactive	ADCYAP1R1	53	33
COCCOCC(=O)NN=Cc1cccnc1Cl	ZINC000872400424	CC	On-Demand	Reactive	ADCYAP1R1	42	32
COCCOCC(=O)NN=Cc1cnn(-c2ccc(OC)cc2)c1	ZINC000872400468	EC	On-Demand	Reactive	PDE10A	16	41
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)ccc1Br	ZINC000872400484	GF	On-Demand	Reactive	ADCYAP1R1	43	36
COCCOCC(=O)NN=Cc1ccc(OC)c(OC2CC2)c1	ZINC000872400492	DD	On-Demand	Reactive	PDE4A	27	43
COCCOCC(=O)NN=Cc1ccc(OC)c(OC2CC2)c1	ZINC000872400492	DD	On-Demand	Reactive	PDE4B	17	43
COCCOCC(=O)NN=Cc1ccc(OC)c(OC2CC2)c1	ZINC000872400492	DD	On-Demand	Reactive	PDE4D	20	46
COCCOCC(=O)NN=Cc1ccc(OC)c(OC2CC2)c1	ZINC000872400492	DD	On-Demand	Reactive	PDE4C	19	43
COCCOCC(=O)NN=Cc1ccc(OC)c(OC2CC2)c1	ZINC000872400492	DD	On-Demand	Reactive	PDE10A	26	45
COCCOCC(=O)NN=Cc1ccc(N2CCCCC2)c(Br)c1	ZINC000872400499	GF	On-Demand	Reactive	PDE10A	18	41
Oc1nnc(Cl)cc1N1CCN(Cc2cccnc2)CC1	ZINC000872400506	DD	On-Demand	Anodyne	DRD2	18	60
Oc1nnc(Cl)cc1N1CCN(Cc2cccnc2)CC1	ZINC000872400506	DD	On-Demand	Anodyne	DRD4	39	60
COCCOCC(=O)NN=Cc1csc(C(F)(F)F)c1	ZINC000872400508	DD	On-Demand	Reactive	ADCYAP1R1	67	36
COCCOCC(=O)NN=Cc1ccc(CO)cc1	ZINC000872400510	CC	On-Demand	Reactive	ADCYAP1R1	45	34
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	DRD2	20	50
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	CYP11B1	22	43
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	DRD4	42	50
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	DRD3	18	50
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	AKT2	36	40
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	CYP11B2	20	43
c1ccc(-c2cc(N3CCN(Cc4cccnc4)CC3)ncn2)cc1	ZINC000872400514	EF	On-Demand	Anodyne	CLK4	15	44
NC(=O)c1cc(N2CCN(Cc3cccnc3)CC2)nc(Cl)n1	ZINC000872400522	EC	On-Demand	Anodyne	DRD4	19	49
COCCOCC(=O)NN=Cc1cc(Cl)ccc1I	ZINC000872400529	GE	On-Demand	Reactive	ABAT	20	42
COCCOCC(=O)NN=Cc1cc(OC)c(Br)cc1F	ZINC000872400540	FD	On-Demand	Reactive	PDE10A	16	43
c1cncc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872400544	DE	On-Demand	Anodyne	HTR1A	15	43
c1cncc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872400544	DE	On-Demand	Anodyne	DRD2	18	58
c1cncc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872400544	DE	On-Demand	Anodyne	DRD4	35	58
c1cncc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872400544	DE	On-Demand	Anodyne	DRD3	16	58
COCCOCC(=O)NN=C1CCCc2ccccc2C1	ZINC000872400559	CD	On-Demand	Reactive	ABAT	17	51
COCCOCC(=O)NN=C(C)c1cc(-c2ccccc2)nn1C	ZINC000872400595	ED	On-Demand	Reactive	CTSV	40	32
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1F	ZINC000872400601	DC	On-Demand	Reactive	PDE10A	15	50
COCCOCC(=O)NN=Cc1ccc(C)cc1OC	ZINC000872400604	CD	On-Demand	Reactive	GCGR	18	40
COCCOCC(=O)NN=Cc1ccc(C)cc1OC	ZINC000872400604	CD	On-Demand	Reactive	PDE10A	24	41
COCCOCC(=O)NN=Cc1ccccc1OCc1ccc(F)cc1F	ZINC000872400608	GF	On-Demand	Reactive	GCGR	30	42
COCCOCC(=O)NN=Cc1ccccc1OCc1ccc(F)cc1F	ZINC000872400608	GF	On-Demand	Reactive	ADCYAP1R1	59	35
COCCOCC(=O)NN=Cc1cccc(C(C)C)c1	ZINC000872400609	CD	On-Demand	Reactive	PDE10A	24	42
COCCOCC(=O)NN=Cc1cccc(C(C)C)c1	ZINC000872400609	CD	On-Demand	Reactive	ADCYAP1R1	62	38
COCCOCC(=O)NN=Cc1ccc(F)c2ccccc12	ZINC000872400612	DE	On-Demand	Reactive	GCGR	33	47
CC(C)(C)OC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872400622	DF	On-Demand	Anodyne	GPR119	50	51
COCCOCC(=O)NN=Cc1ccc(C#N)c(F)c1	ZINC000872400628	CC	On-Demand	Reactive	ADCYAP1R1	62	32
COCCOCC(=O)NN=Cc1cnc(-c2ccccc2OC)nc1	ZINC000872400632	ED	On-Demand	Reactive	PDE10A	24	43
COCCOCC(=O)NN=Cc1cnc(-c2ccccc2OC)nc1	ZINC000872400632	ED	On-Demand	Reactive	ADCYAP1R1	66	41
COCCOCC(=O)NN=C(C)c1cc(F)c(Br)cc1F	ZINC000872400646	FE	On-Demand	Reactive	PYK	40	33
COCCOCC(=O)NN=Cc1ccccc1Sc1cccc(OC)c1	ZINC000872400655	FF	On-Demand	Reactive	MTNR1A	21	42
COCCOCC(=O)NN=Cc1ccccc1Sc1cccc(OC)c1	ZINC000872400655	FF	On-Demand	Reactive	MTNR1B	25	42
COCCOCC(=O)NN=Cc1ccnn1CCc1ccccc1	ZINC000872400660	ED	On-Demand	Reactive	FAS	28	40
NC(=O)c1cc(N2CCC(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872400670	EE	On-Demand	Anodyne	SLC18A3	35	40
NC(=O)c1cc(N2CCC(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872400670	EE	On-Demand	Anodyne	SCD1	25	43
COCCOCC(=O)NN=Cc1ccc(C#N)c(C)c1	ZINC000872400674	CC	On-Demand	Reactive	PDE10A	15	44
COCCOCC(=O)NN=C(C)c1cccc(C(C)C)c1	ZINC000872400686	CE	On-Demand	Reactive	ABAT	20	41
CCC(Cn1cncn1)=NNC(=O)COCCOC	ZINC000872400688	CB	On-Demand	Reactive	HIS3	76	35
COCCOCC(=O)NN=C(C)c1cn(-c2ccccc2)nn1	ZINC000872400692	DC	On-Demand	Reactive	ESRRA	23	42
COCCOCC(=O)NN=C(C)Cc1ccc(F)cc1Cl	ZINC000872400693	DE	On-Demand	Reactive	P2RX7	44	42
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1C	ZINC000872400698	DD	On-Demand	Reactive	GCGR	18	43
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1C	ZINC000872400698	DD	On-Demand	Reactive	PDE10A	17	40
COCCOCC(=O)NN=C(C)c1cc(Br)cc(OC)c1O	ZINC000872400699	GD	On-Demand	Reactive	PYK	91	40
Cc1c(F)ncnc1NCc1ccc(N2CCOCC2)nc1	ZINC000872400700	DD	On-Demand	Anodyne	ADK	45	42
Cc1c(F)ncnc1NCc1ccc(N2CCOCC2)nc1	ZINC000872400700	DD	On-Demand	Anodyne	STAT6	49	35
O=C(c1ccccc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872400705	DI	On-Demand	Anodyne	SLC18A3	45	47
COCCOCC(=O)NN=C(C)c1ccc(Cl)cc1O	ZINC000872400724	DD	On-Demand	Reactive	ABAT	20	40
COCCOCC(=O)NN=C(C)c1ccc(Cl)cc1O	ZINC000872400724	DD	On-Demand	Reactive	PYK	51	40
COCCOCC(=O)NN=C(C)c1cc(Br)ccc1C	ZINC000872400734	EE	On-Demand	Reactive	PYK	108	42
COCCOCC(=O)NN=Cc1ccc(OC)cc1Br	ZINC000872400742	ED	On-Demand	Reactive	PDE10A	15	41
Nc1nc(C(F)F)nc(N2CCC(C(=O)c3ccccc3)CC2)n1	ZINC000872400760	EE	On-Demand	Anodyne	SLC18A3	37	40
Oc1nnc(Cl)cc1Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1	ZINC000872400771	GI	On-Demand	Anodyne	TNK2	45	35
Oc1nnc(Cl)cc1Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1	ZINC000872400772	GI	On-Demand	Anodyne	TNK2	45	35
COCCOCC(=O)NN=C(C)c1cccc(CO)c1	ZINC000872400777	CC	On-Demand	Reactive	ABAT	20	42
COCCOCC(=O)NN=C(C)Cc1ccc(F)cc1	ZINC000872400778	CD	On-Demand	Reactive	PPO2	21	41
COCCOCC(=O)NN=Cc1cc(F)ccc1OC	ZINC000872400805	CC	On-Demand	Reactive	GCGR	21	41
COc1ccc(OC)c2sc(NC3CCN(CC(N)=O)CC3)nc12	ZINC000872400825	FD	On-Demand	Anodyne	HTR4	43	36
COc1ccc(OC)c2sc(NC3CCN(CC(N)=O)CC3)nc12	ZINC000872400825	FD	On-Demand	Anodyne	SSTR5	46	46
COCCOCC(=O)NN=C/C(C)=C\c1cccc(C(F)(F)F)c1	ZINC000872400840	EF	On-Demand	Reactive	ADCYAP1R1	44	36
COCCOCC(=O)NN=C/C(C)=C/c1cccc(C(F)(F)F)c1	ZINC000872400841	EF	On-Demand	Reactive	ADCYAP1R1	44	36
COCCOCC(=O)NN=Cc1c[nH]nc1-c1cccc(OC)c1	ZINC000872400845	ED	On-Demand	Reactive	ROCK2	40	35
COCCOCC(=O)NN=C(C)c1cccc(C2CC2)c1	ZINC000872400852	CE	On-Demand	Reactive	ABAT	19	40
CCC(=NNC(=O)COCCOC)c1cccc(N)c1	ZINC000872400853	CD	On-Demand	Reactive	ABAT	32	41
COCCOCC(=O)NN=Cc1cccc(C(=O)O)c1	ZINC000872400860	CC	On-Demand	Reactive	ABAT	18	41
COCCOCC(=O)NN=Cc1cccc(C(=O)O)c1	ZINC000872400860	CC	On-Demand	Reactive	AOC1	15	43
COCCOCC(=O)NN=Cc1cccc(C(=O)O)c1	ZINC000872400860	CC	On-Demand	Reactive	AMD1	19	43
COCCOCC(=O)NN=Cc1cccc(C(=O)O)c1	ZINC000872400860	CC	On-Demand	Reactive	AKR1C3	25	40
COCCOCC(=O)NN=Cc1cccc(C(=O)O)c1	ZINC000872400860	CC	On-Demand	Reactive	ADCYAP1R1	69	36
COCCOCC(=O)NN=C(COC)c1cccc(Cl)c1	ZINC000872400865	DD	On-Demand	Reactive	ABAT	22	45
COCCOCC(=O)NN=C(COC)c1cccc(Cl)c1	ZINC000872400865	DD	On-Demand	Reactive	KCNK3	23	40
COCCOCC(=O)NN=Cc1cc(O)cc(C(F)(F)F)c1	ZINC000872400879	DD	On-Demand	Reactive	ADCYAP1R1	74	42
CCC(=NNC(=O)COCCOC)c1ccc(C#N)cc1	ZINC000872400901	CD	On-Demand	Reactive	CTRB_BOVIN	47	35
NC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872400907	DD	On-Demand	Anodyne	PTPN2	41	32
NC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872400907	DD	On-Demand	Anodyne	SIGMAR1	16	40
NC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872400907	DD	On-Demand	Anodyne	PRKD1	49	36
NC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872400907	DD	On-Demand	Anodyne	HPGDS	28	42
NC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872400907	DD	On-Demand	Anodyne	VCP	44	35
COCCOCC(=O)NN=Cc1ccc(C)c(OC)c1	ZINC000872400908	CD	On-Demand	Reactive	PDE10A	28	53
COCCOCC(=O)NN=Cc1ccc(C)c(OC)c1	ZINC000872400908	CD	On-Demand	Reactive	ADCYAP1R1	46	39
COCCOCC(=O)NN=Cc1nc2ccc(Br)cc2s1	ZINC000872400910	FE	On-Demand	Reactive	CSNK1D	23	42
O=C(c1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872400919	DH	On-Demand	Anodyne	METAP1	40	33
O=C(c1ccccc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872400919	DH	On-Demand	Anodyne	SLC18A3	44	45
Cc1c(F)ncnc1N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000872400932	DH	On-Demand	Anodyne	HTR1F	56	37
COCCOCC(=O)NN=Cc1cc(C(=O)OC)ccc1Cl	ZINC000872400935	ED	On-Demand	Reactive	GCGR	38	42
COCCOCC(=O)NN=Cc1cc(C(=O)OC)ccc1Cl	ZINC000872400935	ED	On-Demand	Reactive	ADCYAP1R1	78	36
COCCOCC(=O)NN=Cc1ccc(C)c(Cl)c1	ZINC000872400939	CD	On-Demand	Reactive	PDE10A	17	42
COCCOCC(=O)NN=Cc1ccc(C)c(Cl)c1	ZINC000872400939	CD	On-Demand	Reactive	ADCYAP1R1	66	38
CCOc1ccc(C=NNC(=O)COCCOC)cc1F	ZINC000872400951	CD	On-Demand	Reactive	PDE10A	18	45
CCOc1ccc(C=NNC(=O)COCCOC)cc1F	ZINC000872400951	CD	On-Demand	Reactive	ADCYAP1R1	59	35
COCCOCC(=O)NN=C(C)Cc1ccc(Br)cc1	ZINC000872400961	EE	On-Demand	Reactive	PPO2	25	42
COCCOCC(=O)NN=C(C)c1ccc(Cl)c(F)c1	ZINC000872400967	DD	On-Demand	Reactive	ABAT	20	41
COCCOCC(=O)NN=Cc1cc(C)c2ncccc2c1	ZINC000872400972	DD	On-Demand	Reactive	PDE10A	20	49
COCCOCC(=O)NN=Cc1ccc(Cl)cc1F	ZINC000872400979	CD	On-Demand	Reactive	ADCYAP1R1	42	30
COc1ccc(OC)c2sc(NC3CCN(C(=O)c4ccco4)CC3)nc12	ZINC000872400996	GH	On-Demand	Anodyne	ADORA2B	18	40
COCCOCC(=O)NN=Cc1cc(C)nc(Cl)c1	ZINC000872401001	CD	On-Demand	Reactive	PDE10A	16	41
COCCOCC(=O)NN=Cc1cc(C)nc(Cl)c1	ZINC000872401001	CD	On-Demand	Reactive	ADCYAP1R1	41	34
COCCOCC(=O)NN=Cc1nc2ccc(OC)cc2s1	ZINC000872401002	DD	On-Demand	Reactive	CA2	18	41
COCCOCC(=O)NN=Cc1nc2ccc(OC)cc2s1	ZINC000872401002	DD	On-Demand	Reactive	CSNK1D	33	47
NC(=O)[C@H](c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872401006	EE	On-Demand	Anodyne	NPY2R	75	41
NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872401007	EE	On-Demand	Anodyne	NPY2R	75	41
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	HTR1A	55	45
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	DRD2	45	47
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	DRD4	43	39
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	HTR2A	25	44
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	DRD3	43	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	HTR7	49	47
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	SLC27A1	49	39
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NCc1ccccc1	ZINC000872401012	FE	On-Demand	Anodyne	SUCNR1	33	41
COCCOCC(=O)NN=Cc1ccc(Cl)cc1C	ZINC000872401027	CD	On-Demand	Reactive	GCGR	26	40
Cn1ncc2c(N3CCN(CC(=O)NCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401039	GD	On-Demand	Anodyne	HTR1A	28	40
Cn1ncc2c(N3CCN(CC(=O)NCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401039	GD	On-Demand	Anodyne	DRD2	23	42
Cn1ncc2c(N3CCN(CC(=O)NCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401039	GD	On-Demand	Anodyne	DRD3	20	42
Cn1ncc2c(N3CCN(CC(=O)NCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401039	GD	On-Demand	Anodyne	HTR7	35	40
COCCOCC(=O)NN=C(C)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872401055	GD	On-Demand	Reactive	SLC12A5	42	35
COCCOCC(=O)NN=C(C)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	ZINC000872401056	GD	On-Demand	Reactive	SLC12A5	42	35
Cn1ncc2c(NC3CCN(CC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401061	GF	On-Demand	Anodyne	DRD4	18	41
CCCOc1ccc2[nH]cc(C=NNC(=O)COCCOC)c2c1	ZINC000872401066	EE	On-Demand	Reactive	HTR1D	17	53
COCc1cc(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)ccc1OC	ZINC000872401074	GH	On-Demand	Anodyne	HTR6	23	42
O=C(CN1CCOCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872401075	FD	On-Demand	Anodyne	PIK3CA	15	42
COCCOCC(=O)NN=Cc1c(OC)cccc1OC	ZINC000872401079	CC	On-Demand	Reactive	PDE10A	19	42
COCCOCC(=O)NN=Cc1c(OC)cccc1OC	ZINC000872401079	CC	On-Demand	Reactive	ADCYAP1R1	42	36
COCCOCC(=O)NN=Cc1cnn(Cc2ccc(C(F)(F)F)cc2)c1	ZINC000872401083	GE	On-Demand	Reactive	ADCYAP1R1	43	40
COCCOCC(=O)NN=Cc1ccc(-c2ccccc2)cc1OC	ZINC000872401089	EE	On-Demand	Reactive	GCGR	25	41
COCCOCC(=O)NN=Cc1ccc(-c2ccccc2)cc1OC	ZINC000872401089	EE	On-Demand	Reactive	PDE10A	19	48
Cc1c(F)ncnc1NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401092	EE	On-Demand	Anodyne	DRD4	21	50
COCCOCC(=O)NN=Cc1c(Cl)cccc1N1CCCC1	ZINC000872401099	EE	On-Demand	Reactive	HTR2A	15	41
COCCOCC(=O)NN=Cc1c(Cl)cccc1N1CCCC1	ZINC000872401099	EE	On-Demand	Reactive	HTR2C	18	41
COCCOCC(=O)NN=Cc1c(Cl)cccc1N1CCCC1	ZINC000872401099	EE	On-Demand	Reactive	DRD3	45	37
COCCOCC(=O)NN=Cc1c(Cl)cccc1N1CCCC1	ZINC000872401099	EE	On-Demand	Reactive	KCNQ2	67	42
COCCOCC(=O)NN=Cc1cc(F)ccc1O	ZINC000872401101	CC	On-Demand	Reactive	GCGR	41	42
COCCOCC(=O)NN=Cc1cc(F)ccc1O	ZINC000872401101	CC	On-Demand	Reactive	ADCYAP1R1	78	34
COCCOCC(=O)NN=Cc1cccc(OCc2ccc(F)cc2)c1	ZINC000872401102	FF	On-Demand	Reactive	ADCYAP1R1	76	48
COCCOCC(=O)NN=Cc1cc(Cl)c2ccccc2c1O	ZINC000872401105	EE	On-Demand	Reactive	GCGR	43	48
COCCOCC(=O)NN=Cc1cc(Cl)c2ccccc2c1O	ZINC000872401105	EE	On-Demand	Reactive	ADCYAP1R1	78	38
COCc1cc(NS(=O)(=O)c2cccc(F)c2OC)ccc1OC	ZINC000872401122	FF	On-Demand	Anodyne	HTR6	15	51
NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872401136	ED	On-Demand	Anodyne	NPY2R	66	38
NC(=O)[C@H](c1ccccc1)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872401137	ED	On-Demand	Anodyne	NPY2R	66	38
O=C(c1ccco1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872401145	EG	On-Demand	Anodyne	PRKD1	50	32
COCCOCC(=O)NN=C(C)c1ccc(O)c(Cl)c1	ZINC000872401158	DD	On-Demand	Reactive	GCGR	34	44
COCCOCC(=O)NN=C(C)c1ccc(O)c(Cl)c1	ZINC000872401158	DD	On-Demand	Reactive	ADCYAP1R1	81	40
COCCOCC(=O)NN=C(C)c1ccc(OC)cc1Br	ZINC000872401163	FD	On-Demand	Reactive	PYK	80	45
COCCOCC(=O)NN=Cc1c(O)cccc1Cl	ZINC000872401165	CD	On-Demand	Reactive	GCGR	30	40
COCCOCC(=O)NN=Cc1c(O)cccc1Cl	ZINC000872401165	CD	On-Demand	Reactive	ADCYAP1R1	74	36
CCSc1cccc(C=NNC(=O)COCCOC)c1	ZINC000872401166	CD	On-Demand	Reactive	PDE10A	19	40
CCSc1cccc(C=NNC(=O)COCCOC)c1	ZINC000872401166	CD	On-Demand	Reactive	ADCYAP1R1	44	32
COCCOCC(=O)NN=Cc1c[nH]nc1-c1cccc(Cl)c1	ZINC000872401175	ED	On-Demand	Reactive	MAPK1	17	41
O=C(c1ccco1)N1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401194	GI	On-Demand	Anodyne	PRKD1	46	32
NC(=O)[C@H](c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872401203	ED	On-Demand	Anodyne	NPY2R	89	40
NC(=O)[C@@H](c1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872401204	ED	On-Demand	Anodyne	NPY2R	89	40
Cc1c(F)ncnc1NCc1ccccc1S(=O)(=O)N(C)C	ZINC000872401208	DD	On-Demand	Anodyne	PTK2	43	37
O=C(N1CCCC1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872401209	DD	On-Demand	Anodyne	AKR1C3	15	42
COCCOCC(=O)NN=Cc1ccc(F)c(C(F)(F)F)c1	ZINC000872401214	DD	On-Demand	Reactive	ADCYAP1R1	47	35
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(Br)c1	ZINC000872401223	GE	On-Demand	Reactive	PDE10A	24	44
COCCOCC(=O)NN=Cc1cc(-c2ccncc2)ccc1OC	ZINC000872401227	ED	On-Demand	Reactive	PDE10A	16	43
COCCOCC(=O)NN=Cc1ccc2nc(C)ccc2c1	ZINC000872401229	DD	On-Demand	Reactive	PDE10A	17	43
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)NCc1ccccc1	ZINC000872401242	FD	On-Demand	Anodyne	HTR1A	37	46
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)NCc1ccccc1	ZINC000872401242	FD	On-Demand	Anodyne	DRD2	44	46
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)NCc1ccccc1	ZINC000872401242	FD	On-Demand	Anodyne	DRD4	45	41
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)NCc1ccccc1	ZINC000872401242	FD	On-Demand	Anodyne	DRD3	51	39
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)NCc1ccccc1	ZINC000872401242	FD	On-Demand	Anodyne	HTR7	47	46
COCCOCC(=O)NN=C(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872401251	ED	On-Demand	Reactive	DRD4	40	41
COCCOCC(=O)NN=C(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872401251	ED	On-Demand	Reactive	SLC6A1	45	33
COCCOCC(=O)NN=C(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872401251	ED	On-Demand	Reactive	SIGMAR1	42	45
COCCOCC(=O)NN=C(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872401251	ED	On-Demand	Reactive	SLC18A3	19	41
COCCOCC(=O)NN=C(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872401251	ED	On-Demand	Reactive	CACNA1G	31	40
COCCOCC(=O)NN=C(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872401252	ED	On-Demand	Reactive	DRD4	40	41
COCCOCC(=O)NN=C(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872401252	ED	On-Demand	Reactive	SLC6A1	45	33
COCCOCC(=O)NN=C(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872401252	ED	On-Demand	Reactive	SIGMAR1	42	45
COCCOCC(=O)NN=C(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872401252	ED	On-Demand	Reactive	SLC18A3	19	41
COCCOCC(=O)NN=C(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872401252	ED	On-Demand	Reactive	CACNA1G	31	40
C#CCOc1cccc(Cl)c1C=NNC(=O)COCCOC	ZINC000872401258	DD	On-Demand	Reactive	ADCYAP1R1	60	34
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1Br	ZINC000872401265	FD	On-Demand	Reactive	GCGR	18	40
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1Br	ZINC000872401265	FD	On-Demand	Reactive	PDE10A	20	41
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	HTR1A	30	42
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	DRD2	23	42
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	PDGFRB	26	42
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	HTR7	38	42
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	AKT2	15	40
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	ABCC1	59	33
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	AKT1	18	40
Cc1c(F)ncnc1N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000872401279	ED	On-Demand	Anodyne	SLC27A1	54	35
COCCOCC(=O)NN=Cc1ccc(C(=O)O)cc1Cl	ZINC000872401282	DD	On-Demand	Reactive	GCGR	42	47
COCCOCC(=O)NN=Cc1ccc(C(=O)O)cc1Cl	ZINC000872401282	DD	On-Demand	Reactive	ADCYAP1R1	78	39
COCCOCC(=O)NN=C(C)c1cc(Br)cc(C)c1O	ZINC000872401302	FD	On-Demand	Reactive	PYK	84	38
COCCOCC(=O)NN=C(C)c1cc(Br)cc(F)c1O	ZINC000872401303	FD	On-Demand	Reactive	PYK	85	40
COCCOCC(=O)NN=Cc1ccc(Cl)c(Br)c1	ZINC000872401304	EE	On-Demand	Reactive	ADCYAP1R1	64	36
O=C(CN1CCC(Nc2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401320	FE	On-Demand	Anodyne	DRD4	27	45
O=C(CN1CCC(Nc2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401320	FE	On-Demand	Anodyne	KCNH2	17	43
O=C(CN1CCC(Nc2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401320	FE	On-Demand	Anodyne	LTA4H	16	40
O=C(CN1CCC(Nc2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401320	FE	On-Demand	Anodyne	SIGMAR1	15	40
COCCOCC(=O)NN=Cc1ccc(C(F)(F)F)cc1C	ZINC000872401321	DE	On-Demand	Reactive	ADCYAP1R1	48	36
COCCOCC(=O)NN=Cc1ccc(OCC(F)(F)F)c(F)c1	ZINC000872401323	FD	On-Demand	Reactive	ADCYAP1R1	63	39
COCCOCC(=O)NN=Cc1c(O)ccc(Cl)c1F	ZINC000872401328	DD	On-Demand	Reactive	ADCYAP1R1	73	35
COCCOCC(=O)NN=Cc1ccc(O)c(F)c1	ZINC000872401330	CC	On-Demand	Reactive	GCGR	20	43
COCCOCC(=O)NN=Cc1ccc(O)c(F)c1	ZINC000872401330	CC	On-Demand	Reactive	ADCYAP1R1	67	37
COCCOCC(=O)NN=C(C)Cc1ccc(Cl)cc1	ZINC000872401341	CE	On-Demand	Reactive	PPO2	16	41
COCCOCC(=O)NN=Cc1cc(Cl)c(O)cc1Cl	ZINC000872401354	DD	On-Demand	Reactive	GCGR	38	44
COCCOCC(=O)NN=Cc1cc(Cl)c(O)cc1Cl	ZINC000872401354	DD	On-Demand	Reactive	ADCYAP1R1	75	37
Cc1c(F)ncnc1N1CCN(Cc2nc(N)c3ccccc3n2)CC1	ZINC000872401363	FD	On-Demand	Anodyne	HTR3A	21	41
Cc1c(F)ncnc1N1CCN(Cc2nc(N)c3ccccc3n2)CC1	ZINC000872401363	FD	On-Demand	Anodyne	SORD	15	40
COCc1cc(NS(=O)(=O)c2cccc(CCl)c2)ccc1OC	ZINC000872401366	FG	On-Demand	Reactive	HTR6	22	50
COCCOCC(=O)NN=Cc1ccc(F)nc1	ZINC000872401371	CC	On-Demand	Reactive	ADCYAP1R1	43	31
COCCOCC(=O)NN=Cc1cc(F)cc(Cl)c1	ZINC000872401380	CD	On-Demand	Reactive	ADCYAP1R1	60	34
COCCOCC(=O)NN=Cc1ccc(C)c(Br)c1	ZINC000872401392	ED	On-Demand	Reactive	PDE10A	22	41
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)c2ccco2)CC1	ZINC000872401403	FI	On-Demand	Anodyne	L3MBTL3	43	36
COCCOCC(=O)NN=Cc1cc(Cl)cc(OC)c1O	ZINC000872401413	DD	On-Demand	Reactive	GCGR	22	40
COCCOCC(=O)NN=Cc1ccc(Br)cc1OC	ZINC000872401417	ED	On-Demand	Reactive	GCGR	16	40
COCCOCC(=O)NN=Cc1ccc(Br)cc1OC	ZINC000872401417	ED	On-Demand	Reactive	PDE10A	23	41
COCCOCC(=O)NN=Cc1ccc2c[nH]nc2c1	ZINC000872401428	CC	On-Demand	Reactive	PDE10A	18	41
COCCOCC(=O)NN=C(C)c1ccc(NC(C)=O)cc1	ZINC000872401430	DD	On-Demand	Reactive	ESRRG	18	40
COCCOCC(=O)NN=C(C)c1ccc(NC(C)=O)cc1	ZINC000872401430	DD	On-Demand	Reactive	PPO2	34	53
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1O	ZINC000872401434	DC	On-Demand	Reactive	GCGR	21	40
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1O	ZINC000872401434	DC	On-Demand	Reactive	ADCYAP1R1	42	35
Cc1c(F)ncnc1N1CCN([C@H](C(N)=O)c2ccccc2)CC1	ZINC000872401437	ED	On-Demand	Anodyne	NPY2R	64	38
Cc1c(F)ncnc1N1CCN([C@H](C(N)=O)c2ccccc2)CC1	ZINC000872401437	ED	On-Demand	Anodyne	LIMK2	30	41
Cc1c(F)ncnc1N1CCN([C@@H](C(N)=O)c2ccccc2)CC1	ZINC000872401438	ED	On-Demand	Anodyne	NPY2R	64	38
Cc1c(F)ncnc1N1CCN([C@@H](C(N)=O)c2ccccc2)CC1	ZINC000872401438	ED	On-Demand	Anodyne	LIMK2	30	41
COCCOCC(=O)NN=Cc1ccc(-c2cccc(C(F)(F)F)c2)o1	ZINC000872401446	FG	On-Demand	Reactive	ADCYAP1R1	43	36
O=C(N1CCCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872401453	EE	On-Demand	Anodyne	SMO	16	42
COCCOCC(=O)NN=Cc1cc(C)ccc1O	ZINC000872401454	CC	On-Demand	Reactive	GCGR	36	40
COCCOCC(=O)NN=Cc1cc(C)ccc1O	ZINC000872401454	CC	On-Demand	Reactive	ADCYAP1R1	49	32
COCCOCC(=O)NN=C(C)c1cccc(F)c1F	ZINC000872401459	CD	On-Demand	Reactive	ABAT	19	40
COCCOCC(=O)NN=Cc1ccc(Cl)c(C)c1	ZINC000872401461	CD	On-Demand	Reactive	PDE10A	16	42
COCCOCC(=O)NN=Cc1ccc(Cl)c(C)c1	ZINC000872401461	CD	On-Demand	Reactive	ADCYAP1R1	66	38
COCCOCC(=O)NN=Cc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000872401462	ED	On-Demand	Reactive	ADCYAP1R1	59	34
Cc1c(F)ncnc1NCc1ccc(N2CCN(C)CC2)nc1	ZINC000872401468	DD	On-Demand	Anodyne	HRH4	26	45
COCCOCC(=O)NN=Cc1cccc(C(=O)OC(C)(C)C)c1	ZINC000872401477	ED	On-Demand	Reactive	ADCYAP1R1	60	34
COCCOCC(=O)NN=Cc1ccc(Br)c(Cl)c1	ZINC000872401478	EE	On-Demand	Reactive	PDE10A	22	40
COCCOCC(=O)NN=Cc1ccc(Br)c(Cl)c1	ZINC000872401478	EE	On-Demand	Reactive	ADCYAP1R1	64	36
COCCOCC(=O)NN=C(C)c1cc2ccccc2s1	ZINC000872401495	DE	On-Demand	Reactive	PYK	34	53
COCc1cc(NS(=O)(=O)c2c[nH]nc2Cl)ccc1OC	ZINC000872401508	EE	On-Demand	Anodyne	SGK1	40	36
COCCOCC(=O)NN=Cc1cc(Br)cc(C(F)(F)F)c1	ZINC000872401509	GF	On-Demand	Reactive	ADCYAP1R1	43	37
COc1ccc(OC)c2sc(NC3CCN(S(C)(=O)=O)CC3)nc12	ZINC000872401511	FE	On-Demand	Anodyne	SSTR5	26	40
COc1ccc(OC)c2sc(NC3CCN(S(C)(=O)=O)CC3)nc12	ZINC000872401511	FE	On-Demand	Anodyne	MAK	15	45
COc1ccc(OC)c2sc(NC3CCN(S(C)(=O)=O)CC3)nc12	ZINC000872401511	FE	On-Demand	Anodyne	ICK	15	45
COCCOCC(=O)NN=Cc1cc(Cl)cc(C(F)(F)F)c1	ZINC000872401521	EE	On-Demand	Reactive	ADCYAP1R1	72	41
COCCOCC(=O)NN=C1CCCc2ccc(F)cc21	ZINC000872401537	CD	On-Demand	Reactive	NPY5R	16	43
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000872401540	ED	On-Demand	Reactive	DRD2	15	43
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000872401540	ED	On-Demand	Reactive	DRD4	40	39
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000872401540	ED	On-Demand	Reactive	ACHE	36	40
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000872401540	ED	On-Demand	Reactive	SIGMAR1	42	43
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@H]1C	ZINC000872401541	ED	On-Demand	Reactive	DRD2	15	43
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@H]1C	ZINC000872401541	ED	On-Demand	Reactive	DRD4	40	39
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@H]1C	ZINC000872401541	ED	On-Demand	Reactive	ACHE	36	40
COCCOCC(=O)NN=C1CN(Cc2ccccc2)CC[C@H]1C	ZINC000872401541	ED	On-Demand	Reactive	SIGMAR1	42	43
COCCOCC(=O)NN=Cc1ccc(F)c(Cl)c1	ZINC000872401542	CD	On-Demand	Reactive	GCGR	18	41
COCCOCC(=O)NN=Cc1ccc(F)c(Cl)c1	ZINC000872401542	CD	On-Demand	Reactive	ADCYAP1R1	66	36
COCCOCC(=O)NN=Cc1cccc2[nH]ccc12	ZINC000872401556	CD	On-Demand	Reactive	HPGDS	20	40
COCCOCC(=O)NN=Cc1ccc(N2CCN(C)CC2)cc1	ZINC000872401559	EC	On-Demand	Reactive	PDE10A	15	48
O=C(CN1CCC(Nc2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401562	FG	On-Demand	Anodyne	DRD4	22	47
COCCOCC(=O)NN=Cc1cccc(-c2ccc(C)cc2)c1	ZINC000872401565	EF	On-Demand	Reactive	PDE10A	16	42
COCCOCC(=O)NN=Cc1cccc(-c2ccc(C)cc2)c1	ZINC000872401565	EF	On-Demand	Reactive	ADCYAP1R1	49	32
COCCOCC(=O)NN=Cc1cnc(Cl)c(C)c1	ZINC000872401566	CD	On-Demand	Reactive	ADCYAP1R1	59	35
COCCOCC(=O)NN=Cc1cc(Cl)ccc1F	ZINC000872401572	CD	On-Demand	Reactive	ADCYAP1R1	42	31
COCCOCC(=O)NN=Cc1ccc(OCc2ccc(F)cc2)cc1	ZINC000872401578	FF	On-Demand	Reactive	ADCYAP1R1	72	48
COCCOCC(=O)NN=C(C)[C@@H](C)c1ccc(OC)cc1	ZINC000872401592	DD	On-Demand	Reactive	DXR	19	43
COCCOCC(=O)NN=C(C)[C@H](C)c1ccc(OC)cc1	ZINC000872401593	DD	On-Demand	Reactive	DXR	19	43
COCc1cc(NS(=O)(=O)c2cccc(C(F)F)c2)ccc1OC	ZINC000872401598	FH	On-Demand	Anodyne	HTR6	18	45
COCCOCC(=O)NN=Cc1ccc(Cl)nc1	ZINC000872401602	CC	On-Demand	Reactive	ADCYAP1R1	61	35
COCCOCC(=O)NN=Cc1ccc(Br)c(C)c1	ZINC000872401609	ED	On-Demand	Reactive	PDE10A	23	43
COCCOCC(=O)NN=Cc1cccc(-n2cccn2)c1	ZINC000872401620	DC	On-Demand	Reactive	PDE10A	17	45
COCCOCC(=O)NN=C1CCCc2ccc(OC)cc21	ZINC000872401630	DD	On-Demand	Reactive	NQO2	22	43
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)cc1Cl	ZINC000872401635	EE	On-Demand	Reactive	GCGR	26	44
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)cc1Cl	ZINC000872401635	EE	On-Demand	Reactive	PDE10A	16	45
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)cc1Cl	ZINC000872401635	EE	On-Demand	Reactive	ADCYAP1R1	48	36
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	HTR1A	36	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	DRD2	26	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	DRD4	35	45
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	HTR1D	24	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	HTR1B	22	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	DRD3	25	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	PDGFRB	16	44
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	HTR7	33	40
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	PRNP	51	37
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1	ZINC000872401669	EE	On-Demand	Anodyne	SLC27A1	51	43
COCCOCC(=O)NN=Cc1ccccc1C#N	ZINC000872401671	CC	On-Demand	Reactive	GCGR	31	44
COCCOCC(=O)NN=Cc1ccc(-n2cncn2)c(C)c1	ZINC000872401672	DC	On-Demand	Reactive	PDE10A	15	41
NC(=O)c1cc(Nc2ccc(N3CCCCC3)nc2)nc(Cl)n1	ZINC000872401673	EE	On-Demand	Anodyne	GALR2	43	35
COCCOCC(=O)NN=Cc1cccc(Cl)c1O	ZINC000872401685	CD	On-Demand	Reactive	GCGR	35	42
COCCOCC(=O)NN=Cc1cccc(Cl)c1O	ZINC000872401685	CD	On-Demand	Reactive	ADCYAP1R1	79	37
Cn1ncc2c(N3CCN(c4cc(-c5ccccc5)ncn4)CC3)ncnc21	ZINC000872401693	FE	On-Demand	Anodyne	HRH4	16	62
COCCOCC(=O)NN=Cc1ccc(Br)c(Br)c1	ZINC000872401707	GE	On-Demand	Reactive	PDE10A	23	42
O=C(CN1CCN(c2ccncc2C2CC2)CC1)Nc1ccccc1	ZINC000872401722	EF	On-Demand	Anodyne	HTR1A	20	45
O=C(CN1CCN(c2ccncc2C2CC2)CC1)Nc1ccccc1	ZINC000872401722	EF	On-Demand	Anodyne	DRD2	17	45
O=C(CN1CCN(c2ccncc2C2CC2)CC1)Nc1ccccc1	ZINC000872401722	EF	On-Demand	Anodyne	DRD4	24	48
O=C(CN1CCN(c2ccncc2C2CC2)CC1)Nc1ccccc1	ZINC000872401722	EF	On-Demand	Anodyne	SLC27A1	47	39
COCc1cc(NS(=O)(=O)c2ccc(N3CCOC3=O)cc2)ccc1OC	ZINC000872401730	GF	On-Demand	Anodyne	HTR6	25	43
COCCOCC(=O)NN=Cc1ccc(OC)c(Cl)c1	ZINC000872401745	DD	On-Demand	Reactive	GCGR	21	43
COCCOCC(=O)NN=Cc1ccc(OC)c(Cl)c1	ZINC000872401745	DD	On-Demand	Reactive	PDE10A	27	52
COCCOCC(=O)NN=Cc1ccc(OC)c(Cl)c1	ZINC000872401745	DD	On-Demand	Reactive	ADCYAP1R1	71	42
COCCOCC(=O)NN=C(Cc1cccc(OC)c1)C1CC1	ZINC000872401755	DD	On-Demand	Reactive	DRD4	41	32
COCCOCC(=O)NN=C(Cc1cccc(OC)c1)C1CC1	ZINC000872401755	DD	On-Demand	Reactive	MTNR1A	39	41
COCCOCC(=O)NN=C(Cc1cccc(OC)c1)C1CC1	ZINC000872401755	DD	On-Demand	Reactive	MTNR1B	39	41
COCCOCC(=O)NN=Cc1cc(F)c(O)c(F)c1	ZINC000872401759	CC	On-Demand	Reactive	ADCYAP1R1	51	33
COCCOCC(=O)NN=C(C)c1nc2cc(Cl)ccc2n1C	ZINC000872401766	ED	On-Demand	Reactive	PYK	34	43
COCCOCC(=O)NN=C(C)c1cccc(-c2ccncc2)c1	ZINC000872401768	EE	On-Demand	Reactive	ABAT	19	40
COCCOCC(=O)NN=C(C)c1cccc(-c2ccncc2)c1	ZINC000872401768	EE	On-Demand	Reactive	ROCK2	30	41
COCCOCC(=O)NN=Cc1ccc(Br)cc1Cl	ZINC000872401777	EE	On-Demand	Reactive	GCGR	32	41
COCCOCC(=O)NN=Cc1ccc(Br)cc1Cl	ZINC000872401777	EE	On-Demand	Reactive	ADCYAP1R1	43	32
COCCOCC(=O)NN=Cc1ccc(OCCBr)c(Cl)c1	ZINC000872401780	GE	On-Demand	Reactive	PDE10A	23	43
COCCOCC(=O)NN=Cc1ccc(OCCBr)c(Cl)c1	ZINC000872401780	GE	On-Demand	Reactive	ADCYAP1R1	67	38
NC(=O)c1cc(N2CCC([C@@H](O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872401782	EE	On-Demand	Anodyne	P2RY12	40	31
NC(=O)c1cc(N2CCC([C@@H](O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872401782	EE	On-Demand	Anodyne	SCD1	26	40
NC(=O)c1cc(N2CCC([C@H](O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872401783	EE	On-Demand	Anodyne	P2RY12	40	31
NC(=O)c1cc(N2CCC([C@H](O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872401783	EE	On-Demand	Anodyne	SCD1	26	40
COCCOCC(=O)NN=Cc1cccc(COC)c1	ZINC000872401791	CC	On-Demand	Reactive	ADCYAP1R1	70	42
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	DRD4	20	49
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	PDGFRB	52	39
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	PRNP	59	39
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	ABCC1	42	34
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	AKT1	15	41
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	RPS6KB1	19	41
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	LIMK2	50	41
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872401793	ED	On-Demand	Anodyne	SLC27A1	59	41
COCCOCC(=O)NN=Cc1cc(Br)ccc1Cl	ZINC000872401809	EE	On-Demand	Reactive	ADCYAP1R1	44	32
COCCOCC(=O)NN=Cc1cc(Cl)ccc1Cl	ZINC000872401815	DE	On-Demand	Reactive	GCGR	32	40
COCCOCC(=O)NN=Cc1cc(Cl)ccc1Cl	ZINC000872401815	DE	On-Demand	Reactive	ADCYAP1R1	45	33
COCCOCC(=O)NN=C(C)c1ccc(F)cc1Br	ZINC000872401816	EE	On-Demand	Reactive	ABAT	18	40
COCCOCC(=O)NN=C(C)c1ccc(F)cc1Br	ZINC000872401816	EE	On-Demand	Reactive	PYK	81	42
COCCOCC(=O)NN=Cc1cc(-c2ccccc2)ccc1OC	ZINC000872401823	EE	On-Demand	Reactive	GCGR	21	41
COCCOCC(=O)NN=Cc1cc(-c2ccccc2)ccc1OC	ZINC000872401823	EE	On-Demand	Reactive	LTB4R	24	43
COCCOCC(=O)NN=Cc1cc(-c2ccccc2)ccc1OC	ZINC000872401823	EE	On-Demand	Reactive	PDE10A	19	48
COC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401839	EE	On-Demand	Anodyne	HTR1A	27	41
COC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401839	EE	On-Demand	Anodyne	DRD2	22	42
COC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401839	EE	On-Demand	Anodyne	DRD4	44	35
COC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401839	EE	On-Demand	Anodyne	HTR2A	20	41
COC(=O)CN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872401839	EE	On-Demand	Anodyne	AVPR1B	40	35
COCCOCC(=O)NN=C(C)c1cc(Br)ccc1F	ZINC000872401865	EE	On-Demand	Reactive	PYK	109	45
COCCOCC(=O)NN=Cc1ccc(OCC(F)F)cc1	ZINC000872401866	DD	On-Demand	Reactive	ADCYAP1R1	50	37
COCCOCC(=O)NN=C(C)Cc1nc2ccccc2s1	ZINC000872401873	DD	On-Demand	Reactive	CSNK1D	26	41
COCCOCC(=O)NN=Cc1ccc(COC)cc1	ZINC000872401875	CC	On-Demand	Reactive	ADCYAP1R1	63	39
Oc1nnc(Cl)cc1N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000872401886	DG	On-Demand	Anodyne	PRCP	47	44
Oc1nnc(Cl)cc1N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000872401886	DG	On-Demand	Anodyne	KCNN3	35	43
Oc1nnc(Cl)cc1N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000872401887	DG	On-Demand	Anodyne	PRCP	47	44
Oc1nnc(Cl)cc1N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000872401887	DG	On-Demand	Anodyne	KCNN3	35	43
COCCOCC(=O)NN=Cc1ccc(Br)c(F)c1	ZINC000872401916	ED	On-Demand	Reactive	PDE10A	22	40
COCCOCC(=O)NN=Cc1ccc(Br)c(F)c1	ZINC000872401916	ED	On-Demand	Reactive	ADCYAP1R1	52	31
COCCOCC(=O)NN=C[C@@H](C)CCc1ccccc1	ZINC000872401928	CE	On-Demand	Reactive	PAPA1_CARPA	15	40
COCCOCC(=O)NN=C[C@H](C)CCc1ccccc1	ZINC000872401929	CE	On-Demand	Reactive	PAPA1_CARPA	15	40
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	DRD2	26	40
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	DRD4	38	48
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	DRD3	40	36
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	NPY2R	38	40
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	IMDH_CRYPV	33	42
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1	ZINC000872401934	ED	On-Demand	Anodyne	SLC27A1	43	43
COCCOCC(=O)NN=Cc1ccc(F)cc1Cl	ZINC000872401938	CD	On-Demand	Reactive	GCGR	36	43
COCCOCC(=O)NN=Cc1ccc(F)cc1Cl	ZINC000872401938	CD	On-Demand	Reactive	ADCYAP1R1	71	33
COCCOCC(=O)NN=C(C)c1cc(Cl)cc(Cl)c1	ZINC000872401945	DE	On-Demand	Reactive	ABAT	15	43
COCCOCC(=O)NN=C(C)c1cc(Cl)cc(Cl)c1	ZINC000872401945	DE	On-Demand	Reactive	CACNA1I	41	34
Cn1ncc2c(N3CCN(CC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401947	GD	On-Demand	Anodyne	PIK3CA	28	41
Cn1ncc2c(N3CCN(CC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401947	GD	On-Demand	Anodyne	MTOR	67	39
Cn1ncc2c(N3CCN(CC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872401947	GD	On-Demand	Anodyne	IMDH_CRYPV	42	38
COCCOCC(=O)NN=Cc1ccc(Cl)c2cccnc12	ZINC000872401975	DE	On-Demand	Reactive	GCGR	32	42
COCCOCC(=O)NN=Cc1ccc(Cl)c2cccnc12	ZINC000872401975	DE	On-Demand	Reactive	ADCYAP1R1	57	33
CCC(=NNC(=O)COCCOC)c1cc(Cl)ccc1OC	ZINC000872401977	EE	On-Demand	Reactive	CPT1A	44	30
CCC(=NNC(=O)COCCOC)c1cc(Cl)ccc1OC	ZINC000872401977	EE	On-Demand	Reactive	KCNMA1	17	43
COCc1cc(NS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)ccc1OC	ZINC000872401980	GF	On-Demand	Anodyne	HTR6	30	50
COCCOCC(=O)NN=Cc1cc(F)cc(C(F)(F)F)c1	ZINC000872401986	DD	On-Demand	Reactive	ADCYAP1R1	53	38
COCCOCC(=O)NN=Cc1ccc(-c2ccccc2OC)cc1	ZINC000872402003	EE	On-Demand	Reactive	PDE10A	24	44
COCCOCC(=O)NN=Cc1ccc(-c2ccccc2OC)cc1	ZINC000872402003	EE	On-Demand	Reactive	ADCYAP1R1	48	38
Nc1nc(Nc2ccc(N3CCCCC3)nc2)nc(C(F)F)n1	ZINC000872402012	DF	On-Demand	Anodyne	GALR2	45	39
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000872402014	FF	On-Demand	Reactive	ADCYAP1R1	60	40
COCCOCC(=O)NN=Cc1ccccc1OCC(F)(F)F	ZINC000872402017	ED	On-Demand	Reactive	ADCYAP1R1	51	34
COCCOCC(=O)NN=C(Cc1ccccc1)C(F)(F)F	ZINC000872402020	DD	On-Demand	Reactive	CES1	15	43
NC(=O)c1cc(Nc2ccc(N3CCCC3)nc2)nc(Cl)n1	ZINC000872402021	DD	On-Demand	Anodyne	DGAT1	30	40
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1C	ZINC000872402023	DD	On-Demand	Reactive	PDE10A	16	40
COCCOCC(=O)NN=C(C)c1ccc2cc(OC)ccc2c1	ZINC000872402034	EE	On-Demand	Reactive	MTNR1A	69	37
COCCOCC(=O)NN=C(C)c1ccc2cc(OC)ccc2c1	ZINC000872402034	EE	On-Demand	Reactive	MTNR1B	59	36
COCCOCC(=O)NN=C(C)c1ccc2cc(OC)ccc2c1	ZINC000872402034	EE	On-Demand	Reactive	PPO2	22	44
COCCOCC(=O)NN=C(C)c1ccc2cc(OC)ccc2c1	ZINC000872402034	EE	On-Demand	Reactive	PYK	15	41
Cc1c(F)ncnc1NCc1ccc(NC(=O)C(C)C)cc1	ZINC000872402036	DG	On-Demand	Anodyne	FLT1	21	41
COCCOCC(=O)NN=C(C)c1cc(Br)c(F)cc1O	ZINC000872402042	FD	On-Demand	Reactive	PYK	66	38
Cc1c(F)ncnc1Nc1ccc(N2CCCCC2)nc1	ZINC000872402046	CG	On-Demand	Anodyne	GALR2	42	35
Cc1c(F)ncnc1Nc1ccc(N2CCCCC2)nc1	ZINC000872402046	CG	On-Demand	Anodyne	DGAT1	28	40
COCCOCC(=O)NN=Cc1c(F)cccc1Cl	ZINC000872402050	CD	On-Demand	Reactive	ADCYAP1R1	60	33
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	HTR1A	44	40
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	DRD2	41	39
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	DRD4	58	39
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	HTR2A	19	40
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	DRD3	58	40
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	PDGFRB	24	40
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	PRNP	56	36
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	TACR3	18	40
COC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872402056	DD	On-Demand	Anodyne	SLC27A1	52	35
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)ccc1Cl	ZINC000872402071	EE	On-Demand	Reactive	GCGR	27	43
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)ccc1Cl	ZINC000872402071	EE	On-Demand	Reactive	ADCYAP1R1	78	41
COCCOCC(=O)NN=Cc1ccc(F)cc1	ZINC000872402074	CC	On-Demand	Reactive	ADCYAP1R1	60	35
COCCOCC(=O)NN=C(C)c1nc2ccc(Cl)cc2n1C	ZINC000872402077	ED	On-Demand	Reactive	PYK	34	42
COCCOCC(=O)NN=Cc1ccc(Cl)cc1Cl	ZINC000872402086	DE	On-Demand	Reactive	GCGR	34	42
COCCOCC(=O)NN=Cc1ccc(Cl)cc1Cl	ZINC000872402086	DE	On-Demand	Reactive	ALPL	37	40
COCCOCC(=O)NN=Cc1ccc(Cl)cc1Cl	ZINC000872402086	DE	On-Demand	Reactive	ADCYAP1R1	44	32
CCC(=NNC(=O)COCCOC)c1cccc(Cl)c1	ZINC000872402091	CE	On-Demand	Reactive	ABAT	22	45
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1	ZINC000872402110	CC	On-Demand	Reactive	GCGR	16	42
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1	ZINC000872402110	CC	On-Demand	Reactive	TUBB1	50	41
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1	ZINC000872402110	CC	On-Demand	Reactive	PDE10A	26	45
COCCOCC(=O)NN=Cc1ccc(OC)c(O)c1	ZINC000872402110	CC	On-Demand	Reactive	ADCYAP1R1	68	41
COCCOCC(=O)NN=Cc1cccc(O)c1	ZINC000872402112	CC	On-Demand	Reactive	UREA_CANEN	17	40
COCCOCC(=O)NN=Cc1cccc(O)c1	ZINC000872402112	CC	On-Demand	Reactive	ADCYAP1R1	69	38
COCCOCC(=O)NN=Cc1cc(OC)c(O)c(OC)c1	ZINC000872402114	DC	On-Demand	Reactive	PDE10A	27	46
COCCOCC(=O)NN=Cc1cc(OC)c(O)c(OC)c1	ZINC000872402114	DC	On-Demand	Reactive	ADCYAP1R1	49	42
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	HTR1A	24	47
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	DRD2	17	47
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	DRD4	23	47
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	ADRA1D	19	42
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	HTR2A	22	47
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	ADRA1A	22	43
Cc1c(F)ncnc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402120	ED	On-Demand	Anodyne	DRD3	15	47
COCCOCC(=O)NN=Cc1ccc(Cl)cc1	ZINC000872402123	CD	On-Demand	Reactive	UREA_CANEN	21	49
COCCOCC(=O)NN=Cc1ccc(Cl)cc1	ZINC000872402123	CD	On-Demand	Reactive	ADCYAP1R1	62	37
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	HTR1A	26	45
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	DRD2	18	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	DRD4	20	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	HTR2A	20	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	DRD3	18	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	HRP1_PLAFA	94	41
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	HTR7	18	41
Oc1nnc(Cl)cc1NCCCN1CCN(c2ncccn2)CC1	ZINC000872402126	ED	On-Demand	Anodyne	HNMT	62	41
COCCOCC(=O)NN=Cc1cccc(C)c1	ZINC000872402127	CD	On-Demand	Reactive	UREA_CANEN	20	40
COCCOCC(=O)NN=Cc1cccc(C)c1	ZINC000872402127	CD	On-Demand	Reactive	ADCYAP1R1	61	33
COCCOCC(=O)NN=C(C)c1cccc(Br)c1	ZINC000872402143	ED	On-Demand	Reactive	ABAT	28	43
COCCOCC(=O)NN=C(C)c1cccc(Br)c1	ZINC000872402143	ED	On-Demand	Reactive	PYK	93	35
COCCOCC(=O)NN=C(C)c1cccc(Br)c1	ZINC000872402143	ED	On-Demand	Reactive	F2RL1	22	44
COCCOCC(=O)NN=Cc1ccc2c(c1)OCCO2	ZINC000872402145	CC	On-Demand	Reactive	PDE10A	19	54
COCCOCC(=O)NN=Cc1ccc(N(C)C)cc1	ZINC000872402150	CC	On-Demand	Reactive	ESRRG	15	45
COCCOCC(=O)NN=Cc1ccc(N(C)C)cc1	ZINC000872402150	CC	On-Demand	Reactive	UREA_CANEN	17	50
COCCOCC(=O)NN=C1CCc2ccccc21	ZINC000872402152	CD	On-Demand	Reactive	ABAT	15	48
COCCOCC(=O)NN=C(C)c1cccc(NC(C)=O)c1	ZINC000872402157	DD	On-Demand	Reactive	ABAT	20	42
COCCOCC(=O)NN=C(C)c1cccc(NC(C)=O)c1	ZINC000872402157	DD	On-Demand	Reactive	KCNK3	111	38
COCCOCC(=O)NN=C(C)c1cccc(NC(C)=O)c1	ZINC000872402157	DD	On-Demand	Reactive	KCNK9	78	36
COCCOCC(=O)NN=Cc1cccc(OC)c1	ZINC000872402160	CC	On-Demand	Reactive	MTNR1A	34	43
COCCOCC(=O)NN=Cc1cccc(OC)c1	ZINC000872402160	CC	On-Demand	Reactive	MTNR1B	35	43
COCCOCC(=O)NN=Cc1cccc(OC)c1	ZINC000872402160	CC	On-Demand	Reactive	PDE10A	21	42
COCCOCC(=O)NN=Cc1cccc(OC)c1	ZINC000872402160	CC	On-Demand	Reactive	UREA_CANEN	23	56
COCCOCC(=O)NN=Cc1cccc(OC)c1	ZINC000872402160	CC	On-Demand	Reactive	ADCYAP1R1	64	38
COCCOCC(=O)NN=Cc1ccc(C(C)(C)C)cc1	ZINC000872402165	CE	On-Demand	Reactive	ADCYAP1R1	54	33
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1SC	ZINC000872402170	ED	On-Demand	Reactive	PDE10A	17	42
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccc(OC)c(COC)c2)CC1	ZINC000872402187	GD	On-Demand	Anodyne	TGM2	33	44
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccc(OC)c(COC)c2)CC1	ZINC000872402187	GD	On-Demand	Anodyne	F13A1	53	44
COCCOCC(=O)NN=C1CCc2ccc(OC)cc21	ZINC000872402196	CD	On-Demand	Reactive	NQO2	24	47
CCC(=NNC(=O)COCCOC)c1cccc(OC)c1	ZINC000872402201	CD	On-Demand	Reactive	DRD4	46	35
CCC(=NNC(=O)COCCOC)c1cccc(OC)c1	ZINC000872402201	CD	On-Demand	Reactive	MTNR1A	40	40
CCC(=NNC(=O)COCCOC)c1cccc(OC)c1	ZINC000872402201	CD	On-Demand	Reactive	MTNR1B	40	42
CCC(=NNC(=O)COCCOC)c1cccc(OC)c1	ZINC000872402201	CD	On-Demand	Reactive	KCNK3	19	44
COCc1cc(NS(=O)(=O)c2cnc(Cl)c(OC)c2)ccc1OC	ZINC000872402211	FF	On-Demand	Anodyne	HTR6	15	40
COCCOCC(=O)NN=C(C)c1ccc(Br)cc1F	ZINC000872402217	EE	On-Demand	Reactive	PYK	101	41
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)ccc1F	ZINC000872402223	DD	On-Demand	Reactive	TEK	15	44
COCCOCC(=O)NN=Cc1cc(C(F)(F)F)ccc1F	ZINC000872402223	DD	On-Demand	Reactive	ADCYAP1R1	43	36
COCCOCC(=O)NN=C(C)c1ccccc1I	ZINC000872402230	GD	On-Demand	Reactive	ABAT	19	42
COCCOCC(=O)NN=C(C)c1ccc(NC(C)=O)cc1OC	ZINC000872402232	ED	On-Demand	Reactive	ENPP1	66	31
C[C@@H]1CN(CCCNc2ccnc3ncccc23)C[C@@H](C)O1	ZINC000872402235	DF	On-Demand	Anodyne	HRP1_PLAFA	97	38
C[C@@H]1CN(CCCNc2ccnc3ncccc23)C[C@@H](C)O1	ZINC000872402235	DF	On-Demand	Anodyne	HNMT	75	47
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3cccnc23)CC1	ZINC000872402236	FF	On-Demand	Anodyne	DRD4	27	41
Oc1nnc(Cl)cc1N1CCN(Cc2cccc3cccnc23)CC1	ZINC000872402236	FF	On-Demand	Anodyne	DRD3	15	41
COCCOCC(=O)NN=C(CC(C)C)c1ccccn1	ZINC000872402238	CD	On-Demand	Reactive	PLM1_PLAFA	54	35
C[C@@H]1CN(CCCNc2cc(Cl)nnc2O)C[C@@H](C)O1	ZINC000872402254	DD	On-Demand	Anodyne	HRP1_PLAFA	53	34
COCCOCC(=O)NN=Cc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000872402258	FD	On-Demand	Reactive	TGFBR1	15	41
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(F)c1	ZINC000872402260	DD	On-Demand	Reactive	PDE10A	23	45
COCCOCC(=O)NN=Cc1cccc(OCc2ccccn2)c1	ZINC000872402266	ED	On-Demand	Reactive	ADCYAP1R1	65	40
COCCOCC(=O)NN=Cc1ccc(Cl)c(F)c1	ZINC000872402268	CD	On-Demand	Reactive	ADCYAP1R1	66	36
COCCOCC(=O)NN=Cc1ccc(O)c(Cl)c1	ZINC000872402287	CD	On-Demand	Reactive	GCGR	41	48
COCCOCC(=O)NN=Cc1ccc(O)c(Cl)c1	ZINC000872402287	CD	On-Demand	Reactive	ADCYAP1R1	95	48
COCCOCC(=O)NN=Cc1cccc(Cl)c1F	ZINC000872402296	CD	On-Demand	Reactive	ADCYAP1R1	64	33
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(Cl)c1	ZINC000872402302	EE	On-Demand	Reactive	PDE10A	24	45
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(Cl)c1	ZINC000872402302	EE	On-Demand	Reactive	ADCYAP1R1	67	40
COCCOCC(=O)NN=Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000872402319	FE	On-Demand	Reactive	MAOB	25	40
COCCOCC(=O)NN=Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000872402319	FE	On-Demand	Reactive	ADCYAP1R1	66	45
COCCOCC(=O)NN=C(C)c1cccc(OC)c1	ZINC000872402325	CD	On-Demand	Reactive	DRD4	46	35
COCCOCC(=O)NN=C(C)c1cccc(OC)c1	ZINC000872402325	CD	On-Demand	Reactive	ABAT	21	43
COCCOCC(=O)NN=C(C)c1cccc(OC)c1	ZINC000872402325	CD	On-Demand	Reactive	MTNR1A	54	44
COCCOCC(=O)NN=C(C)c1cccc(OC)c1	ZINC000872402325	CD	On-Demand	Reactive	MTNR1B	52	44
COCCOCC(=O)NN=C(C)c1cccc(OC)c1	ZINC000872402325	CD	On-Demand	Reactive	KCNK3	17	42
COCCOCC(=O)NN=Cc1ccsc1	ZINC000872402326	BC	On-Demand	Reactive	ADCYAP1R1	51	35
COCCOCC(=O)NN=C(COC)c1cccc(C(F)(F)F)c1	ZINC000872402327	ED	On-Demand	Reactive	CCR2	64	38
COCCOCC(=O)NN=C(COC)c1cccc(C(F)(F)F)c1	ZINC000872402327	ED	On-Demand	Reactive	ADCYAP1R1	42	35
COCCOCC(=O)NN=C(COC)c1cccc(C(F)(F)F)c1	ZINC000872402327	ED	On-Demand	Reactive	KCNK3	18	43
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872402335	DF	On-Demand	Anodyne	L3MBTL3	56	36
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000872402335	DF	On-Demand	Anodyne	HPGD	43	37
COCCOCC(=O)NN=Cc1cccc(F)c1	ZINC000872402345	CC	On-Demand	Reactive	UREA_CANEN	17	42
COCCOCC(=O)NN=Cc1cccc(F)c1	ZINC000872402345	CC	On-Demand	Reactive	ADCYAP1R1	62	35
COCCOCC(=O)NN=Cc1c(O)ccc2ccccc12	ZINC000872402353	DD	On-Demand	Reactive	GCGR	33	41
COCCOCC(=O)NN=Cc1ccc(OC)c(C#N)c1	ZINC000872402355	CC	On-Demand	Reactive	GCGR	17	42
COCCOCC(=O)NN=Cc1ccc(OC)c(C#N)c1	ZINC000872402355	CC	On-Demand	Reactive	PDE10A	25	48
COCCOCC(=O)NN=Cc1ccc(OC)c(C#N)c1	ZINC000872402355	CC	On-Demand	Reactive	ADCYAP1R1	49	38
Cn1ncc2c(NCc3ccc(C(=O)N4CCOCC4)cc3)nc(Cl)nc21	ZINC000872402356	GE	On-Demand	Anodyne	LRRK2	23	43
COCCOCC(=O)NN=C(C)c1cc(Br)cc(Cl)c1O	ZINC000872402365	GE	On-Demand	Reactive	PYK	90	41
COCCOCC(=O)NN=Cc1c(C)nn(-c2ccc(F)cc2)c1Cl	ZINC000872402372	FE	On-Demand	Reactive	P2RX7	21	40
COCCOCC(=O)NN=C(C)c1ccc(Cl)cc1	ZINC000872402378	CD	On-Demand	Reactive	ABAT	33	43
COCCOCC(=O)NN=Cc1cccc(Br)c1	ZINC000872402379	DD	On-Demand	Reactive	ADCYAP1R1	60	33
COCCOCC(=O)NN=C/C(C)=C\c1ccccc1	ZINC000872402393	CD	On-Demand	Reactive	TLR4	18	40
COCCOCC(=O)NN=C/C(C)=C/c1ccccc1	ZINC000872402395	CD	On-Demand	Reactive	TLR4	18	40
COCCOCC(=O)NN=C(C)c1ccc(Cl)c(Cl)c1	ZINC000872402402	DE	On-Demand	Reactive	ABAT	20	41
COCCOCC(=O)NN=Cc1ccccc1O	ZINC000872402409	CC	On-Demand	Reactive	GCGR	38	43
COCCOCC(=O)NN=Cc1ccccc1O	ZINC000872402409	CC	On-Demand	Reactive	ABAT	19	41
COCCOCC(=O)NN=Cc1ccccc1O	ZINC000872402409	CC	On-Demand	Reactive	ADCYAP1R1	54	34
COCCOCC(=O)NN=C(C)c1ccc(Br)cc1O	ZINC000872402410	ED	On-Demand	Reactive	PYK	117	43
CCN(Cc1ccc2c(c1)OCO2)c1cc(C(N)=O)nc(Cl)n1	ZINC000872402418	ED	On-Demand	Anodyne	BMP1	47	34
COCCOCC(=O)NN=C(C)CCc1ccc(F)cc1	ZINC000872402420	CD	On-Demand	Reactive	PPO2	42	44
COCCOCC(=O)NN=Cc1ccc(OC)c2ccccc12	ZINC000872402421	DD	On-Demand	Reactive	GCGR	39	58
COCCOCC(=O)NN=Cc1ccc(OC)c2ccccc12	ZINC000872402421	DD	On-Demand	Reactive	PDE10A	21	44
COCCOCC(=O)NN=Cc1ccc(OC)c2ccccc12	ZINC000872402421	DD	On-Demand	Reactive	ADCYAP1R1	40	35
COCCOCC(=O)NN=Cc1ccc(Cl)c(C(F)(F)F)c1	ZINC000872402427	EE	On-Demand	Reactive	ADCYAP1R1	74	40
COCCOCC(=O)NN=Cc1cc(Cl)cc(Cl)c1	ZINC000872402429	DE	On-Demand	Reactive	ADCYAP1R1	62	36
COCCOCC(=O)NN=C(C)c1ccccc1O	ZINC000872402442	CC	On-Demand	Reactive	PYK	94	36
COCCOCC(=O)NN=C(C)c1ccc2ccccc2c1O	ZINC000872402450	DE	On-Demand	Reactive	PYK	50	34
COCCOCC(=O)NN=Cc1ccccc1Cl	ZINC000872402451	CD	On-Demand	Reactive	GCGR	34	44
COCCOCC(=O)NN=Cc1ccccc1Cl	ZINC000872402451	CD	On-Demand	Reactive	ADCYAP1R1	59	35
O=C1NC2(CCCCC2)C(=O)N1CCCNc1ccnc2ncccc12	ZINC000872402453	FF	On-Demand	Anodyne	HRP1_PLAFA	96	36
O=C1NC2(CCCCC2)C(=O)N1CCCNc1ccnc2ncccc12	ZINC000872402453	FF	On-Demand	Anodyne	HNMT	66	45
COCCOCC(=O)NN=Cc1ccc(N2CCOCC2)cc1	ZINC000872402454	DC	On-Demand	Reactive	PDE10A	18	48
COCCOCC(=O)NN=Cc1ccc(N2CCOCC2)cc1	ZINC000872402454	DC	On-Demand	Reactive	STAT6	51	33
CCOc1ccc(C=NNC(=O)COCCOC)c(O)c1	ZINC000872402476	CC	On-Demand	Reactive	GCGR	26	40
CCOc1ccc(C=NNC(=O)COCCOC)c(O)c1	ZINC000872402476	CC	On-Demand	Reactive	ADCYAP1R1	60	35
COCCOCC(=O)NN=C(C)c1ccccc1Br	ZINC000872402478	ED	On-Demand	Reactive	ABAT	22	58
COCCOCC(=O)NN=C(C)c1ccccc1Br	ZINC000872402478	ED	On-Demand	Reactive	PYK	61	36
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1	ZINC000872402481	EE	On-Demand	Reactive	MAOB	23	45
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1	ZINC000872402481	EE	On-Demand	Reactive	LTA4H	28	45
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1	ZINC000872402481	EE	On-Demand	Reactive	FFAR1	31	40
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1	ZINC000872402481	EE	On-Demand	Reactive	UREA_CANEN	16	44
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1	ZINC000872402481	EE	On-Demand	Reactive	ADCYAP1R1	74	58
Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(F)c(C(F)F)c1	ZINC000872402482	DF	On-Demand	Anodyne	SGK1	50	39
COc1ccc(OC)c2sc(NCCC(=O)NC(C)C)nc12	ZINC000872402483	DF	On-Demand	Anodyne	ADORA2B	17	42
COCCOCC(=O)NN=C(C)c1ccc(Cl)cc1Cl	ZINC000872402486	DE	On-Demand	Reactive	ABAT	20	40
COCCOCC(=O)NN=C(C)c1ccc(Cl)cc1Cl	ZINC000872402486	DE	On-Demand	Reactive	ALPL	36	40
COCCOCC(=O)NN=Cc1ccc(O)cc1	ZINC000872402488	CC	On-Demand	Reactive	ESRRG	21	51
COCCOCC(=O)NN=Cc1ccc(O)cc1	ZINC000872402488	CC	On-Demand	Reactive	ADCYAP1R1	63	38
CCC(=O)c1c(Cl)cccc1NCc1ccc(C(=O)N(C)C)cc1	ZINC000872402495	EI	On-Demand	Anodyne	ECR	52	40
CCC(=O)c1c(Cl)cccc1NCc1ccc(C(=O)N(C)C)cc1	ZINC000872402495	EI	On-Demand	Anodyne	E3UJZ5_SPOLI	43	38
COCCOCC(=O)NN=C(C)c1ccc(F)cc1O	ZINC000872402500	CD	On-Demand	Reactive	PYK	51	40
O=C(CCNc1ccnc2ncccc12)N1CCOCC1	ZINC000872402502	CD	On-Demand	Anodyne	HNMT	49	37
O=C(CCNc1cc(-c2ccccc2)ncn1)N1CCOCC1	ZINC000872402506	DD	On-Demand	Anodyne	P2RY12	20	40
COCCOCC(=O)NN=C(C)c1ccc(O)cc1F	ZINC000872402507	CD	On-Demand	Reactive	PYK	40	33
O=C(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCC1	ZINC000872402527	EF	On-Demand	Anodyne	DPP7	40	36
O=C(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCC1	ZINC000872402527	EF	On-Demand	Anodyne	L3MBTL3	62	43
COCCOCC(=O)NN=C(C)c1ccc(O)c(F)c1	ZINC000872402535	CD	On-Demand	Reactive	PYK	51	35
COCCOCC(=O)NN=C(C)c1ccc(OC)cc1	ZINC000872402559	CD	On-Demand	Reactive	PPO2	33	52
COCCOCC(=O)NN=C(C)c1ccccc1Cl	ZINC000872402574	CD	On-Demand	Reactive	ABAT	20	42
COCCOCC(=O)NN=C(C)c1ccccc1Cl	ZINC000872402574	CD	On-Demand	Reactive	ECR	45	36
COCCOCC(=O)NN=Cc1ccc(C(C)C)cc1	ZINC000872402584	CD	On-Demand	Reactive	ADCYAP1R1	53	42
COCCOCC(=O)NN=C(C)c1ccc(OC)c(OC)c1	ZINC000872402588	DD	On-Demand	Reactive	ENPP1	55	30
COCCOCC(=O)NN=C(C)c1ccc(F)c(Cl)c1	ZINC000872402595	DD	On-Demand	Reactive	ABAT	26	44
CCCOc1cccc(C=NNC(=O)COCCOC)c1	ZINC000872402600	CD	On-Demand	Reactive	ADCYAP1R1	63	40
COCCOCC(=O)NN=Cc1ccc(OCC(F)(F)F)cc1	ZINC000872402611	ED	On-Demand	Reactive	ADCYAP1R1	55	41
COCCOCC(=O)NN=C(C)c1ccccc1OC(F)(F)F	ZINC000872402619	EE	On-Demand	Reactive	KCNK3	38	44
COCCOCC(=O)NN=C(C)c1ccccc1OC(F)(F)F	ZINC000872402619	EE	On-Demand	Reactive	KCNK9	40	44
COCCOCC(=O)NN=Cc1cc(C)c(OC)c(C)c1	ZINC000872402624	CD	On-Demand	Reactive	PDE10A	24	44
COCCOCC(=O)NN=Cc1ccc(N2CCOCC2)c(F)c1	ZINC000872402626	EC	On-Demand	Reactive	PDE10A	15	40
COCCOCC(=O)NN=Cc1ccccc1I	ZINC000872402634	FD	On-Demand	Reactive	ABAT	17	57
COCCOCC(=O)NN=Cc1ccccc1OC	ZINC000872402640	CC	On-Demand	Reactive	GCGR	29	43
COCCOCC(=O)NN=Cc1ccccc1OC	ZINC000872402640	CC	On-Demand	Reactive	PDE10A	20	44
COCCOCC(=O)NN=Cc1ccccc1OC	ZINC000872402640	CC	On-Demand	Reactive	ADCYAP1R1	51	37
COCCOCC(=O)NN=Cc1ccccc1Br	ZINC000872402647	DD	On-Demand	Reactive	ABAT	25	40
CCOc1ccc(C=NNC(=O)COCCOC)cc1OC	ZINC000872402666	DD	On-Demand	Reactive	PDE10A	27	51
CCOc1ccc(C=NNC(=O)COCCOC)cc1OC	ZINC000872402666	DD	On-Demand	Reactive	ADCYAP1R1	47	43
O=C(c1ccc2c(c1)OCO2)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872402674	FE	On-Demand	Anodyne	NOS2	55	36
CCOc1cc(C=NNC(=O)COCCOC)ccc1O	ZINC000872402676	CC	On-Demand	Reactive	GCGR	19	42
CCOc1cc(C=NNC(=O)COCCOC)ccc1O	ZINC000872402676	CC	On-Demand	Reactive	PDE10A	22	46
CCOc1cc(C=NNC(=O)COCCOC)ccc1O	ZINC000872402676	CC	On-Demand	Reactive	ADCYAP1R1	70	40
O=C(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872402677	FE	On-Demand	Anodyne	NPY2R	29	40
O=C(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872402677	FE	On-Demand	Anodyne	GRM5	16	40
O=C(c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872402677	FE	On-Demand	Anodyne	SMO	15	41
COCCOCC(=O)NN=Cc1c(OC)ccc2ccccc12	ZINC000872402678	DD	On-Demand	Reactive	GCGR	17	40
COCCOCC(=O)NN=Cc1c(OC)ccc2ccccc12	ZINC000872402678	DD	On-Demand	Reactive	MTNR1A	29	48
COCCOCC(=O)NN=Cc1c(OC)ccc2ccccc12	ZINC000872402678	DD	On-Demand	Reactive	MTNR1B	26	48
COCCOCC(=O)NN=Cc1c(OC)ccc2ccccc12	ZINC000872402678	DD	On-Demand	Reactive	PDE10A	19	42
COCCOCC(=O)NN=C(C)c1cccc(Cl)c1	ZINC000872402679	CD	On-Demand	Reactive	ABAT	33	60
Oc1nnc(Cl)cc1N1CCC(c2ccccc2)CC1	ZINC000872402715	CG	On-Demand	Anodyne	SLC18A3	56	40
Oc1nnc(Cl)cc1N1CCC(c2ccccc2)CC1	ZINC000872402715	CG	On-Demand	Anodyne	GRM2	17	48
COCCOCC(=O)NN=Cc1cccc(O)c1OC	ZINC000872402720	CC	On-Demand	Reactive	GCGR	40	42
COCCOCC(=O)NN=Cc1cccc(O)c1OC	ZINC000872402720	CC	On-Demand	Reactive	ADCYAP1R1	58	38
C=CCOc1ccc(C=NNC(=O)COCCOC)cc1	ZINC000872402726	CD	On-Demand	Reactive	ADCYAP1R1	45	38
COCCOCC(=O)NN=C(C)c1cc(Br)ccc1O	ZINC000872402732	ED	On-Demand	Reactive	PYK	136	51
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	HTR1A	30	42
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	DRD2	21	42
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	ADRA1D	16	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	HTR1D	15	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	ADRA1A	15	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	ADRA1B	17	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	PDGFRB	63	47
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	NPY2R	24	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	SMO	22	42
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1OC	ZINC000872402735	GF	On-Demand	Anodyne	HPGD	27	41
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1OC	ZINC000872402751	DD	On-Demand	Reactive	CPT1A	44	31
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1OC	ZINC000872402751	DD	On-Demand	Reactive	KCNMA1	18	45
CCC(=O)c1c(Cl)cccc1N[C@H](C)CO	ZINC000872402754	BF	On-Demand	Anodyne	CXCL8	41	37
CCC(=O)c1c(Cl)cccc1N[C@@H](C)CO	ZINC000872402755	BF	On-Demand	Anodyne	CXCL8	41	37
COCCOCC(=O)NN=Cc1ccc(OC(F)(F)F)cc1	ZINC000872402757	DD	On-Demand	Reactive	ADCYAP1R1	46	36
COCCOCC(=O)NN=C(C)c1ccc(C(C)C)cc1	ZINC000872402759	CE	On-Demand	Reactive	PPO2	29	50
COCCOCC(=O)NN=Cc1ccccc1OC(F)(F)F	ZINC000872402764	DD	On-Demand	Reactive	GCGR	22	40
COCCOCC(=O)NN=Cc1ccc(OC(C)=O)c(OC)c1	ZINC000872402766	DC	On-Demand	Reactive	PDE10A	27	47
COCCOCC(=O)NN=Cc1ccc(OC(C)=O)c(OC)c1	ZINC000872402766	DC	On-Demand	Reactive	ADCYAP1R1	44	39
COCCOCC(=O)NN=Cc1ccc(C)c(C)c1	ZINC000872402778	CD	On-Demand	Reactive	PDE10A	24	44
COCCOCC(=O)NN=Cc1ccc(C)c(C)c1	ZINC000872402778	CD	On-Demand	Reactive	ADCYAP1R1	51	35
COCCOCC(=O)NN=Cc1ccccc1OCc1cccnc1	ZINC000872402784	ED	On-Demand	Reactive	ADCYAP1R1	60	36
CCOc1cc(C=NNC(=O)COCCOC)cc(Cl)c1OC	ZINC000872402797	ED	On-Demand	Reactive	GCGR	15	41
CCOc1cc(C=NNC(=O)COCCOC)cc(Cl)c1OC	ZINC000872402797	ED	On-Demand	Reactive	PDE10A	24	57
CCOc1cc(C=NNC(=O)COCCOC)cc(Cl)c1OC	ZINC000872402797	ED	On-Demand	Reactive	ADCYAP1R1	69	44
COCCOCC(=O)NN=Cc1cc(Cl)c2c(c1)OCO2	ZINC000872402801	DD	On-Demand	Reactive	ADCYAP1R1	40	33
COCCOCC(=O)NN=Cc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000872402809	FD	On-Demand	Reactive	P2RX7	19	47
CCOc1cc(C=NNC(=O)COCCOC)cc(Br)c1OC	ZINC000872402810	GD	On-Demand	Reactive	PDE10A	25	57
O=C(c1ccoc1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872402813	EG	On-Demand	Anodyne	PRKD1	51	34
COCCOCC(=O)NN=Cc1ccc(N2CCCCC2)cc1	ZINC000872402814	DD	On-Demand	Reactive	PDE10A	15	46
CC(C)CN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872402815	DD	On-Demand	Anodyne	PDK1	24	40
N#Cc1ccnc(N2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872402821	DF	On-Demand	Mild	MAP3K12	46	33
COCCOCC(=O)NN=Cc1ccc(F)c(Br)c1	ZINC000872402824	ED	On-Demand	Reactive	ADCYAP1R1	52	31
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1Cl	ZINC000872402826	ED	On-Demand	Reactive	GCGR	25	47
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1Cl	ZINC000872402826	ED	On-Demand	Reactive	PDE10A	16	41
C#CCOc1ccc(C(C)=NNC(=O)COCCOC)cc1	ZINC000872402830	DD	On-Demand	Reactive	PLA2G4B	40	33
COCCOCC(=O)NN=Cc1cccc(OCc2ccccc2F)c1	ZINC000872402831	FF	On-Demand	Reactive	ADCYAP1R1	68	43
COCCOCC(=O)NN=Cc1c(C)nn(-c2ccc(F)cc2)c1C	ZINC000872402834	ED	On-Demand	Reactive	P2RX7	19	41
COCCOCC(=O)NN=C(C)c1cccc(C#N)c1	ZINC000872402843	CD	On-Demand	Reactive	ABAT	20	41
COCCOCC(=O)NN=Cc1ccc(SC)c(OC)c1	ZINC000872402848	DD	On-Demand	Reactive	PDE10A	28	47
COCCOCC(=O)NN=Cc1ccc(SC)c(OC)c1	ZINC000872402848	DD	On-Demand	Reactive	ADCYAP1R1	44	36
COCCOCC(=O)NN=C(C)c1ccc(OC)cc1O	ZINC000872402854	CC	On-Demand	Reactive	PYK	46	43
COCCOCC(=O)NN=Cc1ccncc1	ZINC000872402855	BC	On-Demand	Reactive	PDE10A	16	46
COCCOCC(=O)NN=C(C)c1ccccc1OC	ZINC000872402856	CD	On-Demand	Reactive	ABAT	18	41
COCCOCC(=O)NN=C(C)c1ccccc1OC	ZINC000872402856	CD	On-Demand	Reactive	KCNK3	34	41
COCCOCC(=O)NN=C(C)c1ccccc1OC	ZINC000872402856	CD	On-Demand	Reactive	KCNK9	26	41
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1	ZINC000872402861	CC	On-Demand	Reactive	PDE10A	29	55
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1	ZINC000872402861	CC	On-Demand	Reactive	UREA_CANEN	26	46
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1	ZINC000872402861	CC	On-Demand	Reactive	ADCYAP1R1	47	42
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1	ZINC000872402861	CC	On-Demand	Reactive	ENPP1	54	30
COCCOCC(=O)NN=Cc1ccc2ncccc2c1	ZINC000872402862	CD	On-Demand	Reactive	PDE10A	18	43
COCCOCC(=O)NN=Cc1ccc2ncccc2c1	ZINC000872402862	CD	On-Demand	Reactive	ADCYAP1R1	57	32
COCCOCC(=O)NN=C1CCCc2ccccc21	ZINC000872402867	CD	On-Demand	Reactive	ABAT	17	58
COCCOCC(=O)NN=C(C)c1ccccc1	ZINC000872402870	CD	On-Demand	Reactive	ABAT	33	40
COCCOCC(=O)NN=C(C)c1ccccc1	ZINC000872402870	CD	On-Demand	Reactive	PPO2	31	45
COCCOCC(=O)NN=Cc1cccc(C(F)(F)F)c1	ZINC000872402873	DD	On-Demand	Reactive	ADCYAP1R1	69	46
COCCOCC(=O)NN=Cc1ccnc2ccccc12	ZINC000872402879	CD	On-Demand	Reactive	GCGR	27	42
COCCOCC(=O)NN=Cc1ccc(OCC(C)C)cc1	ZINC000872402882	DD	On-Demand	Reactive	ADCYAP1R1	41	38
COCCOCC(=O)NN=Cc1ccc(OC)cc1OC(F)F	ZINC000872402884	ED	On-Demand	Reactive	PDE10A	17	40
COCCOCC(=O)NN=Cc1cccc(OC)c1O	ZINC000872402914	CC	On-Demand	Reactive	GCGR	29	41
COCCOCC(=O)NN=Cc1cccc(OC)c1O	ZINC000872402914	CC	On-Demand	Reactive	ADCYAP1R1	58	36
COCCOCC(=O)NN=Cc1cc(Cl)cc(Cl)c1OC	ZINC000872402915	EE	On-Demand	Reactive	GCGR	35	41
COCCOCC(=O)NN=Cc1cc(Cl)cc(Cl)c1OC	ZINC000872402915	EE	On-Demand	Reactive	ADCYAP1R1	52	35
COCCOCC(=O)NN=Cc1ccccc1	ZINC000872402918	BC	On-Demand	Reactive	PDE10A	20	42
COCCOCC(=O)NN=Cc1ccccc1	ZINC000872402918	BC	On-Demand	Reactive	ADCYAP1R1	60	38
COCCOCC(=O)NN=Cc1cc(OC)ccc1O	ZINC000872402922	CC	On-Demand	Reactive	ADCYAP1R1	70	34
c1cnc2nccc(NCc3ccnc(N4CCCC4)c3)c2c1	ZINC000872402927	DG	On-Demand	Anodyne	HNMT	57	38
O=C(c1ccc(CNc2nc(Cl)nc3sccc23)cc1)N1CCOCC1	ZINC000872402929	GG	On-Demand	Anodyne	LRRK2	19	42
COCCOCC(=O)NN=Cc1cc(Br)c(O)c(OC)c1	ZINC000872402937	FD	On-Demand	Reactive	PDE10A	26	43
COCCOCC(=O)NN=Cc1cc(Br)c(O)c(OC)c1	ZINC000872402937	FD	On-Demand	Reactive	ADCYAP1R1	46	39
COCCOCC(=O)NN=C(C)c1ccc(O)c(C)c1	ZINC000872402938	CD	On-Demand	Reactive	PYK	51	33
CCC(=NNC(=O)COCCOC)c1ccc(Cl)cc1	ZINC000872402944	CE	On-Demand	Reactive	UTS2	41	31
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	HTR1A	43	48
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	DRD2	35	48
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	DRD4	24	50
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	ADRA1D	21	42
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	HTR2A	26	48
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	ADRA1A	22	41
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	DRD3	20	48
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	HRP1_PLAFA	102	45
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	HTR7	40	43
c1cnc(N2CCN(CCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872402948	EE	On-Demand	Anodyne	HNMT	111	55
COCCOCC(=O)NN=C(C)c1ccc(N(C)C)cc1	ZINC000872402969	CD	On-Demand	Reactive	ESRRG	18	43
COCCOCC(=O)NN=Cc1ccc(C(=O)OC)cc1	ZINC000872402970	CC	On-Demand	Reactive	ESRRG	15	43
COCCOCC(=O)NN=Cc1ccc(C(=O)OC)cc1	ZINC000872402970	CC	On-Demand	Reactive	ADCYAP1R1	61	37
O=C1Cc2cc(S(=O)(=O)Nc3ccc(F)c(C(F)F)c3)cc3c2N1CCC3	ZINC000872402975	GG	On-Demand	Anodyne	PKM	23	40
COCCOCC(=O)NN=Cc1ccc(Cl)c(Cl)c1	ZINC000872402980	DE	On-Demand	Reactive	PDE10A	21	43
COCCOCC(=O)NN=Cc1ccc(Cl)c(Cl)c1	ZINC000872402980	DE	On-Demand	Reactive	ADCYAP1R1	67	38
COCCOCC(=O)NN=C1CCCCc2ccccc21	ZINC000872402982	CD	On-Demand	Reactive	ABAT	16	55
COCCOCC(=O)NN=C(C)c1ccc(F)cc1	ZINC000872402985	CD	On-Demand	Reactive	ESRRG	17	41
COCCOCC(=O)NN=C(C)c1ccc(F)cc1	ZINC000872402985	CD	On-Demand	Reactive	PPO2	30	48
COCCOCC(=O)NN=Cc1ccc(C(F)(F)F)cc1	ZINC000872402986	DD	On-Demand	Reactive	ADCYAP1R1	52	42
COCCOCC(=O)NN=C(C)c1ccc2ccccc2c1	ZINC000872402991	DE	On-Demand	Reactive	PYK	42	33
COCCOCC(=O)NN=C/C=C/c1ccccc1OC	ZINC000872403009	CD	On-Demand	Reactive	TLR4	15	43
COCCOCC(=O)NN=C/C=C\c1ccccc1OC	ZINC000872403010	CD	On-Demand	Reactive	TLR4	15	43
Cn1ncc(S(=O)(=O)Nc2ccc(F)c(C(F)F)c2)c1C(F)(F)F	ZINC000872403017	FG	On-Demand	Anodyne	SGK1	49	35
COCCOCC(=O)NN=Cc1ccc(OC)c(F)c1	ZINC000872403024	CC	On-Demand	Reactive	TUBB1	24	42
COCCOCC(=O)NN=Cc1ccc(OC)c(F)c1	ZINC000872403024	CC	On-Demand	Reactive	PDE10A	26	52
COCCOCC(=O)NN=Cc1ccc(OC)c(F)c1	ZINC000872403024	CC	On-Demand	Reactive	ADCYAP1R1	63	38
COc1ccc(OC)c2sc(NC3CCN(C(=O)C4CC4)CC3)nc12	ZINC000872403043	FG	On-Demand	Anodyne	ADORA2B	18	41
COc1ccc(OC)c2sc(NC3CCN(C(=O)C4CC4)CC3)nc12	ZINC000872403043	FG	On-Demand	Anodyne	TTK	17	40
Cc1c(F)ncnc1N1CCC(c2ccccc2)CC1	ZINC000872403044	CG	On-Demand	Anodyne	SLC18A3	40	36
COCCOCC(=O)NN=Cc1ccc(-n2ccnc2)cc1	ZINC000872403046	DC	On-Demand	Reactive	CYP2C19	16	40
COCCOCC(=O)NN=Cc1ccc(C(=O)NC2CC2)cc1	ZINC000872403049	DC	On-Demand	Reactive	ADCYAP1R1	48	33
COCCOCC(=O)NN=Cc1ccc(OC)c(Br)c1	ZINC000872403050	ED	On-Demand	Reactive	PDE10A	27	44
COCCOCC(=O)NN=Cc1ccc(OC)c(Br)c1	ZINC000872403050	ED	On-Demand	Reactive	UREA_CANEN	17	41
COCCOCC(=O)NN=Cc1ccc(OC)c(Br)c1	ZINC000872403050	ED	On-Demand	Reactive	ADCYAP1R1	43	36
COc1cccc(C(=O)NCCNc2cc(C)nc3c2cnn3C)c1	ZINC000872403055	EE	On-Demand	Anodyne	DRD4	57	45
COc1cccc(C(=O)NCCNc2cc(C)nc3c2cnn3C)c1	ZINC000872403055	EE	On-Demand	Anodyne	NQO2	17	40
COc1cccc(C(=O)NCCNc2cc(C)nc3c2cnn3C)c1	ZINC000872403055	EE	On-Demand	Anodyne	PROKR1	53	31
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)c(OC)c1	ZINC000872403069	ED	On-Demand	Reactive	GCGR	16	45
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)c(OC)c1	ZINC000872403069	ED	On-Demand	Reactive	PDE10A	27	53
COCCOCC(=O)NN=Cc1cc(Cl)c(OC)c(OC)c1	ZINC000872403069	ED	On-Demand	Reactive	ADCYAP1R1	64	47
O=C(c1ccoc1)N1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872403072	GI	On-Demand	Anodyne	PRKD1	47	33
COCCOCC(=O)NN=Cc1ccc(O)c(Br)c1	ZINC000872403075	ED	On-Demand	Reactive	ADCYAP1R1	65	36
COCCOCC(=O)NN=Cc1ccc(OCc2ccccc2F)cc1	ZINC000872403091	FF	On-Demand	Reactive	ADCYAP1R1	65	45
O=C(C1CC1)N1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872403092	FH	On-Demand	Anodyne	PRKD1	58	41
O=C(C1CC1)N1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872403092	FH	On-Demand	Anodyne	GRM5	20	45
COCCOCC(=O)NN=Cc1cc(Cl)ccc1OC	ZINC000872403095	DD	On-Demand	Reactive	GCGR	26	43
COCCOCC(=O)NN=Cc1cc(Cl)ccc1OC	ZINC000872403095	DD	On-Demand	Reactive	PDE10A	17	41
COCCOCC(=O)NN=Cc1cc(Cl)ccc1OC	ZINC000872403095	DD	On-Demand	Reactive	ADCYAP1R1	42	35
COCCOCC(=O)NN=Cc1ccc(F)c(-c2cccs2)c1	ZINC000872403106	EF	On-Demand	Reactive	ADCYAP1R1	44	32
Nc1nc(NCc2ccc(C(=O)N3CCCC3)cc2)nc(C(F)F)n1	ZINC000872403109	EE	On-Demand	Anodyne	TPH1	32	40
Nc1nc(NCc2ccc(C(=O)N3CCCC3)cc2)nc(C(F)F)n1	ZINC000872403109	EE	On-Demand	Anodyne	DPP7	41	35
Nc1nc(NCc2ccc(C(=O)N3CCCC3)cc2)nc(C(F)F)n1	ZINC000872403109	EE	On-Demand	Anodyne	PTR1	48	37
Nc1nc(NCc2ccc(C(=O)N3CCCC3)cc2)nc(C(F)F)n1	ZINC000872403109	EE	On-Demand	Anodyne	L3MBTL3	64	37
COCCOCC(=O)NN=Cc1cc(C)c(OCc2ccccn2)c(C)c1	ZINC000872403113	FE	On-Demand	Reactive	PDE10A	21	41
COCCOCC(=O)NN=Cc1cc(C)c(OCc2ccccn2)c(C)c1	ZINC000872403113	FE	On-Demand	Reactive	ADCYAP1R1	58	40
COCCOCC(=O)NN=Cc1cccc(OC(C)C)c1	ZINC000872403115	CD	On-Demand	Reactive	PDE10A	20	40
COCCOCC(=O)NN=Cc1cccc(OC(C)C)c1	ZINC000872403115	CD	On-Demand	Reactive	ADCYAP1R1	52	36
COCCOCC(=O)NN=Cc1c[nH]c2ccc(F)cc12	ZINC000872403117	CD	On-Demand	Reactive	MPO	79	43
COCCOCC(=O)NN=C(C)c1oc2ccc(OC)cc2c1C	ZINC000872403118	EE	On-Demand	Reactive	MTNR1A	60	38
COCCOCC(=O)NN=C(C)c1oc2ccc(OC)cc2c1C	ZINC000872403118	EE	On-Demand	Reactive	MTNR1B	46	38
COCCOCC(=O)NN=Cc1c[nH]c2ccc(OC)cc12	ZINC000872403155	DD	On-Demand	Reactive	HTR1D	17	59
COCCOCC(=O)NN=Cc1c[nH]c2ccc(OC)cc12	ZINC000872403155	DD	On-Demand	Reactive	MTNR1A	36	45
COCCOCC(=O)NN=Cc1c[nH]c2ccc(OC)cc12	ZINC000872403155	DD	On-Demand	Reactive	MTNR1B	29	43
COCCOCC(=O)NN=Cc1cccc(OCc2ccccc2C#N)c1	ZINC000872403162	FE	On-Demand	Reactive	ADCYAP1R1	71	42
O=C(c1ccc(CN=c2cc[nH]cc2C2CC2)cc1)N1CCCC1	ZINC000872403182	DG	On-Demand	Anodyne	L3MBTL3	87	40
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1Cl	ZINC000872403188	DE	On-Demand	Reactive	ABAT	21	41
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1Cl	ZINC000872403188	DE	On-Demand	Reactive	ALPL	37	40
COCCOCC(=O)NN=C(C)c1ccc(N)cc1	ZINC000872403196	CC	On-Demand	Reactive	PPO2	31	41
COCCOCC(=O)NN=C1CCN(Cc2ccccc2)C1	ZINC000872403197	DD	On-Demand	Reactive	SIGMAR1	30	41
COCCOCC(=O)NN=C1CCN(Cc2ccccc2)C1	ZINC000872403197	DD	On-Demand	Reactive	NOD2	44	39
COCCOCC(=O)NN=Cc1cc(Cl)ccc1O	ZINC000872403213	CD	On-Demand	Reactive	GCGR	41	44
COCCOCC(=O)NN=Cc1cc(Cl)ccc1O	ZINC000872403213	CD	On-Demand	Reactive	ADCYAP1R1	78	36
COCCOCC(=O)NN=Cc1ccc(-n2cccn2)cc1	ZINC000872403214	DC	On-Demand	Reactive	AMP1_PLAFQ	55	39
COCCOCC(=O)NN=Cc1ccc(-n2cccn2)cc1	ZINC000872403214	DC	On-Demand	Reactive	PDE10A	15	49
COCCOCC(=O)NN=C(C)c1nc2ccccc2s1	ZINC000872403216	DD	On-Demand	Reactive	TMPRSS6	44	32
COCCOCC(=O)NN=Cc1c(Cl)cccc1Cl	ZINC000872403225	DE	On-Demand	Reactive	ADCYAP1R1	65	34
c1cnc(N2CCN(CCCN=c3cc[nH]cc3C3CC3)CC2)nc1	ZINC000872403227	ED	On-Demand	Anodyne	HTR1A	16	46
c1cnc(N2CCN(CCCN=c3cc[nH]cc3C3CC3)CC2)nc1	ZINC000872403227	ED	On-Demand	Anodyne	DRD4	16	47
COCCOCC(=O)NN=Cc1cc(OC)cc(OC)c1	ZINC000872403230	CC	On-Demand	Reactive	PDE10A	22	47
COCCOCC(=O)NN=Cc1cc(OC)cc(OC)c1	ZINC000872403230	CC	On-Demand	Reactive	ADCYAP1R1	46	34
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)C2CC2)CC1	ZINC000872403234	EH	On-Demand	Anodyne	EPHX2	23	40
NC(=O)c1cc(N2CCC(c3ccccc3)CC2)nc(Cl)n1	ZINC000872403235	DF	On-Demand	Anodyne	SCD1	15	42
COCCOCC(=O)NN=Cc1cc(OC)c(OC)c(OC)c1	ZINC000872403249	EC	On-Demand	Reactive	TUBB1	41	33
COCCOCC(=O)NN=Cc1cc(OC)c(OC)c(OC)c1	ZINC000872403249	EC	On-Demand	Reactive	PDE10A	29	58
COCCOCC(=O)NN=Cc1cc(OC)c(OC)c(OC)c1	ZINC000872403249	EC	On-Demand	Reactive	UREA_CANEN	15	54
COCCOCC(=O)NN=Cc1cc(OC)c(OC)c(OC)c1	ZINC000872403249	EC	On-Demand	Reactive	ADCYAP1R1	46	45
COCCOCC(=O)NN=C(C)c1ccc(OCC(=O)N2CCCC2)cc1	ZINC000872403250	GD	On-Demand	Reactive	PLA2G4B	40	33
COCCOCC(=O)NN=Cc1ccc2cc(OC)ccc2c1	ZINC000872403254	DD	On-Demand	Reactive	PDE10A	20	41
COCCOCC(=O)NN=Cc1ccc2cc(OC)ccc2c1	ZINC000872403254	DD	On-Demand	Reactive	UREA_CANEN	17	41
COCCOCC(=O)NN=Cc1ccc2cc(OC)ccc2c1	ZINC000872403254	DD	On-Demand	Reactive	ADCYAP1R1	59	34
COCCOCC(=O)NN=Cc1ccccc1OCc1ccccc1	ZINC000872403257	EE	On-Demand	Reactive	GCGR	27	42
COCCOCC(=O)NN=Cc1ccccc1OCc1ccccc1	ZINC000872403257	EE	On-Demand	Reactive	ADCYAP1R1	72	44
COCCOCC(=O)NN=C(C)c1ccc(O)c(OC)c1	ZINC000872403258	CC	On-Demand	Reactive	PYK	42	35
COCCOCC(=O)NN=C(C)c1ccc(O)c(OC)c1	ZINC000872403258	CC	On-Demand	Reactive	ADCYAP1R1	42	36
COc1ccc(OC)c2sc(NC3CCN(C(=O)c4ccoc4)CC3)nc12	ZINC000872403263	GH	On-Demand	Anodyne	ADORA2B	18	45
COCCOCC(=O)NN=C(C)c1ccc(OC(C)C)cc1	ZINC000872403265	DD	On-Demand	Reactive	PPO2	30	40
COCCOCC(=O)NN=Cc1cc(Cl)cc(Cl)c1O	ZINC000872403266	DD	On-Demand	Reactive	ADCYAP1R1	46	34
COc1cccc(C(=O)NCCN=c2cc[nH]cc2C2CC2)c1	ZINC000872403267	DE	On-Demand	Anodyne	DRD4	57	43
COc1ccc(OC)c2sc(N[C@H](C)CO)nc12	ZINC000872403270	CE	On-Demand	Anodyne	ADORA2B	17	42
COc1ccc(OC)c2sc(N[C@@H](C)CO)nc12	ZINC000872403271	CE	On-Demand	Anodyne	ADORA2B	17	42
COCCOCC(=O)NN=C(C)c1nc2ccccc2n1C	ZINC000872403272	DD	On-Demand	Reactive	PYK	35	54
COCCOCC(=O)NN=Cc1ccccc1C(F)(F)F	ZINC000872403276	DD	On-Demand	Reactive	ADCYAP1R1	43	30
COCCOCC(=O)NN=Cc1cccc(Cl)c1Cl	ZINC000872403277	DE	On-Demand	Reactive	GCGR	27	40
COCCOCC(=O)NN=Cc1cccc(Cl)c1Cl	ZINC000872403277	DE	On-Demand	Reactive	ADCYAP1R1	68	34
COCCOCC(=O)NN=C(C)c1ccc(O)cc1	ZINC000872403279	CC	On-Demand	Reactive	ESRRG	20	51
CCOc1cc(C=NNC(=O)COCCOC)cc(Br)c1O	ZINC000872403280	GD	On-Demand	Reactive	PDE10A	21	45
CCOc1cc(C=NNC(=O)COCCOC)cc(Br)c1O	ZINC000872403280	GD	On-Demand	Reactive	ADCYAP1R1	43	35
COCCOCC(=O)NN=Cc1c(C)nn(Cc2ccccc2Cl)c1C	ZINC000872403282	GE	On-Demand	Reactive	P2RX7	21	41
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1OC	ZINC000872403286	GD	On-Demand	Anodyne	RBP4	19	40
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1OC	ZINC000872403286	GD	On-Demand	Anodyne	LRRK2	15	40
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1OC	ZINC000872403286	GD	On-Demand	Anodyne	HPGD	26	40
COCCOCC(=O)NN=C(C)c1cc(F)ccc1O	ZINC000872403294	CD	On-Demand	Reactive	PYK	80	44
COCCOCC(=O)NN=Cc1cc(Cl)c(O)c(OC)c1	ZINC000872403298	DD	On-Demand	Reactive	GCGR	18	43
COCCOCC(=O)NN=Cc1cc(Cl)c(O)c(OC)c1	ZINC000872403298	DD	On-Demand	Reactive	PDE10A	25	43
COCCOCC(=O)NN=Cc1cc(Cl)c(O)c(OC)c1	ZINC000872403298	DD	On-Demand	Reactive	ADCYAP1R1	73	45
CCOc1cc(C=NNC(=O)COCCOC)cc(Cl)c1O	ZINC000872403299	ED	On-Demand	Reactive	PDE10A	17	45
CCOc1cc(C=NNC(=O)COCCOC)cc(Cl)c1O	ZINC000872403299	ED	On-Demand	Reactive	ADCYAP1R1	69	41
Cc1nn(C)cc1S(=O)(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1	ZINC000872403306	FD	On-Demand	Unstable	NR1I2	43	37
COCCOCC(=O)NN=Cc1ccc(OCc2cccc(F)c2)cc1	ZINC000872403307	FF	On-Demand	Reactive	MAOB	30	45
COCCOCC(=O)NN=Cc1ccc(OCc2cccc(F)c2)cc1	ZINC000872403307	FF	On-Demand	Reactive	GYS1	40	32
COCCOCC(=O)NN=Cc1ccc(OCc2cccc(F)c2)cc1	ZINC000872403307	FF	On-Demand	Reactive	ADCYAP1R1	75	49
COCCOCC(=O)NN=C(C)c1cc(OC)ccc1O	ZINC000872403313	CC	On-Demand	Reactive	MTNR1A	62	40
COCCOCC(=O)NN=C(C)c1cc(OC)ccc1O	ZINC000872403313	CC	On-Demand	Reactive	MTNR1B	53	40
COCCOCC(=O)NN=C(C)c1cc(OC)ccc1O	ZINC000872403313	CC	On-Demand	Reactive	PYK	81	48
COCCOCC(=O)NN=Cc1ccc(N(C)c2ccccc2)cc1	ZINC000872403314	EF	On-Demand	Reactive	ESRRG	15	43
COCCOCC(=O)NN=C(C)c1ccc(OC)cc1OC	ZINC000872403318	DD	On-Demand	Reactive	MTNR1A	40	35
COCCOCC(=O)NN=C(C)c1cc(C)ccc1O	ZINC000872403322	CD	On-Demand	Reactive	PYK	80	37
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872403323	EF	On-Demand	Anodyne	NPY2R	25	42
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872403323	EF	On-Demand	Anodyne	GRM5	19	44
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872403323	EF	On-Demand	Anodyne	SMO	15	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872403323	EF	On-Demand	Anodyne	HPGD	42	41
COCCOCC(=O)NN=C(C)c1ccc(F)c(Br)c1	ZINC000872403336	EE	On-Demand	Reactive	PYK	40	35
COCCOCC(=O)NN=C(C)c1cccc(F)c1	ZINC000872403341	CD	On-Demand	Reactive	ABAT	21	43
CCOc1ccccc1C=NNC(=O)COCCOC	ZINC000872403344	CD	On-Demand	Reactive	ADCYAP1R1	42	34
COCCOCC(=O)NN=Cc1ccc(F)c(F)c1	ZINC000872403345	CD	On-Demand	Reactive	PDE10A	17	41
COCCOCC(=O)NN=Cc1ccc(F)c(F)c1	ZINC000872403345	CD	On-Demand	Reactive	ADCYAP1R1	59	32
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc(F)c(C(F)F)c3)ccc21	ZINC000872403347	GH	On-Demand	Anodyne	PKM	24	41
COCCOCC(=O)NN=Cc1ccccc1F	ZINC000872403350	CC	On-Demand	Reactive	ABAT	19	42
COCCOCC(=O)NN=C(C)c1ccccc1F	ZINC000872403351	CD	On-Demand	Reactive	ABAT	19	43
COCCOCC(=O)NN=Cc1ccc(O)c(OC)c1	ZINC000872403352	CC	On-Demand	Reactive	GCGR	22	46
COCCOCC(=O)NN=Cc1ccc(O)c(OC)c1	ZINC000872403352	CC	On-Demand	Reactive	PDE10A	27	45
COCCOCC(=O)NN=Cc1ccc(O)c(OC)c1	ZINC000872403352	CC	On-Demand	Reactive	ADCYAP1R1	74	44
COCCOCC(=O)NN=Cc1cccc2ccccc12	ZINC000872403354	CD	On-Demand	Reactive	GCGR	33	43
COCCOCC(=O)NN=Cc1cccc2ccccc12	ZINC000872403354	CD	On-Demand	Reactive	CHAT	45	33
COCCOCC(=O)NN=Cc1ccc(C(=O)O)cc1	ZINC000872403360	CC	On-Demand	Reactive	ESRRG	15	43
COCCOCC(=O)NN=Cc1ccc(C(=O)O)cc1	ZINC000872403360	CC	On-Demand	Reactive	ADCYAP1R1	64	39
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1OC	ZINC000872403381	EC	On-Demand	Reactive	GCGR	24	47
COCCOCC(=O)NN=Cc1ccc(OC)c(OC)c1OC	ZINC000872403381	EC	On-Demand	Reactive	PDE10A	20	43
COCCOCC(=O)NN=C(C)c1ccc(Br)cc1	ZINC000872403388	ED	On-Demand	Reactive	PPO2	30	49
COCCOCC(=O)NN=C(C)c1ccc(Br)cc1	ZINC000872403388	ED	On-Demand	Reactive	PYK	79	36
Cn1ncc2c(NCCCN3CCN(c4ncccn4)CC3)nc(Cl)nc21	ZINC000872403392	GD	On-Demand	Anodyne	HTR1A	19	41
Cn1ncc2c(NCCCN3CCN(c4ncccn4)CC3)nc(Cl)nc21	ZINC000872403392	GD	On-Demand	Anodyne	ADRA1A	15	40
Cn1ncc2c(NCCCN3CCN(c4ncccn4)CC3)nc(Cl)nc21	ZINC000872403392	GD	On-Demand	Anodyne	HRP1_PLAFA	61	33
Cn1ncc2c(NCCCN3CCN(c4ncccn4)CC3)nc(Cl)nc21	ZINC000872403392	GD	On-Demand	Anodyne	HNMT	44	34
COCCOCC(=O)NN=Cc1cc(OC)c(O)cc1Br	ZINC000872403398	FD	On-Demand	Reactive	PDE10A	15	44
COCCOCC(=O)NN=Cc1ccc(Oc2cccnc2)c(C)c1	ZINC000872403400	EE	On-Demand	Reactive	PDE10A	17	40
COc1ccc(OC)c2sc(NCCC(=O)N3CCOCC3)nc12	ZINC000872403404	FD	On-Demand	Anodyne	ADORA2B	18	51
COCCOCC(=O)NN=C(C)c1ccc(OCC(F)(F)F)cc1	ZINC000872403405	EE	On-Demand	Reactive	PLA2G4B	40	33
COCCOCC(=O)NN=C(C)c1ccc(OCC(F)(F)F)cc1	ZINC000872403405	EE	On-Demand	Reactive	PPO2	35	40
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCC1	ZINC000872403419	EG	On-Demand	Anodyne	HNMT	54	36
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCC1	ZINC000872403419	EG	On-Demand	Anodyne	L3MBTL3	52	42
O=C(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCC1	ZINC000872403419	EG	On-Demand	Anodyne	NAMPT	21	46
COCCOCC(=O)NN=Cc1cccc(OCC#N)c1	ZINC000872403426	CC	On-Demand	Reactive	ADCYAP1R1	51	38
C=CCOc1ccc(C=NNC(=O)COCCOC)cc1Cl	ZINC000872403432	EE	On-Demand	Reactive	PDE10A	17	42
C=CCOc1ccc(C=NNC(=O)COCCOC)cc1Cl	ZINC000872403432	EE	On-Demand	Reactive	ADCYAP1R1	66	38
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	DRD4	57	45
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	MAPK14	17	44
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	CTSL	28	42
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	CTSS	18	48
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	TAAR1	32	41
COc1cccc(C(=O)NCCNc2ncnc(F)c2C)c1	ZINC000872403435	DD	On-Demand	Anodyne	KCNK3	36	45
COCCOCC(=O)NN=C(C)c1ccc(OCC(=O)N(C)C)cc1	ZINC000872403438	FC	On-Demand	Reactive	PLA2G4B	40	33
COCCOCC(=O)NN=C(C)c1ccc(OCC(=O)N(C)C)cc1	ZINC000872403438	FC	On-Demand	Reactive	PPO2	36	40
COCCOCC(=O)NN=Cc1cccc(OC)c1OC(F)F	ZINC000872403441	ED	On-Demand	Reactive	GCGR	28	42
COCCOCC(=O)NN=Cc1cccc(OC)c1OC(F)F	ZINC000872403441	ED	On-Demand	Reactive	PDE10A	19	41
COCCOCC(=O)NN=Cc1cccc(OC)c1OC(F)F	ZINC000872403441	ED	On-Demand	Reactive	ADCYAP1R1	51	33
COCCOCC(=O)NN=Cc1cccc(OC(F)F)c1	ZINC000872403449	DD	On-Demand	Reactive	PDE10A	19	40
COCCOCC(=O)NN=Cc1cccc(OC(F)F)c1	ZINC000872403449	DD	On-Demand	Reactive	ADCYAP1R1	57	38
COCCOCC(=O)NN=Cc1ccc(OCc2ccncc2)cc1	ZINC000872403451	ED	On-Demand	Reactive	ADCYAP1R1	67	46
CC(C)CN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872403457	DF	On-Demand	Anodyne	EHMT2	62	32
CC(C)CN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872403457	DF	On-Demand	Anodyne	Q4VQ11_PIG	40	34
COCCOCC(=O)NN=Cc1ccc(OC)cc1O	ZINC000872403459	CC	On-Demand	Reactive	GCGR	32	42
COCCOCC(=O)NN=Cc1ccc(OC)cc1O	ZINC000872403459	CC	On-Demand	Reactive	ADCYAP1R1	65	34
COCCOCC(=O)NN=Cc1cc(C)c(O)c(C)c1	ZINC000872403466	CD	On-Demand	Reactive	ADCYAP1R1	42	38
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(OC)c1	ZINC000872403471	ED	On-Demand	Reactive	PDE10A	28	49
COCCOCC(=O)NN=Cc1ccc(OC(F)F)c(OC)c1	ZINC000872403471	ED	On-Demand	Reactive	ADCYAP1R1	44	40
COCCOCC(=O)NN=Cc1cn(CCC#N)c2ccccc12	ZINC000872403474	ED	On-Demand	Reactive	GCGR	16	41
COCCOCC(=O)NN=Cc1cccc(OC)c1OC	ZINC000872403493	CC	On-Demand	Reactive	GCGR	33	46
COCCOCC(=O)NN=Cc1cccc(OC)c1OC	ZINC000872403493	CC	On-Demand	Reactive	PDE10A	20	44
COCCOCC(=O)NN=Cc1cccc(OC)c1OC	ZINC000872403493	CC	On-Demand	Reactive	ADCYAP1R1	53	36
COCCOCC(=O)NN=C(C)c1cccc(C(F)(F)F)c1	ZINC000872403495	DE	On-Demand	Reactive	ABAT	20	41
COCCOCC(=O)NN=C(C)c1cccc(C(F)(F)F)c1	ZINC000872403495	DE	On-Demand	Reactive	CCR2	65	39
COCCOCC(=O)NN=C(C)c1cccc(C(F)(F)F)c1	ZINC000872403495	DE	On-Demand	Reactive	ADCYAP1R1	42	35
COCCOCC(=O)NN=C(C)c1cccc(C(F)(F)F)c1	ZINC000872403495	DE	On-Demand	Reactive	KCNK3	18	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000872403504	ED	On-Demand	Anodyne	PDGFRB	19	41
COCCOCC(=O)NN=Cc1ccc(OC)cc1OC	ZINC000872403529	CC	On-Demand	Reactive	GCGR	18	43
COCCOCC(=O)NN=Cc1ccc(OC)cc1OC	ZINC000872403529	CC	On-Demand	Reactive	CYP1B1	30	42
COCCOCC(=O)NN=Cc1ccc(OC)cc1OC	ZINC000872403529	CC	On-Demand	Reactive	CYP1A1	40	42
COCCOCC(=O)NN=Cc1ccc(OC)cc1OC	ZINC000872403529	CC	On-Demand	Reactive	PDE10A	19	43
COCCOCC(=O)NN=Cc1cc(Br)ccc1O	ZINC000872403531	ED	On-Demand	Reactive	GCGR	35	40
COCCOCC(=O)NN=Cc1cc(Br)ccc1O	ZINC000872403531	ED	On-Demand	Reactive	PYK	79	42
COCCOCC(=O)NN=Cc1cc(Br)ccc1O	ZINC000872403531	ED	On-Demand	Reactive	ADCYAP1R1	49	32
O=C(c1ccccc1OC(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872403532	GE	On-Demand	Anodyne	NPY2R	25	42
COCCOCC(=O)NN=C(C)c1ccc2c(c1)CCC(=O)N2	ZINC000872403543	DD	On-Demand	Reactive	HDAC9	18	45
c1ccc(-c2cc(NCC[C@@H]3CCCO3)ncn2)cc1	ZINC000872403548	CG	On-Demand	Anodyne	TNK2	61	44
c1ccc(-c2cc(NCC[C@H]3CCCO3)ncn2)cc1	ZINC000872403550	CG	On-Demand	Anodyne	TNK2	61	44
CCOc1cc(C=NNC(=O)COCCOC)ccc1OC	ZINC000872403553	DD	On-Demand	Reactive	PDE10A	27	55
CCOc1cc(C=NNC(=O)COCCOC)ccc1OC	ZINC000872403553	DD	On-Demand	Reactive	UREA_CANEN	18	47
CCOc1cc(C=NNC(=O)COCCOC)ccc1OC	ZINC000872403553	DD	On-Demand	Reactive	ADCYAP1R1	46	39
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1OC	ZINC000872403555	FD	On-Demand	Anodyne	PDGFRB	82	46
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1OC	ZINC000872403555	FD	On-Demand	Anodyne	PDE3B	42	36
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1OC	ZINC000872403555	FD	On-Demand	Anodyne	HPGD	40	39
COCCOCC(=O)NN=Cc1cccc(OCc2ccccc2)c1	ZINC000872403557	EE	On-Demand	Reactive	UREA_CANEN	18	44
COCCOCC(=O)NN=Cc1cccc(OCc2ccccc2)c1	ZINC000872403557	EE	On-Demand	Reactive	ADCYAP1R1	77	48
COCCOCC(=O)NN=Cc1ccc(C)c(F)c1	ZINC000872403563	CD	On-Demand	Reactive	PDE10A	15	42
COCCOCC(=O)NN=Cc1ccc(C)c(F)c1	ZINC000872403563	CD	On-Demand	Reactive	ADCYAP1R1	57	32
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1-c1ccccc1	ZINC000872403571	FE	On-Demand	Reactive	PDE10A	19	43
Nc1nc(C(F)F)nc(N2CCC[C@@H]2Cc2ccccc2)n1	ZINC000872403575	DF	On-Demand	Anodyne	SLC18A2	25	40
Nc1nc(C(F)F)nc(N2CCC[C@H]2Cc2ccccc2)n1	ZINC000872403579	DF	On-Demand	Anodyne	SLC18A2	25	40
Cc1c(F)ncnc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403584	CD	On-Demand	Anodyne	PRKD1	18	42
Cc1c(F)ncnc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403584	CD	On-Demand	Anodyne	SIRT3	50	37
Cc1c(F)ncnc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403584	CD	On-Demand	Anodyne	LIMK2	16	44
COCCOCC(=O)NN=C(C)c1cccc(C)c1	ZINC000872403595	CD	On-Demand	Reactive	ABAT	26	44
COCCOCC(=O)NN=C(C)c1cccc(C)c1	ZINC000872403595	CD	On-Demand	Reactive	KCNK3	64	40
COCCOCC(=O)NN=C(C)c1cccc(C)c1	ZINC000872403595	CD	On-Demand	Reactive	KCNK9	46	40
COCCOCC(=O)NN=Cc1ccccc1OCc1ccncc1	ZINC000872403613	ED	On-Demand	Reactive	ADCYAP1R1	52	38
COCCOCC(=O)NN=Cc1ccc(OC)c(C)c1	ZINC000872403623	CD	On-Demand	Reactive	PDE10A	27	45
COCCOCC(=O)NN=Cc1ccc(OC)c(C)c1	ZINC000872403623	CD	On-Demand	Reactive	ADCYAP1R1	44	38
COCCOCC(=O)NN=Cc1ccc(OC)cc1	ZINC000872403624	CC	On-Demand	Reactive	PDE10A	21	40
COCCOCC(=O)NN=Cc1ccc(OC)cc1	ZINC000872403624	CC	On-Demand	Reactive	UREA_CANEN	25	40
COCCOCC(=O)NN=Cc1ccc(OC)cc1	ZINC000872403624	CC	On-Demand	Reactive	ADCYAP1R1	50	37
COc1ccc(C(=O)N2CCN(c3cc(C)nc4c3cnn4C)CC2)cc1OC	ZINC000872403631	GE	On-Demand	Anodyne	SSTR1	40	41
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872403632	FG	On-Demand	Anodyne	P2RY12	16	41
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872403632	FG	On-Demand	Anodyne	CCKAR	50	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872403632	FG	On-Demand	Anodyne	AKT3	24	41
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000872403632	FG	On-Demand	Anodyne	AKT1	27	41
COCCOCC(=O)NN=Cc1c(O)cccc1OC	ZINC000872403634	CC	On-Demand	Reactive	GCGR	21	40
COCCOCC(=O)NN=Cc1c(O)cccc1OC	ZINC000872403634	CC	On-Demand	Reactive	PDE10A	18	40
COCCOCC(=O)NN=Cc1c(O)cccc1OC	ZINC000872403634	CC	On-Demand	Reactive	ADCYAP1R1	68	38
COCCOCC(=O)NN=Cc1cnc(-c2ccccc2)nc1	ZINC000872403636	DD	On-Demand	Reactive	ADCYAP1R1	59	37
CCOc1ccc(C=NNC(=O)COCCOC)cc1	ZINC000872403638	CD	On-Demand	Reactive	ADCYAP1R1	46	40
COCCOCC(=O)NN=Cc1cccc(Cl)c1	ZINC000872403640	CD	On-Demand	Reactive	ABAT	26	42
COCCOCC(=O)NN=Cc1cccc(Cl)c1	ZINC000872403640	CD	On-Demand	Reactive	UREA_CANEN	22	50
COCCOCC(=O)NN=Cc1cccc(Cl)c1	ZINC000872403640	CD	On-Demand	Reactive	ADCYAP1R1	71	37
O=C(c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872403649	FE	On-Demand	Anodyne	SMO	19	45
O=C(c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872403649	FE	On-Demand	Anodyne	L3MBTL3	40	33
CCC(=NNC(=O)COCCOC)c1ccc2cc(OC)ccc2c1	ZINC000872403653	EF	On-Demand	Reactive	MTNR1A	62	38
CCC(=NNC(=O)COCCOC)c1ccc2cc(OC)ccc2c1	ZINC000872403653	EF	On-Demand	Reactive	MTNR1B	51	36
Cc1c(F)ncnc1NCCN1CCc2ccccc2C1	ZINC000872403677	CE	On-Demand	Anodyne	NOD2	41	37
Cc1cccc(C(=O)N2CCCN(c3ccnc4ncccc34)CC2)c1	ZINC000872403705	EG	On-Demand	Anodyne	PARP1	15	41
Cc1cccc(C(=O)N2CCCN(c3ccnc4ncccc34)CC2)c1	ZINC000872403705	EG	On-Demand	Anodyne	SMO	18	41
Cc1cccc(C(=O)N2CCCN(c3ccnc4ncccc34)CC2)c1	ZINC000872403705	EG	On-Demand	Anodyne	HPGD	43	41
CCC(=O)c1c(Cl)cccc1NCCCNC(C)=O	ZINC000872403714	CF	On-Demand	Anodyne	ECR	42	36
O=C(c1ccc(F)cc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872403739	EG	On-Demand	Anodyne	NPY2R	20	44
O=C(c1ccc(F)cc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872403739	EG	On-Demand	Anodyne	SLC9A1	28	42
O=C(c1ccc(F)cc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872403739	EG	On-Demand	Anodyne	L3MBTL3	48	35
COCCOCC(=O)NN=C(C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872403765	ED	On-Demand	Reactive	DRD4	30	41
COCCOCC(=O)NN=C(C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872403766	ED	On-Demand	Reactive	DRD4	30	41
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872403770	EE	On-Demand	Anodyne	BDKRB1	15	40
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872403770	EE	On-Demand	Anodyne	BTK	39	40
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872403770	EE	On-Demand	Anodyne	STAT6	49	34
Cc1c(F)ncnc1NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000872403770	EE	On-Demand	Anodyne	LRRK2	31	41
COCCOCC(=O)NN=Cc1cccc(OC(F)(F)F)c1	ZINC000872403778	DD	On-Demand	Reactive	ADCYAP1R1	51	41
c1ccc(-c2cc(NCc3ccnc(N4CCCC4)c3)ncn2)cc1	ZINC000872403783	EH	On-Demand	Anodyne	HRH4	16	54
COCCOCC(=O)NN=Cc1ccc2c(c1)CCO2	ZINC000872403784	CC	On-Demand	Reactive	PDE10A	16	47
COCCOCC(=O)NN=Cc1c(Cl)cccc1OC(F)F	ZINC000872403785	EE	On-Demand	Reactive	ADCYAP1R1	65	33
COCCOCC(=O)NN=Cc1ccc(F)c(C)c1	ZINC000872403789	CD	On-Demand	Reactive	PDE10A	17	42
COCCOCC(=O)NN=Cc1ccc(F)c(C)c1	ZINC000872403789	CD	On-Demand	Reactive	ADCYAP1R1	57	32
NC(=O)c1cc(NCC2CC2)nc(Cl)n1	ZINC000872403800	BD	On-Demand	Anodyne	VCP	64	40
C=CCc1cc(C=NNC(=O)COCCOC)cc(OC)c1O	ZINC000872403804	DD	On-Demand	Reactive	PDE10A	22	40
COCCOCC(=O)NN=C1CCc2ccccc2C1	ZINC000872403817	CD	On-Demand	Reactive	ABAT	23	60
COCCOCC(=O)NN=Cc1cc(Cl)ccc1OCc1cccnc1	ZINC000872403821	GE	On-Demand	Reactive	PTGER1	49	41
COCCOCC(=O)NN=Cc1cc(Cl)ccc1OCc1cccnc1	ZINC000872403821	GE	On-Demand	Reactive	ADCYAP1R1	62	36
COCCOCC(=O)NN=C(C)c1cc2cccc(OC)c2o1	ZINC000872403833	DD	On-Demand	Reactive	PYK	40	36
CCCc1ccc(C(C)=NNC(=O)COCCOC)cc1	ZINC000872403835	CE	On-Demand	Reactive	PPO2	50	39
COCCOCC(=O)NN=C(C)c1ccc(C)cc1O	ZINC000872403836	CD	On-Demand	Reactive	PYK	51	33
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1O	ZINC000872403844	DD	On-Demand	Reactive	ABAT	20	40
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1O	ZINC000872403844	DD	On-Demand	Reactive	KCNMA1	26	40
COCCOCC(=O)NN=C(C)c1cc(Cl)ccc1O	ZINC000872403844	DD	On-Demand	Reactive	PYK	80	44
COCCOCC(=O)NN=C(C)c1cc(Cl)c(OC)cc1OC	ZINC000872403849	ED	On-Demand	Reactive	HTR4	47	36
COCCOCC(=O)NN=Cc1cc(Cl)c2c(c1)OCCO2	ZINC000872403855	ED	On-Demand	Reactive	ADCYAP1R1	40	33
COCCOCC(=O)NN=C(C)c1ccc(F)c(F)c1	ZINC000872403858	CD	On-Demand	Reactive	ABAT	25	41
COCCOCC(=O)NN=C1CCN(c2ccccn2)CC1	ZINC000872403859	DC	On-Demand	Reactive	DRD4	26	43
COCCOCC(=O)NN=Cc1ccc(OC)cc1Cl	ZINC000872403863	DD	On-Demand	Reactive	GCGR	34	41
COCCOCC(=O)NN=Cc1ccc(OC)cc1Cl	ZINC000872403863	DD	On-Demand	Reactive	ADCYAP1R1	65	34
COCCOCC(=O)NN=C(C)c1ccc(-n2cccn2)cc1	ZINC000872403880	DD	On-Demand	Reactive	AMP1_PLAFQ	56	39
COc1cccc(C(=O)NCCNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872403881	FD	On-Demand	Anodyne	DRD4	60	46
COc1cccc(C(=O)NCCNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872403881	FD	On-Demand	Anodyne	DRD3	15	46
COc1cccc(C(=O)NCCNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872403881	FD	On-Demand	Anodyne	PROKR1	55	33
COCCOCC(=O)NN=Cc1cc(OC)c(OC)cc1Br	ZINC000872403886	GD	On-Demand	Reactive	PDE10A	22	51
Cc1c(F)ncnc1NC1CCN(C(=O)C2CC2)CC1	ZINC000872403888	CD	On-Demand	Anodyne	CD38	29	41
Cc1c(F)ncnc1NC1CCN(C(=O)C2CC2)CC1	ZINC000872403888	CD	On-Demand	Anodyne	GPR119	33	42
COCCOCC(=O)NN=Cc1ccc2ccccc2c1	ZINC000872403891	CD	On-Demand	Reactive	PDE10A	19	42
COCCOCC(=O)NN=Cc1ccc2ccccc2c1	ZINC000872403891	CD	On-Demand	Reactive	ADCYAP1R1	61	37
COCCOCC(=O)NN=C(C)c1ccc(OC)c(CN2CCCCC2)c1	ZINC000872403902	GE	On-Demand	Reactive	SLC9A1	58	33
COCCOCC(=O)NN=Cc1cc(OC)c2c(c1)OCO2	ZINC000872403903	DC	On-Demand	Reactive	PDE10A	24	48
COCCOCC(=O)NN=Cc1cc(OC)c2c(c1)OCCO2	ZINC000872403910	DC	On-Demand	Reactive	PDE10A	25	48
C=CCOc1cccc(C=NNC(=O)COCCOC)c1	ZINC000872403913	CD	On-Demand	Reactive	ADCYAP1R1	62	39
COCCOCC(=O)NN=Cc1cccc(OCC(F)(F)F)c1	ZINC000872403916	ED	On-Demand	Reactive	ADCYAP1R1	64	46
COCCOCC(=O)NN=C(C)c1ccc(OC)c(CN2CCCC2)c1	ZINC000872403921	FD	On-Demand	Reactive	SLC9A1	59	33
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)c2ccoc2)CC1	ZINC000872403922	FI	On-Demand	Anodyne	L3MBTL3	58	35
COCCOCC(=O)NN=Cc1ccc(OC)c(OC(F)F)c1	ZINC000872403923	ED	On-Demand	Reactive	PDE10A	28	49
COCCOCC(=O)NN=Cc1ccc(OC)c(OC(F)F)c1	ZINC000872403923	ED	On-Demand	Reactive	ADCYAP1R1	44	38
COc1ccc(OC)c2sc(NCCNC(=O)c3ccco3)nc12	ZINC000872403924	EF	On-Demand	Anodyne	ADORA2A	15	42
COCCOCC(=O)NN=Cc1cccc(C#N)c1	ZINC000872403926	CC	On-Demand	Reactive	ADCYAP1R1	50	33
CCOc1ccc(O)c(C=NNC(=O)COCCOC)c1	ZINC000872403927	CC	On-Demand	Reactive	ADCYAP1R1	69	35
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	P2RY12	40	36
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	PRKD1	62	42
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	MAPK9	21	40
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	MAPK8	15	40
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	SFRP1	67	32
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	WNT3	53	31
O=C(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872403929	DF	On-Demand	Anodyne	VCP	51	35
CC(=O)NCCCNc1c(Br)ccc(C)c1C#N	ZINC000872403941	DF	On-Demand	Mild	TBK1	19	41
O=C(c1ccccc1F)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872403951	FE	On-Demand	Anodyne	SLC6A9	26	41
O=C(c1ccccc1F)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872403951	FE	On-Demand	Anodyne	PARP1	38	40
COCCOCC(=O)NN=Cc1cnn(-c2ccccc2)c1	ZINC000872403953	DC	On-Demand	Reactive	PDE10A	15	41
COCCOCC(=O)NN=C(C)c1cccc(OC(F)F)c1	ZINC000872403958	DD	On-Demand	Reactive	ABAT	19	40
COc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1OC	ZINC000872403960	FF	On-Demand	Anodyne	PDGFRB	27	40
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403965	FH	On-Demand	Anodyne	KCNQ2	54	35
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403965	FH	On-Demand	Anodyne	NPY2R	25	40
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403965	FH	On-Demand	Anodyne	MTNR1A	19	42
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403965	FH	On-Demand	Anodyne	MTNR1B	20	42
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCC(C)C)CC1	ZINC000872403965	FH	On-Demand	Anodyne	EPHX2	22	47
C[C@H]1CCCCN1C(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872403978	FE	On-Demand	Anodyne	CPT1A	61	37
C[C@@H]1CCCCN1C(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872403979	FE	On-Demand	Anodyne	CPT1A	61	37
COc1ccc(C(=O)N2CCN(c3nc(Cl)nc4c3cnn4C)CC2)cc1	ZINC000872403986	GD	On-Demand	Anodyne	NPBWR1	50	32
CN(Cc1ccc(F)c(F)c1)c1nc(N)nc(C(F)F)n1	ZINC000872404000	DE	On-Demand	Anodyne	DRTS_TOXGO	15	45
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872404004	EF	On-Demand	Anodyne	PDGFRB	33	44
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872404004	EF	On-Demand	Anodyne	CCKAR	19	40
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872404004	EF	On-Demand	Anodyne	SMO	26	53
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872404020	ED	On-Demand	Anodyne	PDGFRB	61	41
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872404020	ED	On-Demand	Anodyne	HPGD	18	42
O=S1(=O)CC[C@H](CNc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872404021	EF	On-Demand	Anodyne	VCP	20	41
O=S1(=O)CC[C@@H](CNc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872404022	EF	On-Demand	Anodyne	VCP	20	41
c1cnc2nccc(NCCc3cn4c(n3)CCCC4)c2c1	ZINC000872404023	CF	On-Demand	Anodyne	HNMT	75	42
CCNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872404036	CC	On-Demand	Anodyne	HTR1A	43	40
CCNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872404036	CC	On-Demand	Anodyne	DRD2	32	40
CCNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872404036	CC	On-Demand	Anodyne	HTR2A	23	40
CCNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872404036	CC	On-Demand	Anodyne	DRD3	32	40
CCNC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872404036	CC	On-Demand	Anodyne	SLC27A1	49	38
O=C(c1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872404050	ED	On-Demand	Anodyne	NPY2R	30	51
CCNC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872404051	CD	On-Demand	Anodyne	SLC27A1	42	35
NC(=O)c1cc(N2CCCN(C(=O)c3ccccc3)CC2)nc(Cl)n1	ZINC000872404052	FD	On-Demand	Anodyne	SMO	32	45
O=C(c1cccc(F)c1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404055	EG	On-Demand	Anodyne	HRH3	21	40
O=C(c1cccc(F)c1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404055	EG	On-Demand	Anodyne	NPY2R	23	46
COC(=O)CN(C)c1nc2c(OC)ccc(OC)c2s1	ZINC000872404061	CD	On-Demand	Anodyne	ADORA2B	17	45
Cc1c(F)ncnc1NCc1cccnc1N1CCOCC1	ZINC000872404068	DD	On-Demand	Anodyne	SCN10A	15	40
Cc1c(F)ncnc1NCc1cccnc1N1CCOCC1	ZINC000872404068	DD	On-Demand	Anodyne	STAT6	55	36
O=C(c1ccc(F)cc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404069	EG	On-Demand	Anodyne	NPY2R	15	42
O=C(c1ccc(F)cc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404069	EG	On-Demand	Anodyne	SLC9A1	21	40
O=C(c1ccc(F)cc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404069	EG	On-Demand	Anodyne	L3MBTL3	49	38
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872404070	DE	On-Demand	Anodyne	AKT1	31	44
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872404070	DE	On-Demand	Anodyne	SMO	18	47
Oc1nnc(Cl)cc1N[C@@H](CN1CCCC1)c1ccccc1	ZINC000872404072	DG	On-Demand	Anodyne	OPRK1	17	40
Oc1nnc(Cl)cc1N[C@H](CN1CCCC1)c1ccccc1	ZINC000872404073	DG	On-Demand	Anodyne	OPRK1	17	40
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	ADORA2B	19	42
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	NQO2	48	36
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	MTNR1A	65	43
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	MTNR1B	66	49
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	IKBKE	29	44
COc1ccc(OC)c2sc(NCCCNC(C)=O)nc12	ZINC000872404074	DE	On-Demand	Anodyne	TBK1	27	44
Cn1ncc2c(NCc3cccnc3N3CCOCC3)nc(Cl)nc21	ZINC000872404080	FD	On-Demand	Anodyne	PIK3CA	29	41
Cn1ncc2c(NCc3cccnc3N3CCOCC3)nc(Cl)nc21	ZINC000872404080	FD	On-Demand	Anodyne	SCN10A	19	45
Cn1ncc2c(NCc3cccnc3N3CCOCC3)nc(Cl)nc21	ZINC000872404080	FD	On-Demand	Anodyne	PDE10A	15	40
Cn1ncc2c(NCc3cccnc3N3CCOCC3)nc(Cl)nc21	ZINC000872404080	FD	On-Demand	Anodyne	STAT6	49	36
O=S1(=O)CC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872404081	DD	On-Demand	Anodyne	VCP	60	38
O=S1(=O)CC[C@@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872404082	DD	On-Demand	Anodyne	VCP	60	38
NC(=O)c1cc(NC[C@@H](c2ccccc2)N2CCOCC2)nc(Cl)n1	ZINC000872404091	FD	On-Demand	Anodyne	CASR	48	38
NC(=O)c1cc(NC[C@@H](c2ccccc2)N2CCOCC2)nc(Cl)n1	ZINC000872404091	FD	On-Demand	Anodyne	STAT6	48	34
NC(=O)c1cc(NC[C@H](c2ccccc2)N2CCOCC2)nc(Cl)n1	ZINC000872404092	FD	On-Demand	Anodyne	CASR	48	38
NC(=O)c1cc(NC[C@H](c2ccccc2)N2CCOCC2)nc(Cl)n1	ZINC000872404092	FD	On-Demand	Anodyne	STAT6	48	34
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(F)cc3C(C)(F)F)ccc21	ZINC000872404098	GH	On-Demand	Anodyne	MOGAT2	41	35
Cn1ncc2c(N3CCCN(C(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872404113	FE	On-Demand	Anodyne	SMO	44	47
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2cccc3c2CCCC3)cc1	ZINC000872404114	FH	On-Demand	Anodyne	HDAC1	20	47
COc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872404120	EF	On-Demand	Anodyne	SLC18A3	17	44
COc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872404120	EF	On-Demand	Anodyne	L3MBTL3	41	34
COc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872404120	EF	On-Demand	Anodyne	NPBWR1	58	33
Cc1cc([C@@H]2CCCN2c2cc(-c3cccc(Cl)c3)ncn2)no1	ZINC000872404135	EI	On-Demand	Anodyne	GRM5	18	51
COc1ccc(OC)c2sc(NCCCNS(C)(=O)=O)nc12	ZINC000872404139	ED	On-Demand	Anodyne	NPY5R	15	45
CC(=O)NCCCNc1cc(-c2ccccc2)ncn1	ZINC000872404143	CE	On-Demand	Anodyne	TPH1	41	37
CC(=O)NCCCNc1cc(-c2ccccc2)ncn1	ZINC000872404143	CE	On-Demand	Anodyne	MTNR1A	54	40
CC(=O)NCCCNc1cc(-c2ccccc2)ncn1	ZINC000872404143	CE	On-Demand	Anodyne	MTNR1B	55	40
O=C(c1ccc(F)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872404163	FE	On-Demand	Anodyne	NPY2R	27	48
CC(=O)NCCCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872404166	DF	On-Demand	Anodyne	MTNR1A	40	38
CC(=O)NCCCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872404166	DF	On-Demand	Anodyne	MTNR1B	40	38
O=C(c1cccc(F)c1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872404167	FE	On-Demand	Anodyne	NPY2R	25	50
C[C@H]1CCCCN1C(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872404169	EE	On-Demand	Anodyne	CPT1A	42	34
C[C@@H]1CCCCN1C(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872404170	EE	On-Demand	Anodyne	CPT1A	42	34
NC(=O)c1cc(N2CCCN(C(=O)c3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872404176	GD	On-Demand	Anodyne	NPY2R	15	43
Cc1cccc(C(=O)N2CCCN(c3ncnc(F)c3C)CC2)c1	ZINC000872404180	EF	On-Demand	Anodyne	LIMK2	22	43
Cc1cccc(C(=O)N2CCCN(c3ncnc(F)c3C)CC2)c1	ZINC000872404180	EF	On-Demand	Anodyne	HPGD	49	44
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872404182	EF	On-Demand	Anodyne	PDGFRB	22	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872404182	EF	On-Demand	Anodyne	AKT2	42	38
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872404182	EF	On-Demand	Anodyne	AKT3	63	38
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872404182	EF	On-Demand	Anodyne	AKT1	49	43
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872404182	EF	On-Demand	Anodyne	SMO	21	46
Cn1ncc2c(N3CCCN(C(=O)c4cccc(F)c4)CC3)nc(Cl)nc21	ZINC000872404184	GF	On-Demand	Anodyne	NPY2R	18	44
O=C(c1cccc(F)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404193	FG	On-Demand	Anodyne	NPY2R	22	45
O=C(c1cccc(F)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404193	FG	On-Demand	Anodyne	PARP1	17	41
O=C(c1cccc(F)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404193	FG	On-Demand	Anodyne	SMO	15	41
Cc1noc(C)c1S(=O)(=O)Nc1ccc(F)cc1C(C)(F)F	ZINC000872404194	EG	On-Demand	Anodyne	EDNRA	16	40
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccccc2)CC1	ZINC000872404216	DE	On-Demand	Anodyne	SMO	47	49
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccccc2)CC1	ZINC000872404216	DE	On-Demand	Anodyne	HPGD	40	36
O=C(c1ccccc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872404218	EE	On-Demand	Anodyne	NPY2R	35	46
O=C(c1ccccc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872404218	EE	On-Demand	Anodyne	SMO	45	47
c1cnc2nccc(NCc3ccc(N4CCCC4)nc3)c2c1	ZINC000872404228	DG	On-Demand	Anodyne	HNMT	52	37
COc1ccc(C(=O)N2CCN(c3cc(C)nc4c3cnn4C)CC2)cc1	ZINC000872404239	FE	On-Demand	Anodyne	CCKAR	24	40
COc1ccc(C(=O)N2CCN(c3cc(C)nc4c3cnn4C)CC2)cc1	ZINC000872404239	FE	On-Demand	Anodyne	SSTR1	31	41
COCCc1ccc(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)cc1	ZINC000872404240	FH	On-Demand	Anodyne	PRTN3	44	30
COCCc1ccc(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)cc1	ZINC000872404240	FH	On-Demand	Anodyne	MOGAT2	50	34
Cn1ncc2c(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)nc(Cl)nc21	ZINC000872404255	GF	On-Demand	Anodyne	SMO	20	45
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872404256	EE	On-Demand	Anodyne	AKT1	22	41
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000872404256	EE	On-Demand	Anodyne	HPGD	41	35
NC(=O)c1cc(NCCN2CCc3ccccc3C2)nc(Cl)n1	ZINC000872404257	ED	On-Demand	Anodyne	HTR7	16	44
NC(=O)c1cc(NCCN2CCc3ccccc3C2)nc(Cl)n1	ZINC000872404257	ED	On-Demand	Anodyne	NOD2	41	35
O=C(c1ccccc1F)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404258	FG	On-Demand	Anodyne	PARP1	30	42
O=C(c1ccccc1F)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404258	FG	On-Demand	Anodyne	HCRTR2	15	40
CCNC(=O)CN1CCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872404261	ED	On-Demand	Anodyne	DRD3	16	41
CCNC(=O)CN1CCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872404261	ED	On-Demand	Anodyne	SLC27A1	42	35
NC(=O)c1cc(N2CCCN(C(=O)c3ccccc3F)CC2)nc(Cl)n1	ZINC000872404274	GD	On-Demand	Anodyne	SCD1	25	46
NC(=O)c1cc(N2CCCN(C(=O)c3ccccc3F)CC2)nc(Cl)n1	ZINC000872404274	GD	On-Demand	Anodyne	SCD	22	40
Cn1ncc2c(NC[C@@H](c3ccccc3)N3CCOCC3)nc(Cl)nc21	ZINC000872404288	FF	On-Demand	Anodyne	ABL1	26	43
Cn1ncc2c(NC[C@H](c3ccccc3)N3CCOCC3)nc(Cl)nc21	ZINC000872404289	FF	On-Demand	Anodyne	ABL1	26	43
c1ccc(-c2cc(NCc3cccnc3N3CCOCC3)ncn2)cc1	ZINC000872404292	EF	On-Demand	Anodyne	PIK3CA	31	47
c1ccc(-c2cc(NCc3cccnc3N3CCOCC3)ncn2)cc1	ZINC000872404292	EF	On-Demand	Anodyne	SCN10A	20	44
O=C(c1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404296	EF	On-Demand	Anodyne	METAP1	41	36
O=C(c1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404296	EF	On-Demand	Anodyne	NPY2R	24	44
O=C(c1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404296	EF	On-Demand	Anodyne	PARP1	15	40
O=C(c1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404296	EF	On-Demand	Anodyne	SMO	47	49
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872404305	FD	On-Demand	Anodyne	NPY2R	15	44
O=C(c1ccc(F)cc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404313	FG	On-Demand	Anodyne	NPY2R	18	40
O=C(c1ccc(F)cc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872404313	FG	On-Demand	Anodyne	SMO	18	47
O=C(c1ccc(C=NNC[C@@H]2CCCC2(F)F)cc1)N1CCCC1	ZINC000872404314	EG	On-Demand	Mild	L3MBTL3	76	38
O=C(c1ccc(C=NNC[C@H]2CCCC2(F)F)cc1)N1CCCC1	ZINC000872404315	EG	On-Demand	Mild	L3MBTL3	76	38
O=C(c1ccccc1F)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404320	EG	On-Demand	Anodyne	RBP4	24	44
CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404330	ED	On-Demand	Anodyne	P2RY12	46	38
CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404330	ED	On-Demand	Anodyne	PRNP	56	37
CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404330	ED	On-Demand	Anodyne	SLC27A1	62	37
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872404340	ED	On-Demand	Anodyne	KLK7	23	41
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872404340	ED	On-Demand	Anodyne	NPY2R	29	42
O=C(c1ccccc1)N1CCCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872404341	FH	On-Demand	Anodyne	SMO	43	48
c1cnc(N2CCOCC2)c(CNc2ccnc3ncccc23)c1	ZINC000872404351	DE	On-Demand	Anodyne	PIK3CA	15	43
c1cnc(N2CCOCC2)c(CNc2ccnc3ncccc23)c1	ZINC000872404351	DE	On-Demand	Anodyne	SCN10A	15	42
Cn1cnc(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)c1Cl	ZINC000872404356	FG	On-Demand	Anodyne	PIK3C3	44	32
O=C(c1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404366	DG	On-Demand	Anodyne	NPY2R	25	44
O=C(c1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404366	DG	On-Demand	Anodyne	PREP	26	40
O=C(c1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404366	DG	On-Demand	Anodyne	RBP4	25	40
O=C(c1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404366	DG	On-Demand	Anodyne	SMO	36	40
O=C(c1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872404366	DG	On-Demand	Anodyne	L3MBTL3	55	37
O=C(NC1CCCCC1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872404370	ED	On-Demand	Anodyne	CNR1	15	47
CCNC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872404374	CC	On-Demand	Anodyne	SIRT3	44	37
CCNC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872404374	CC	On-Demand	Anodyne	SLC27A1	44	37
Cc1c(F)ncnc1N(C)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000872404396	DE	On-Demand	Anodyne	MAPK14	46	39
Cc1c(F)ncnc1N(C)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000872404396	DE	On-Demand	Anodyne	MAPK13	92	36
Cc1cccc(C(=O)N2CCCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872404426	EE	On-Demand	Anodyne	NPY2R	30	43
Cc1cccc(C(=O)N2CCCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872404426	EE	On-Demand	Anodyne	HPGD	40	39
c1ccc(-c2cc(N3CCC4(CC3)OCCO4)ncn2)cc1	ZINC000872404430	CE	On-Demand	Anodyne	ADK	15	47
Oc1nnc(Cl)cc1NCc1cccnc1N1CCOCC1	ZINC000872404436	DD	On-Demand	Anodyne	SCN10A	20	47
Oc1nnc(Cl)cc1NCc1cccnc1N1CCOCC1	ZINC000872404436	DD	On-Demand	Anodyne	STAT6	57	39
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)s1	ZINC000872404451	GG	On-Demand	Anodyne	PIK3CA	16	46
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)s1	ZINC000872404451	GG	On-Demand	Anodyne	PIK3CG	19	46
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(F)cc2C(C)(F)F)s1	ZINC000872404451	GG	On-Demand	Anodyne	RORA	18	55
Cc1c(F)ncnc1N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000872404470	EE	On-Demand	Anodyne	NPY2R	16	44
Cc1c(F)ncnc1N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000872404470	EE	On-Demand	Anodyne	HPGD	47	38
O=C(c1ccccn1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872404496	DE	On-Demand	Anodyne	RBP4	23	41
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	P2RY12	99	39
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	SIRT3	54	31
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	SIRT2	49	30
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	SIRT1	49	30
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	DGAT1	39	48
CCOC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872404497	EG	On-Demand	Anodyne	VCP	41	38
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1F	ZINC000872404559	GG	On-Demand	Anodyne	TRPV1	48	36
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1F	ZINC000872404559	GG	On-Demand	Anodyne	MOGAT2	42	36
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	DHFR	38	46
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	FOLA	17	41
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	DFR1	17	41
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	DRTS_TOXGO	60	46
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	DYR_PNECA	48	46
COc1ccc(C)cc1CNc1nc(N)nc(C(F)F)n1	ZINC000872404608	CE	On-Demand	Anodyne	DRTS_TRYCR	58	41
c1ccc(-c2cc(N3CCCN(C[C@H]4CCCO4)CC3)ncn2)cc1	ZINC000872404630	EF	On-Demand	Anodyne	TNK2	57	38
c1ccc(-c2cc(N3CCCN(C[C@@H]4CCCO4)CC3)ncn2)cc1	ZINC000872404633	EF	On-Demand	Anodyne	TNK2	57	38
CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872404640	FF	On-Demand	Anodyne	TRPV1	18	42
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	TRPV1	19	45
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	AKT2	15	43
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	AKT3	29	43
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	AKT1	26	43
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	MLYCD	18	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000872404649	FF	On-Demand	Anodyne	HPGD	26	43
CS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872404658	FF	On-Demand	Anodyne	MOGAT2	41	34
O=C(NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)C1CC1	ZINC000872404702	FG	On-Demand	Anodyne	GRM5	16	41
O=C(NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)C1CC1	ZINC000872404702	FG	On-Demand	Anodyne	PTGES	29	44
COc1ccc(Nc2cc(Cl)nnc2O)cc1OC1CCCC1	ZINC000872404826	EH	On-Demand	Anodyne	PDE4A	51	45
COc1ccc(Nc2cc(Cl)nnc2O)cc1OC1CCCC1	ZINC000872404826	EH	On-Demand	Anodyne	PDE4B	27	45
COc1ccc(Nc2cc(Cl)nnc2O)cc1OC1CCCC1	ZINC000872404826	EH	On-Demand	Anodyne	PDE4D	34	45
COc1ccc(Nc2cc(Cl)nnc2O)cc1OC1CCCC1	ZINC000872404826	EH	On-Demand	Anodyne	PDE4C	17	45
CCOc1ccncc1S(=O)(=O)Nc1cccc(F)c1C(C)(F)F	ZINC000872404847	FH	On-Demand	Anodyne	ALPL	16	48
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccn2)CC1	ZINC000872404864	DD	On-Demand	Anodyne	AKT1	25	42
Oc1nnc(Cl)cc1NCCCN1CCc2ccccc21	ZINC000872404886	DF	On-Demand	Anodyne	HRP1_PLAFA	48	32
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	HTR1A	53	45
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	DRD2	35	47
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	DRD4	46	43
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	ADRA1D	22	45
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	HTR2A	46	45
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	ADRA1A	20	45
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	DRD3	41	44
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	HTR7	60	51
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	RPS6KB1	43	36
Cc1c(F)ncnc1NCCN1CCN(c2ccccc2)CC1	ZINC000872404928	DE	On-Demand	Anodyne	TNK2	15	42
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccn(CCF)n2)CC1	ZINC000872404935	EC	On-Demand	Anodyne	TGM2	26	41
CCOC(=O)N1CCN(S(=O)(=O)Nc2ccn(CCF)n2)CC1	ZINC000872404935	EC	On-Demand	Anodyne	F13A1	28	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)Nc3ccn(CCF)n3)cc2N1	ZINC000872404970	GF	On-Demand	Anodyne	PKM	39	46
FC(F)(F)COCCCNc1ccnc2ncccc12	ZINC000872405029	CG	On-Demand	Anodyne	KCNN3	15	47
Cc1c(F)cccc1S(=O)(=O)Nc1ccn(CCF)n1	ZINC000872405062	DE	On-Demand	Anodyne	C0L093_TOBAC	22	40
COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccn(CCF)n2)c1	ZINC000872405065	FD	On-Demand	Anodyne	CPT1A	45	32
COc1cc(S(=O)(=O)Nc2ccn(CCF)n2)ccc1Cl	ZINC000872405099	EE	On-Demand	Anodyne	FFAR4	17	50
CC(C)(C)C(=O)c1ccc(S(=O)(=O)Nc2ccn(CCF)n2)cc1	ZINC000872405100	FF	On-Demand	Anodyne	PRTN3	45	33
CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(CCF)n2)cc1	ZINC000872405103	EE	On-Demand	Anodyne	CA2	17	46
CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(CCF)n2)cc1	ZINC000872405103	EE	On-Demand	Anodyne	CA1	20	42
CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(CCF)n2)cc1	ZINC000872405103	EE	On-Demand	Anodyne	CA4	19	42
Cc1c(F)ncnc1N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000872405132	DD	On-Demand	Anodyne	SIRT3	67	37
Cc1c(F)ncnc1N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000872405132	DD	On-Demand	Anodyne	SIRT2	53	35
Cc1c(F)ncnc1N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000872405132	DD	On-Demand	Anodyne	SIRT1	51	32
Cc1c(F)ncnc1N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000872405132	DD	On-Demand	Anodyne	LIMK2	20	44
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	HTR1A	41	43
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	DRD2	26	43
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	DRD4	30	41
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	HTR2A	33	43
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	DRD3	32	40
Nc1nc(NCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872405135	ED	On-Demand	Anodyne	HTR7	54	50
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)C1CC1	ZINC000872405140	DF	On-Demand	Anodyne	F11	22	42
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)C1CC1	ZINC000872405140	DF	On-Demand	Anodyne	EPHX2	25	44
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccn(CCF)n1	ZINC000872405153	EE	On-Demand	Anodyne	CPT1A	72	42
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccn(CCF)n1	ZINC000872405153	EE	On-Demand	Anodyne	CPT2	43	35
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccn(CCF)n1	ZINC000872405153	EE	On-Demand	Anodyne	CPT1B	58	38
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccn(CCF)n1	ZINC000872405153	EE	On-Demand	Anodyne	PTGDR	22	40
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872405167	FF	On-Demand	Anodyne	PTGS2	34	41
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872405167	FF	On-Demand	Anodyne	TRPV1	55	36
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872405167	FF	On-Demand	Anodyne	MOGAT2	48	36
CC(C)c1nnc(N2CCC(NC(=O)C3CC3)CC2)o1	ZINC000872405169	CD	On-Demand	Anodyne	PTGES	25	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)C1CC1	ZINC000872405171	CE	On-Demand	Anodyne	EPHX2	24	42
c1cnc2nccc(N3CCN(C4CCCC4)CC3)c2c1	ZINC000872405183	CF	On-Demand	Anodyne	EBP	36	40
CCOC(=O)CC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872405242	CE	On-Demand	Anodyne	SIRT3	48	33
Nc1nc(NCCOc2ccc(F)cc2)nc(C(F)F)n1	ZINC000872405245	CE	On-Demand	Anodyne	HTR7	15	64
O=S(=O)(Nc1ccc(C2CC2)cc1F)c1cn[nH]c1	ZINC000872405303	CE	On-Demand	Anodyne	MOGAT2	40	32
COc1cccc(S(=O)(=O)Nc2ccn(CCF)n2)c1F	ZINC000872405335	DD	On-Demand	Anodyne	CCR4	23	41
O=S(=O)(Nc1ccn(CCF)n1)c1ccc2c(c1)OCO2	ZINC000872405371	DD	On-Demand	Anodyne	PKM	30	41
COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405427	GG	On-Demand	Anodyne	TRPV1	41	43
COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405427	GG	On-Demand	Anodyne	CPT1A	30	41
COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405427	GG	On-Demand	Anodyne	CPT1B	52	37
COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405427	GG	On-Demand	Anodyne	PTGDR	37	49
COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405427	GG	On-Demand	Anodyne	PTGDR2	44	49
Cn1nc(C(F)(F)F)cc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405458	FG	On-Demand	Anodyne	TRPV1	84	38
O=C(c1ccc(O)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872405514	ED	On-Demand	Anodyne	FABI	42	36
O=C(c1ccc(O)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872405514	ED	On-Demand	Anodyne	L3MBTL3	40	33
NC(=O)c1cc(N2CCN(C(=O)c3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872405543	FD	On-Demand	Anodyne	NPY2R	17	46
Nc1nc(C(F)F)nc(N2CCN(C(=O)c3cccc(F)c3)CC2)n1	ZINC000872405556	FD	On-Demand	Anodyne	NPY2R	17	44
Cn1nc(C(F)(F)F)cc1S(=O)(=O)Nc1ccc(F)cc1C(C)(F)F	ZINC000872405580	GG	On-Demand	Anodyne	MOGAT2	40	34
Cn1ncc2c(N3CCC(NC(=O)c4ccc(F)cc4)CC3)nc(Cl)nc21	ZINC000872405614	GF	On-Demand	Anodyne	MAPK14	37	45
Cn1ncc2c(N3CCC(NC(=O)c4ccc(F)cc4)CC3)nc(Cl)nc21	ZINC000872405614	GF	On-Demand	Anodyne	MAPK13	44	45
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCC2)CC1	ZINC000872405672	DF	On-Demand	Anodyne	SIRT3	66	34
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCC2)CC1	ZINC000872405672	DF	On-Demand	Anodyne	SIRT2	55	34
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCC2)CC1	ZINC000872405672	DF	On-Demand	Anodyne	SIRT1	49	32
FC1(F)CCC[C@@H]1CNN=Cc1c[nH]c2ncccc12	ZINC000872405734	CF	On-Demand	Mild	CDC7	44	42
FC1(F)CCC[C@H]1CNN=Cc1c[nH]c2ncccc12	ZINC000872405735	CF	On-Demand	Mild	CDC7	44	42
O=C(Nc1cccc(CNc2cc(Cl)nnc2O)c1)C1CCC1	ZINC000872405780	EG	On-Demand	Anodyne	TYK2	45	36
CC(=O)Nc1ncc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)s1	ZINC000872405826	FF	On-Demand	Anodyne	CDK5	46	34
CC(=O)Nc1ncc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)s1	ZINC000872405826	FF	On-Demand	Anodyne	MGEA5	32	41
CC(C)c1cccc(S(=O)(=O)Nc2ccn(CCF)n2)c1	ZINC000872405828	DF	On-Demand	Anodyne	MTNN	46	30
c1ccc(-c2cc(NCc3ccnc(N4CCOCC4)c3)ncn2)cc1	ZINC000872405840	EF	On-Demand	Anodyne	ADK	34	44
c1ccc(-c2cc(NCc3ccnc(N4CCOCC4)c3)ncn2)cc1	ZINC000872405840	EF	On-Demand	Anodyne	PIK3CA	17	45
NC(=O)c1cccc(C=NNC[C@H]2CCCC2(F)F)c1	ZINC000872405857	CE	On-Demand	Mild	AMD1	17	41
NC(=O)c1cccc(C=NNC[C@@H]2CCCC2(F)F)c1	ZINC000872405859	CE	On-Demand	Mild	AMD1	17	41
O=C1NCCc2ccc(S(=O)(=O)Nc3ccc(C4CC4)cc3F)cc21	ZINC000872405864	FF	On-Demand	Anodyne	MOGAT2	53	41
Cn1ncc(C(F)(F)F)c1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872405871	FG	On-Demand	Anodyne	TRPV1	54	36
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cn1	ZINC000872405872	FE	On-Demand	Anodyne	TRPV1	55	35
COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872405876	GF	On-Demand	Anodyne	DRD4	43	33
COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872405876	GF	On-Demand	Anodyne	TRPV1	74	35
COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872405876	GF	On-Demand	Anodyne	PTGDR	15	40
O=C(c1ccccn1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872405991	DD	On-Demand	Anodyne	NPY2R	28	41
O=C(c1ccccn1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872405991	DD	On-Demand	Anodyne	GRM4	47	35
COC(=O)c1nscc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872406014	FF	On-Demand	Anodyne	TRPV1	44	34
Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3ccc(C4CC4)cc3F)ccc21	ZINC000872406047	GF	On-Demand	Anodyne	MOGAT2	47	36
COCCc1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872406048	EH	On-Demand	Anodyne	TRPV1	42	33
Cc1c(F)ncnc1NCc1cccc(S(=O)(=O)NC(C)C)c1	ZINC000872406073	EE	On-Demand	Anodyne	MTNN	55	33
O=C(c1cccc(F)c1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872406079	EG	On-Demand	Anodyne	SLC9A1	22	41
O=C(c1cccc(F)c1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872406079	EG	On-Demand	Anodyne	RBP4	21	40
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	HTR1A	58	44
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	DRD2	39	43
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	DRD4	50	41
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	HTR2A	44	43
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	DRD3	49	44
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	HRP1_PLAFA	61	32
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	HTR7	64	59
Oc1nnc(Cl)cc1NCCN1CCN(c2ccccc2)CC1	ZINC000872406122	EE	On-Demand	Anodyne	HNMT	49	37
COC(=O)c1ccc(CN(C)c2nc(N)nc(C(F)F)n2)cc1	ZINC000872406184	DD	On-Demand	Anodyne	DHFR	27	43
CCOc1ccncc1S(=O)(=O)Nc1ccc(F)cc1C(C)(F)F	ZINC000872406192	FH	On-Demand	Anodyne	ALPL	16	45
O=C(c1ccc(F)c(F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872406220	FE	On-Demand	Anodyne	NPY2R	23	40
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCC2)c1	ZINC000872406247	DG	On-Demand	Anodyne	ADORA3	42	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCC2)c1	ZINC000872406247	DG	On-Demand	Anodyne	TYK2	50	35
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCC2)c1	ZINC000872406247	DG	On-Demand	Anodyne	LIMK2	17	40
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCC2)c1	ZINC000872406247	DG	On-Demand	Anodyne	KCNK3	16	42
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872406271	EE	On-Demand	Anodyne	AKT2	20	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872406271	EE	On-Demand	Anodyne	AKT3	38	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872406271	EE	On-Demand	Anodyne	ABCC1	72	37
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872406271	EE	On-Demand	Anodyne	AKT1	33	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000872406271	EE	On-Demand	Anodyne	HPGD	42	35
N#Cc1ccc2[nH]cc(C=NNC[C@H]3CCCC3(F)F)c2c1	ZINC000872406315	DG	On-Demand	Mild	SLC6A4	17	41
N#Cc1ccc2[nH]cc(C=NNC[C@@H]3CCCC3(F)F)c2c1	ZINC000872406316	DG	On-Demand	Mild	SLC6A4	17	41
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)ccc1C	ZINC000872406350	FH	On-Demand	Anodyne	TRPV1	64	36
O=C(NC1CCN(c2nc3c(F)cc(Cl)cc3s2)CC1)C1CC1	ZINC000872406364	FH	On-Demand	Anodyne	PTGES	29	40
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872406389	EG	On-Demand	Anodyne	NMT1	41	43
Cc1c(F)ncnc1NCc1ccnc(N2CCOCC2)c1	ZINC000872406398	DD	On-Demand	Anodyne	EPHB4	60	36
Cc1c(F)ncnc1NCc1ccnc(N2CCOCC2)c1	ZINC000872406398	DD	On-Demand	Anodyne	STAT6	44	35
COC(=O)c1nc(Cl)ccc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872406439	GG	On-Demand	Anodyne	TRPV1	58	35
Cn1ncc2c(NCc3cccc(NC(=O)C4CCC4)c3)nc(Cl)nc21	ZINC000872406465	FG	On-Demand	Anodyne	ADORA3	49	38
Cn1ncc2c(NCc3cccc(NC(=O)C4CCC4)c3)nc(Cl)nc21	ZINC000872406465	FG	On-Demand	Anodyne	TBK1	40	37
CCC(CC)C(=O)N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872406480	ED	On-Demand	Anodyne	P2RY12	40	33
COC(=O)Cn1cc(S(=O)(=O)Nc2cccc(F)c2C(C)(F)F)cn1	ZINC000872406580	GE	On-Demand	Anodyne	PRTN3	50	32
Cc1c(F)ncnc1N1CCC(NC(=O)C2CC2)CC1	ZINC000872406589	CD	On-Demand	Anodyne	EPHX2	22	40
Cc1c(F)ncnc1N1CCC(NC(=O)C2CC2)CC1	ZINC000872406589	CD	On-Demand	Anodyne	SIRT3	77	35
Cc1c(F)ncnc1N1CCC(NC(=O)C2CC2)CC1	ZINC000872406589	CD	On-Demand	Anodyne	SIRT2	61	34
Cc1c(F)ncnc1N1CCC(NC(=O)C2CC2)CC1	ZINC000872406589	CD	On-Demand	Anodyne	SIRT1	51	34
CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccn(CCF)n2)cc1	ZINC000872406609	ED	On-Demand	Anodyne	LIMK2	32	40
NS(=O)(=O)c1ccc2c(c1)C(=NNC[C@H]1CCCC1(F)F)CCC2	ZINC000872406655	FE	On-Demand	Mild	CA7	25	40
NS(=O)(=O)c1ccc2c(c1)C(=NNC[C@H]1CCCC1(F)F)CCC2	ZINC000872406655	FE	On-Demand	Mild	CA14	15	40
NS(=O)(=O)c1ccc2c(c1)C(=NNC[C@@H]1CCCC1(F)F)CCC2	ZINC000872406658	FE	On-Demand	Mild	CA7	25	40
NS(=O)(=O)c1ccc2c(c1)C(=NNC[C@@H]1CCCC1(F)F)CCC2	ZINC000872406658	FE	On-Demand	Mild	CA14	15	40
CCOC(=O)CC1(S(=O)(=O)Nc2ccc(C3CC3)cc2F)CC1	ZINC000872406672	EF	On-Demand	Anodyne	TRPV1	42	34
COCCc1ccc(S(=O)(=O)Nc2cccc(F)c2C(C)(F)F)cc1	ZINC000872406680	FH	On-Demand	Anodyne	PRTN3	56	36
O=S(=O)(Nc1ccc(C2CC2)cc1F)c1ccc2c(c1)OCCO2	ZINC000872406735	EG	On-Demand	Anodyne	PKM	42	41
COc1ccc(OC)c2sc(NC[C@@H](O)CN(C)C)nc12	ZINC000872406763	DD	On-Demand	Anodyne	ADORA2B	15	40
COc1ccc(OC)c2sc(NC[C@H](O)CN(C)C)nc12	ZINC000872406764	DD	On-Demand	Anodyne	ADORA2B	15	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872406823	GH	On-Demand	Anodyne	TRPV1	52	34
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872406823	GH	On-Demand	Anodyne	LIMK2	23	45
CNS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872406835	GE	On-Demand	Anodyne	MOGAT2	41	34
COC(=O)Cn1cc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cn1	ZINC000872406861	FD	On-Demand	Anodyne	TRPV1	89	36
O=C(c1ccc(C(F)(F)F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872406863	GF	On-Demand	Anodyne	NPY2R	30	41
O=C(c1ccc(C(F)(F)F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872406863	GF	On-Demand	Anodyne	SLC6A9	26	42
O=C(c1ccc(C(F)(F)F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872406863	GF	On-Demand	Anodyne	MLYCD	18	40
O=C(NCC(F)(F)F)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872406870	EF	On-Demand	Anodyne	TBK1	44	33
O=S(=O)(Nc1ccc(C2CC2)cc1F)c1cnn(CC(F)F)c1	ZINC000872406964	EF	On-Demand	Anodyne	TRPV1	48	34
CCC(CC)C(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872406989	DF	On-Demand	Anodyne	METAP1	27	40
CCC(CC)C(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872406989	DF	On-Demand	Anodyne	AKT1	20	45
Cn1ncc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1C(F)(F)F	ZINC000872407000	FG	On-Demand	Anodyne	TRPV1	46	35
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccc(F)cc1	ZINC000872407008	EG	On-Demand	Anodyne	SSTR5	44	42
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccc(F)cc1	ZINC000872407008	EG	On-Demand	Anodyne	MAPK13	53	33
O=C(NC1CCN(c2ccncc2C2CC2)CC1)c1ccc(F)cc1	ZINC000872407008	EG	On-Demand	Anodyne	SLC6A5	28	40
CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872407009	FG	On-Demand	Anodyne	TRPV1	73	36
CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cc1	ZINC000872407009	FG	On-Demand	Anodyne	LIMK2	33	50
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(C4CC4)cc3F)ccc21	ZINC000872407065	FG	On-Demand	Anodyne	TRPV1	43	34
Cn1ncc2c(NCc3ccnc(N4CCOCC4)c3)nc(Cl)nc21	ZINC000872407096	FD	On-Demand	Anodyne	PIK3CB	15	41
COCc1ccccc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872407122	EH	On-Demand	Anodyne	TRPV1	48	36
NC(=O)c1cc(N2CCCN(C[C@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872407155	EC	On-Demand	Anodyne	PDE8B	49	34
NC(=O)c1cc(N2CCCN(C[C@@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872407157	EC	On-Demand	Anodyne	PDE8B	49	34
COc1ccc(OC)c2sc(N3CCC(NC(=O)C4CC4)CC3)nc12	ZINC000872407186	FF	On-Demand	Anodyne	ADORA2B	15	40
COc1ccc(OC)c2sc(N3CCC(NC(=O)C4CC4)CC3)nc12	ZINC000872407186	FF	On-Demand	Anodyne	EPHX2	21	44
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000872407195	DD	On-Demand	Anodyne	SMO	15	40
COCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872407196	DE	On-Demand	Anodyne	EGFR	24	48
COCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872407196	DE	On-Demand	Anodyne	KDR	16	42
COCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872407196	DE	On-Demand	Anodyne	KCNK3	46	34
COCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872407196	DE	On-Demand	Anodyne	KCNK9	43	34
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000872407203	GG	On-Demand	Anodyne	DRD4	17	48
O=S(=O)(Nc1ccn(CCF)n1)c1cc(C(F)(F)F)ccc1F	ZINC000872407210	FF	On-Demand	Anodyne	SGK1	21	43
O=C(c1ccc(O)cc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872407237	DF	On-Demand	Anodyne	L3MBTL3	49	36
COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)o1	ZINC000872407250	EF	On-Demand	Anodyne	TRPV1	42	34
O=C(Nc1cccc(CNc2ccnc3ncccc23)c1)C1CCC1	ZINC000872407260	EH	On-Demand	Anodyne	TYK2	52	38
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	DRD4	22	46
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	CNR2	15	43
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	SSTR5	41	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	CHRNA7	17	42
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	SLC6A5	31	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	MCHR1	15	45
O=C(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872407290	FG	On-Demand	Anodyne	HPGDS	43	43
CC(CCc1ccc(OCC(=O)O)cc1)=NNC[C@@H]1CCCC1(F)F	ZINC000872407299	FG	On-Demand	Mild	PPO2	34	53
CC(CCc1ccc(OCC(=O)O)cc1)=NNC[C@@H]1CCCC1(F)F	ZINC000872407299	FG	On-Demand	Mild	FFAR4	42	32
CC(CCc1ccc(OCC(=O)O)cc1)=NNC[C@H]1CCCC1(F)F	ZINC000872407301	FG	On-Demand	Mild	PPO2	34	53
CC(CCc1ccc(OCC(=O)O)cc1)=NNC[C@H]1CCCC1(F)F	ZINC000872407301	FG	On-Demand	Mild	FFAR4	42	32
O=S(=O)(Nc1ccc(C2CC2)cc1F)c1cnn(CC(F)(F)F)c1	ZINC000872407313	FG	On-Demand	Anodyne	TRPV1	52	35
Cc1nc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c(Br)n1C	ZINC000872407345	GG	On-Demand	Anodyne	TRPV1	51	35
Cn1ncc2c(N3CCN(C(=O)c4cccc(F)c4)CC3)nc(Cl)nc21	ZINC000872407351	FE	On-Demand	Anodyne	NPY2R	19	47
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2cccc(F)c2C(C)(F)F)s1	ZINC000872407382	GG	On-Demand	Anodyne	PIK3CG	19	42
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2cccc(F)c2C(C)(F)F)s1	ZINC000872407382	GG	On-Demand	Anodyne	RORA	18	55
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872407384	FF	On-Demand	Anodyne	TRPV1	52	34
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	MAPK14	51	39
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	SSTR5	44	40
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	MAPK13	92	37
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	AKT1	16	40
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	MCHR1	18	44
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	SIRT3	63	34
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	SIRT2	66	34
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000872407404	EE	On-Demand	Anodyne	SIRT1	56	34
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	DRD4	17	44
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	MAPK14	40	39
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	SSTR5	43	43
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	MAPK13	87	36
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	SSTR3	20	40
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872407405	FE	On-Demand	Anodyne	MCHR1	18	45
O=C(O)Cc1ccccc1CS(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872407412	FG	On-Demand	Anodyne	CXCL8	23	40
O=C(O)Cc1ccccc1CS(=O)(=O)Nc1ccc(C2CC2)cc1F	ZINC000872407412	FG	On-Demand	Anodyne	TRPV1	58	37
COC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)s1	ZINC000872407518	GG	On-Demand	Anodyne	TRPV1	42	34
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872407525	DE	On-Demand	Anodyne	PDGFRB	28	41
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872407525	DE	On-Demand	Anodyne	AKT1	21	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872407525	DE	On-Demand	Anodyne	SMO	21	42
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000872407525	DE	On-Demand	Anodyne	HPGD	44	36
COc1ccc(OC)c2sc(NC3CCN(C(=O)C(C)C)CC3)nc12	ZINC000872407548	FG	On-Demand	Anodyne	ADORA2B	18	42
CCC(CC)C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872407557	CE	On-Demand	Anodyne	AKT2	23	40
CCC(CC)C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872407557	CE	On-Demand	Anodyne	AKT3	46	40
CCC(CC)C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872407557	CE	On-Demand	Anodyne	AKT1	38	44
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cccc(F)c3C(C)(F)F)ccc21	ZINC000872407566	GH	On-Demand	Anodyne	HSD17B3	41	37
Cn1nnc2cc(S(=O)(=O)Nc3ccc(C4CC4)cc3F)ccc21	ZINC000872407576	EF	On-Demand	Anodyne	TRPV1	40	33
Oc1nnc(Cl)cc1NCc1ccnc(N2CCOCC2)c1	ZINC000872407580	DD	On-Demand	Anodyne	EPHB4	40	34
Oc1nnc(Cl)cc1NCc1ccnc(N2CCOCC2)c1	ZINC000872407580	DD	On-Demand	Anodyne	STAT6	48	35
Oc1nnc(Cl)cc1NCc1ccnc(N2CCOCC2)c1	ZINC000872407580	DD	On-Demand	Anodyne	SMG1	28	40
O=C(c1cccc(F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872407582	ED	On-Demand	Anodyne	NPY2R	30	53
Cc1noc(C)c1S(=O)(=O)Nc1cccc(F)c1C(C)(F)F	ZINC000872407643	EG	On-Demand	Anodyne	EDNRA	23	43
Oc1nnc(Cl)cc1NCCCN1CCc2ccccc2C1	ZINC000872407671	DF	On-Demand	Anodyne	HRP1_PLAFA	82	36
Oc1nnc(Cl)cc1NCCCN1CCc2ccccc2C1	ZINC000872407671	DF	On-Demand	Anodyne	HTR7	17	46
Oc1nnc(Cl)cc1NCCCN1CCc2ccccc2C1	ZINC000872407671	DF	On-Demand	Anodyne	HNMT	54	37
COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)cn1	ZINC000872407712	FF	On-Demand	Anodyne	TRPV1	69	35
O=S(=O)(Nc1ccc(C2CC2)cc1F)c1cnn(CC2CC2)c1	ZINC000872407715	EG	On-Demand	Anodyne	TRPV1	46	35
CC(C)n1cnc(S(=O)(=O)Nc2ccc(C3CC3)cc2F)c1	ZINC000872407727	DG	On-Demand	Anodyne	TRPV1	50	34
Oc1ccc(C=NNC[C@@H]2CCCC2(F)F)cc1Cl	ZINC000872407774	CG	On-Demand	Mild	ADCYAP1R1	49	33
Oc1ccc(C=NNC[C@H]2CCCC2(F)F)cc1Cl	ZINC000872407775	CG	On-Demand	Mild	ADCYAP1R1	49	33
CC(CCc1ccccc1[N+](=O)[O-])=NNC[C@@H]1CCCC1(F)F	ZINC000872407819	EH	On-Demand	Mild	COLA	102	34
CC(CCc1ccccc1[N+](=O)[O-])=NNC[C@H]1CCCC1(F)F	ZINC000872407820	EH	On-Demand	Mild	COLA	102	34
O=S(=O)(Nc1ccn(CCF)n1)c1ccc2c(c1)OCCO2	ZINC000872407822	ED	On-Demand	Anodyne	PKM	38	42
Cc1c(F)ncnc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000872407823	DD	On-Demand	Anodyne	NOD2	40	35
Cc1c(F)ncnc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000872407824	DD	On-Demand	Anodyne	NOD2	40	35
O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2ccn(CCF)n2)c1	ZINC000872407861	FD	On-Demand	Anodyne	MAPK13	74	33
NC(=O)c1cc(NCCCN2CCc3ccccc3C2)nc(Cl)n1	ZINC000872407914	EE	On-Demand	Anodyne	HTR7	34	49
O=C1CCCc2cc(S(=O)(=O)Nc3ccn(CCF)n3)ccc2N1	ZINC000872407949	FD	On-Demand	Anodyne	PKM	31	46
O=C(O)c1ccccc1C=NNC[C@H]1CCCC1(F)F	ZINC000872407988	CF	On-Demand	Mild	SLC6A1	30	40
O=C(O)c1ccccc1C=NNC[C@@H]1CCCC1(F)F	ZINC000872407989	CF	On-Demand	Mild	SLC6A1	30	40
COc1ccc(OC)c2sc(N3CCOC[C@H]3C)nc12	ZINC000872408044	CF	On-Demand	Anodyne	MTOR	15	42
COc1ccc(OC)c2sc(N3CCOC[C@@H]3C)nc12	ZINC000872408045	CF	On-Demand	Anodyne	MTOR	15	42
O=S(=O)(Nc1ccn(CCF)n1)c1ccc2c(c1)OCCCO2	ZINC000872408236	ED	On-Demand	Anodyne	PKM	36	44
COc1ccc2[nH]cc(C=NNC[C@H]3CCCC3(F)F)c2c1	ZINC000872408321	DH	On-Demand	Mild	MTNR1A	16	45
COc1ccc2[nH]cc(C=NNC[C@@H]3CCCC3(F)F)c2c1	ZINC000872408322	DH	On-Demand	Mild	MTNR1A	16	45
C[C@@H]1COCCN1c1cc(C(N)=O)nc(Cl)n1	ZINC000872408367	CC	On-Demand	Anodyne	MTOR	40	38
Nc1nc(NCCCN2CCc3ccccc3C2)nc(C(F)F)n1	ZINC000872408384	EE	On-Demand	Anodyne	HTR7	18	45
NC(=O)c1cc(NCC2CCCC2)nc(Cl)n1	ZINC000872408443	CD	On-Demand	Anodyne	VCP	48	36
Cc1ccccc1CN1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872408554	EF	On-Demand	Anodyne	DRD4	35	44
NC(=O)c1cc(NC[C@H]2CCN(c3ccccc3)C2)nc(Cl)n1	ZINC000872408559	EE	On-Demand	Anodyne	VCP	60	36
NC(=O)c1cc(NC[C@@H]2CCN(c3ccccc3)C2)nc(Cl)n1	ZINC000872408560	EE	On-Demand	Anodyne	VCP	60	36
CCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872408562	BD	On-Demand	Reactive	ESRRG	20	45
CN(C)S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408565	DE	On-Demand	Anodyne	KCNK3	85	37
CN(C)S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408565	DE	On-Demand	Anodyne	KCNK9	68	37
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	DRD4	40	48
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	SIGMAR1	32	41
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	CHEK2	18	42
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	CCR3	36	41
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	CCR2	18	46
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	MCHR1	17	46
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	BIRC2	22	41
NC(=O)c1cc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408575	EE	On-Demand	Anodyne	NPFFR1	43	37
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	DRD4	40	48
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	SIGMAR1	32	41
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	CHEK2	18	42
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	CCR3	36	41
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	CCR2	18	46
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	MCHR1	17	46
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	BIRC2	22	41
NC(=O)c1cc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(Cl)n1	ZINC000872408576	EE	On-Demand	Anodyne	NPFFR1	43	37
COc1ccsc1S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408577	GH	On-Demand	Anodyne	KCNK3	44	39
COc1ccsc1S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408577	GH	On-Demand	Anodyne	KCNK9	46	39
CC(C)c1nn(C)c(Cl)c1C=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872408581	EF	On-Demand	Reactive	ADCYAP1R1	48	34
c1ccc(C2(CNc3ccnc4ncccc34)CCOCC2)cc1	ZINC000872408584	DH	On-Demand	Anodyne	ICMT	56	38
O=C(c1ccccc1O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872408591	ED	On-Demand	Anodyne	SCD1	17	40
O=C(c1ccccc1O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872408591	ED	On-Demand	Anodyne	SCD	17	40
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	DRD2	17	43
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	DRD4	21	43
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	HTR1B	18	42
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	HTR2A	15	46
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	SIGMAR1	48	43
Cc1c(F)ncnc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408604	DG	On-Demand	Anodyne	BIRC2	21	40
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	ESR1	74	40
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	KCNH2	15	41
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	ESR2	52	38
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	LTA4H	70	46
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	HRH3	68	49
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	PSMB2	52	51
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	PSMB1	57	51
O=C(O)c1ccc(C(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000872408617	GF	On-Demand	Reactive	ADCYAP1R1	65	45
Oc1nnc(Cl)cc1NCC1(c2ccccc2)CCOCC1	ZINC000872408621	DF	On-Demand	Anodyne	ICMT	70	43
CCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872408622	CE	On-Demand	Anodyne	SIRT3	69	36
CCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872408622	CE	On-Demand	Anodyne	SIRT2	58	33
CCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872408622	CE	On-Demand	Anodyne	SIRT1	51	36
c1ccc(-c2cc(NC[C@@H]3CCN(C4CC4)C3)ncn2)cc1	ZINC000872408623	CG	On-Demand	Anodyne	VCP	49	35
c1ccc(-c2cc(NC[C@H]3CCN(C4CC4)C3)ncn2)cc1	ZINC000872408624	CG	On-Demand	Anodyne	VCP	49	35
Nc1nc(NC2CCN(CCc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872408625	EF	On-Demand	Anodyne	SIGMAR1	34	40
Nc1nc(NC[C@@H](CO)Cc2ccccc2)nc(C(F)F)n1	ZINC000872408626	DD	On-Demand	Anodyne	TPH1	44	40
Nc1nc(NC[C@H](CO)Cc2ccccc2)nc(C(F)F)n1	ZINC000872408627	DD	On-Demand	Anodyne	TPH1	44	40
Cc1c(F)ncnc1NCC1(c2ccccc2)CCOCC1	ZINC000872408632	DG	On-Demand	Anodyne	ICMT	88	44
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	DRD2	22	40
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	DRD4	35	50
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	ACHE	22	42
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	HTR2A	21	50
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	OPRM1	15	43
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	KCNH2	19	41
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	SIGMAR1	53	42
NC(=O)c1cc(NC2CCN(CCc3ccccc3)CC2)nc(Cl)n1	ZINC000872408673	FE	On-Demand	Anodyne	MCHR1	21	42
c1cnc2nccc(NCc3ccc(N4CCCC4)cc3)c2c1	ZINC000872408676	DH	On-Demand	Clean	HNMT	58	39
CCCCNC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872408680	DG	On-Demand	Anodyne	TBK1	70	39
CCC(C)=NNCc1ccc2ccccc2n1	ZINC000872408690	BG	On-Demand	Mild	CYSLTR1	28	40
CCC(=O)c1c(Cl)cccc1N[C@H](C)Cn1ccnc1	ZINC000872408714	CH	On-Demand	Anodyne	TBXAS1	46	44
CCC(=O)c1c(Cl)cccc1N[C@@H](C)Cn1ccnc1	ZINC000872408715	CH	On-Demand	Anodyne	TBXAS1	46	44
CCC(CC)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872408725	BE	On-Demand	Reactive	HDAC6	17	41
CCC(CC)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872408725	BE	On-Demand	Reactive	ESRRG	20	43
Cc1ccccc1CN1CCCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872408739	FE	On-Demand	Anodyne	PIK3CB	17	42
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	DRD2	20	43
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	DRD4	30	46
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	ACHE	15	45
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	HTR2A	15	46
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	OPRM1	16	41
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	KCNH2	19	45
Oc1nnc(Cl)cc1NC1CCN(CCc2ccccc2)CC1	ZINC000872408750	EF	On-Demand	Anodyne	SIGMAR1	54	42
COc1ccc(OC)c2sc(N[C@@H](C)Cn3ccnc3)nc12	ZINC000872408752	DG	On-Demand	Anodyne	QPCT	24	43
COc1ccc(OC)c2sc(N[C@H](C)Cn3ccnc3)nc12	ZINC000872408753	DG	On-Demand	Anodyne	QPCT	24	43
CCOC(=O)C1CCC(=NNCc2ccc3ccccc3n2)CC1	ZINC000872408775	EG	On-Demand	Mild	CYSLTR1	25	45
CCCN(C)S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408798	EG	On-Demand	Anodyne	KCNK3	46	33
CCCN(C)S(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408798	EG	On-Demand	Anodyne	KCNK9	52	33
CS(=O)(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872408803	ED	On-Demand	Anodyne	HRH4	19	51
CS(=O)(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872408804	ED	On-Demand	Anodyne	HRH4	19	51
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1cccc(OCCN(C)C)c1	ZINC000872408827	FE	On-Demand	Reactive	ABAT	20	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1cccc(OCCN(C)C)c1	ZINC000872408827	FE	On-Demand	Reactive	PLA2G4B	53	42
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1cccc(OCCN(C)C)c1	ZINC000872408827	FE	On-Demand	Reactive	ESRRG	58	40
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1cccc(OCCN(C)C)c1	ZINC000872408827	FE	On-Demand	Reactive	UTS2	60	36
C[C@@H](Cn1ccnc1)Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872408852	CC	On-Demand	Anodyne	TBXAS1	32	42
Cn1ncc2c(NCC3(c4ccccc4)CCOCC3)nc(Cl)nc21	ZINC000872408868	FG	On-Demand	Anodyne	ICMT	45	41
CN1CCN(c2ncc(C=NNCc3ccc4ccccc4n3)cn2)CC1	ZINC000872408870	FD	On-Demand	Mild	HTR3A	17	51
NC(=O)c1cc(NCC2(c3ccccc3)CCOCC2)nc(Cl)n1	ZINC000872408874	EE	On-Demand	Anodyne	ICMT	49	40
NC(=O)c1cc(NCC2(c3ccccc3)CCOCC2)nc(Cl)n1	ZINC000872408874	EE	On-Demand	Anodyne	STAT6	44	33
COCCCC(C)=NNCc1ccc2ccccc2n1	ZINC000872408876	CG	On-Demand	Mild	CYSLTR1	28	43
Oc1nnc(Cl)cc1NCc1ccc(N2CCCC2)cc1	ZINC000872408885	DG	On-Demand	Clean	STAT6	34	41
Nc1nc(C(F)F)nc(N2CCN(Cc3ccc(F)cc3Cl)CC2)n1	ZINC000872408909	FF	On-Demand	Anodyne	P2RX7	34	40
CCOC(=O)N[C@H](CNc1cc(Cl)nnc1O)CC(C)C	ZINC000872408911	DE	On-Demand	Anodyne	HLA-DRB1	42	37
CO[C@@H](C)CS(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408929	EF	On-Demand	Anodyne	KCNK3	44	34
CO[C@@H](C)CS(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872408929	EF	On-Demand	Anodyne	KCNK9	44	34
CCC(=O)c1c(Cl)cccc1NC1CCN(CC(=O)NC)CC1	ZINC000872408945	EF	On-Demand	Anodyne	DRD4	20	42
Nc1nc(NCC2(c3ccccc3)CCOCC2)nc(C(F)F)n1	ZINC000872408950	EF	On-Demand	Anodyne	ICMT	73	39
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	HTR1A	24	44
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	DRD2	17	43
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	DRD4	35	49
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	HTR2A	21	43
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	DRD3	20	43
Oc1nnc(Cl)cc1NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000872408958	FE	On-Demand	Anodyne	HTR7	34	48
CCNC(=O)CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872408965	ED	On-Demand	Anodyne	PRNP	44	35
CCNC(=O)CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872408965	ED	On-Demand	Anodyne	SLC27A1	59	37
CNC(=O)CN1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872408966	EE	On-Demand	Anodyne	CACNA1I	46	36
COCCS(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872409030	EE	On-Demand	Anodyne	KCNK3	97	37
COCCS(=O)(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000872409030	EE	On-Demand	Anodyne	KCNK9	68	37
Nc1nc(NCCN2CCN(c3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872409031	FD	On-Demand	Anodyne	HTR1A	15	43
Nc1nc(NCCN2CCN(c3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872409031	FD	On-Demand	Anodyne	DRD4	25	45
Nc1nc(NCCN2CCN(c3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872409031	FD	On-Demand	Anodyne	HTR2A	17	41
Nc1nc(NCCN2CCN(c3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872409031	FD	On-Demand	Anodyne	HTR7	24	40
CCCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409035	CG	On-Demand	Reactive	RARB	20	43
CCCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409035	CG	On-Demand	Reactive	PLA2G4B	57	43
CCCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409035	CG	On-Demand	Reactive	ESRRG	18	41
CCCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409035	CG	On-Demand	Reactive	PPO2	40	44
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	HTR1A	51	44
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	DRD2	43	46
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	ADRA1A	34	46
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	DRD3	62	44
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	ADORA2B	15	44
COc1ccc(OC)c2sc(NCCCCN3CCN(C)CC3)nc12	ZINC000872409036	FF	On-Demand	Anodyne	HNMT	41	33
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872409085	GE	On-Demand	Reactive	DRD4	42	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872409085	GE	On-Demand	Reactive	ACHE	26	44
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872409085	GE	On-Demand	Reactive	SIGMAR1	32	40
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872409086	GE	On-Demand	Reactive	DRD4	42	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872409086	GE	On-Demand	Reactive	ACHE	26	44
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872409086	GE	On-Demand	Reactive	SIGMAR1	32	40
COc1ccccc1NC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409102	EF	On-Demand	Anodyne	PDE3A	41	38
COc1ccccc1NC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409102	EF	On-Demand	Anodyne	PDGFRB	43	37
COc1ccccc1NC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409102	EF	On-Demand	Anodyne	PDE3B	44	38
COc1ccccc1NC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409102	EF	On-Demand	Anodyne	LIMK2	46	51
O=C(c1ccccc1O)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872409125	DF	On-Demand	Anodyne	RBP4	25	47
COc1ccccc1NC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872409137	FH	On-Demand	Anodyne	HTR1A	29	49
COc1ccccc1NC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872409137	FH	On-Demand	Anodyne	DRD3	18	40
COc1ccccc1NC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872409137	FH	On-Demand	Anodyne	KCNQ2	42	36
CNC(=O)CN1CCC(Nc2nc3c(OC)ccc(OC)c3s2)CC1	ZINC000872409150	FD	On-Demand	Anodyne	SSTR5	40	43
Cc1c(F)ncnc1NC[C@@H](O)COc1ccccc1	ZINC000872409161	CD	On-Demand	Anodyne	ADRB2	50	51
Cc1c(F)ncnc1NC[C@@H](O)COc1ccccc1	ZINC000872409161	CD	On-Demand	Anodyne	ADRB1	51	40
Cc1c(F)ncnc1NC[C@@H](O)COc1ccccc1	ZINC000872409161	CD	On-Demand	Anodyne	ADRB3	36	40
C[C@@H]1C[C@@H](C(=O)O)CCC1=NNCc1ccc2ccccc2n1	ZINC000872409163	DG	On-Demand	Mild	ALOX5	26	41
COc1ccccc1NC(=O)C1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872409165	GG	On-Demand	Anodyne	HTR1A	37	48
COc1ccccc1NC(=O)C1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872409165	GG	On-Demand	Anodyne	HTR1B	16	48
COc1ccccc1NC(=O)C1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872409165	GG	On-Demand	Anodyne	SSTR1	37	43
COc1ccccc1NC(=O)C1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872409165	GG	On-Demand	Anodyne	MAPK7	45	34
Cc1c(F)ncnc1NC[C@H](O)COc1ccccc1	ZINC000872409166	CD	On-Demand	Anodyne	ADRB2	50	51
Cc1c(F)ncnc1NC[C@H](O)COc1ccccc1	ZINC000872409166	CD	On-Demand	Anodyne	ADRB1	51	40
Cc1c(F)ncnc1NC[C@H](O)COc1ccccc1	ZINC000872409166	CD	On-Demand	Anodyne	ADRB3	36	40
Cn1ncc2c(NC[C@H](O)COc3ccccc3)nc(Cl)nc21	ZINC000872409175	ED	On-Demand	Anodyne	ADRB2	27	43
Cn1ncc2c(NC[C@@H](O)COc3ccccc3)nc(Cl)nc21	ZINC000872409176	ED	On-Demand	Anodyne	ADRB2	27	43
Nc1nc(C(F)F)nc(N2CCC[C@H]2COc2ccc(Cl)cc2)n1	ZINC000872409187	FG	On-Demand	Anodyne	CHRNA10	62	51
Nc1nc(C(F)F)nc(N2CCC[C@@H]2COc2ccc(Cl)cc2)n1	ZINC000872409188	FG	On-Demand	Anodyne	CHRNA10	62	51
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	DHFR	25	46
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	FOLA	28	40
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	DRTS_PLAFK	42	44
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	DRTS_TOXGO	38	44
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	DYR_PNECA	23	41
CCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872409189	EF	On-Demand	Anodyne	DRTS_TRYCR	69	44
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000872409194	FF	On-Demand	Anodyne	DRD4	25	45
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000872409194	FF	On-Demand	Anodyne	P2RX7	56	40
Nc1nc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872409196	EE	On-Demand	Anodyne	DRD4	21	40
Nc1nc(N[C@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872409197	EE	On-Demand	Anodyne	DRD4	21	40
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409199	FG	On-Demand	Reactive	DRD2	15	47
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409199	FG	On-Demand	Reactive	DRD4	43	47
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409199	FG	On-Demand	Reactive	ACHE	31	47
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409199	FG	On-Demand	Reactive	SIGMAR1	37	42
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409199	FG	On-Demand	Reactive	NOD2	45	38
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409200	FG	On-Demand	Reactive	DRD2	15	47
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409200	FG	On-Demand	Reactive	DRD4	43	47
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409200	FG	On-Demand	Reactive	ACHE	31	47
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409200	FG	On-Demand	Reactive	SIGMAR1	37	42
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872409200	FG	On-Demand	Reactive	NOD2	45	38
Oc1nnc(Cl)cc1N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000872409210	EH	On-Demand	Anodyne	CHRNA10	67	52
Oc1nnc(Cl)cc1N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000872409213	EH	On-Demand	Anodyne	CHRNA10	67	52
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	HTR1A	18	44
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	ACHE	30	46
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	HTR2A	23	46
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	DRD3	26	45
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	HRP1_PLAFA	95	42
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	HTR7	21	47
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	SIGMAR1	53	47
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	BCHE	23	46
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	HNMT	77	40
Oc1nnc(Cl)cc1NCCCN1CCN(Cc2ccccc2)CC1	ZINC000872409254	FE	On-Demand	Anodyne	CACNA1G	16	42
NC(=O)c1cc(NCc2ccc(N3CCCC3)cc2)nc(Cl)n1	ZINC000872409285	EE	On-Demand	Clean	STAT6	69	44
c1ccc2nc(CNN=C3CCCC3)ccc2c1	ZINC000872409294	BG	On-Demand	Mild	CYSLTR1	20	40
C[C@H](c1nc(-c2ccccc2)no1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409307	GF	On-Demand	Anodyne	NPY2R	16	42
CNC(=O)CN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872409320	EC	On-Demand	Anodyne	Q4VQ11_PIG	48	35
COCCOc1cc(Nc2cc(Cl)nnc2O)ccc1OC	ZINC000872409330	EF	On-Demand	Anodyne	ENPP1	68	35
COCCOc1cc(Nc2cc(Cl)nnc2O)ccc1OC	ZINC000872409330	EF	On-Demand	Anodyne	DRTS_TRYCR	49	35
CNC(=O)CN1CCC(Nc2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872409336	FF	On-Demand	Anodyne	SSTR5	15	41
CCC(C=NNC(=O)c1ccc(C(=O)O)cc1)CC	ZINC000872409366	CF	On-Demand	Reactive	ESRRG	20	40
Oc1nnc(Cl)cc1N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872409389	DF	On-Demand	Anodyne	DRD4	36	46
Oc1nnc(Cl)cc1N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872409389	DF	On-Demand	Anodyne	SIGMAR1	36	40
Oc1nnc(Cl)cc1N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872409389	DF	On-Demand	Anodyne	CCR2	17	45
Oc1nnc(Cl)cc1N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872409390	DF	On-Demand	Anodyne	DRD4	36	46
Oc1nnc(Cl)cc1N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872409390	DF	On-Demand	Anodyne	SIGMAR1	36	40
Oc1nnc(Cl)cc1N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872409390	DF	On-Demand	Anodyne	CCR2	17	45
Nc1nc(N[C@@H](CO)Cc2ccccc2)nc(C(F)F)n1	ZINC000872409445	CD	On-Demand	Anodyne	TPH1	49	37
Nc1nc(N[C@H](CO)Cc2ccccc2)nc(C(F)F)n1	ZINC000872409447	CD	On-Demand	Anodyne	TPH1	49	37
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc(OCCN(C)C)cc1	ZINC000872409509	FE	On-Demand	Reactive	LTA4H	24	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc(OCCN(C)C)cc1	ZINC000872409509	FE	On-Demand	Reactive	PLA2G4B	63	42
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc(OCCN(C)C)cc1	ZINC000872409509	FE	On-Demand	Reactive	ESRRG	73	46
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc(OCCN(C)C)cc1	ZINC000872409509	FE	On-Demand	Reactive	PPO2	40	37
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc(OCCN(C)C)cc1	ZINC000872409509	FE	On-Demand	Reactive	UTS2	43	34
CN(C)C(=O)c1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872409591	DD	On-Demand	Anodyne	TPH1	61	44
CN(C)C(=O)c1cccc(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872409591	DD	On-Demand	Anodyne	DRTS_TRYCR	44	31
CCC(=O)c1c(Cl)cccc1NCCn1cncn1	ZINC000872409629	CF	On-Demand	Anodyne	HIS3	54	32
CC(CC(F)(F)F)=NNCc1ccc2ccccc2n1	ZINC000872409683	CH	On-Demand	Mild	CYSLTR1	20	40
NC(=O)c1cc(NCCN2CCCCCC2)nc(Cl)n1	ZINC000872409709	CD	On-Demand	Anodyne	HNMT	47	34
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HTR1A	62	48
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	DRD2	37	48
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	DRD4	34	49
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	ADRA1D	20	43
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HTR2A	54	48
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HTR2C	21	41
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	ADRA1A	22	43
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	DRD3	44	46
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HRP1_PLAFA	47	32
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HTR7	82	52
Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872409743	FE	On-Demand	Anodyne	HNMT	52	38
Cc1c(F)ncnc1NC1CCN(C[C@H]2CCCO2)CC1	ZINC000872409762	CD	On-Demand	Anodyne	TNK2	57	37
Cc1c(F)ncnc1NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000872409767	CD	On-Demand	Anodyne	TNK2	57	37
O=C(O)c1ccc(C(=O)NN=C2CC3(CCC3)C2)cc1	ZINC000872409770	CE	On-Demand	Reactive	RARA	42	33
COC(=O)C1CCC(=NNCc2ccc3ccccc3n2)CC1	ZINC000872409789	DG	On-Demand	Mild	ALOX5	27	41
COC(=O)C1CCC(=NNCc2ccc3ccccc3n2)CC1	ZINC000872409789	DG	On-Demand	Mild	ALOX5AP	40	38
COc1ccccc1NC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872409806	FG	On-Demand	Anodyne	HTR1A	35	47
COc1ccccc1NC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872409806	FG	On-Demand	Anodyne	DRD2	21	41
COc1ccccc1NC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872409806	FG	On-Demand	Anodyne	ADRA1D	23	41
COc1ccccc1NC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872409806	FG	On-Demand	Anodyne	ADRA1A	20	41
COc1ccccc1NC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872409806	FG	On-Demand	Anodyne	DRD3	22	40
CCOc1ccccc1C=NNC[C@H]1CCCC1(F)F	ZINC000872409858	CG	On-Demand	Mild	HCN1	40	32
CCOc1ccccc1C=NNC[C@H]1CCCC1(F)F	ZINC000872409858	CG	On-Demand	Mild	HCN4	40	32
CCOc1ccccc1C=NNC[C@@H]1CCCC1(F)F	ZINC000872409860	CG	On-Demand	Mild	HCN1	40	32
CCOc1ccccc1C=NNC[C@@H]1CCCC1(F)F	ZINC000872409860	CG	On-Demand	Mild	HCN4	40	32
CCOCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409861	DD	On-Demand	Anodyne	SIRT3	50	34
CCOCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409861	DD	On-Demand	Anodyne	SIRT2	45	32
CCOCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872409861	DD	On-Demand	Anodyne	SIRT1	41	34
CCOCCCNC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872409874	EF	On-Demand	Anodyne	TBK1	65	38
O=C(O)c1ccc(C(=O)NN=C2CCCC[C@H]2N2CCCCCC2)cc1	ZINC000872409894	FG	On-Demand	Reactive	L3MBTL3	63	37
O=C(O)c1ccc(C(=O)NN=C2CCCC[C@@H]2N2CCCCCC2)cc1	ZINC000872409895	FG	On-Demand	Reactive	L3MBTL3	63	37
CCN(Cc1ccccc1Cl)c1nc(N)nc(C(F)F)n1	ZINC000872409897	DG	On-Demand	Anodyne	DRTS_TOXGO	19	40
CCN(Cc1ccccc1Cl)c1nc(N)nc(C(F)F)n1	ZINC000872409897	DG	On-Demand	Anodyne	DYR_PNECA	18	40
O=C(O)c1ccc(C(=O)NN=C2CCC3(CC2)CC3)cc1	ZINC000872409900	CF	On-Demand	Reactive	RARA	43	35
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HTR1A	84	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	DRD2	59	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	DRD4	55	49
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	ADRA1D	30	45
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HTR2A	72	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HTR2C	35	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	SLC6A4	17	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	ADRA1A	32	45
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	ADRA1B	17	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	DRD3	71	46
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HRP1_PLAFA	92	39
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HTR7	98	61
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	SIGMAR1	17	44
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2)CC1	ZINC000872409929	EE	On-Demand	Anodyne	HNMT	79	39
CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1OC	ZINC000872409930	DG	On-Demand	Anodyne	DRTS_PLAFK	23	41
CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1OC	ZINC000872409930	DG	On-Demand	Anodyne	LPAR2	15	41
CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1OC	ZINC000872409930	DG	On-Demand	Anodyne	DRTS_TRYCR	51	36
CCOC(=O)NC1CCC(=NNCc2ccc3ccccc3n2)CC1	ZINC000872409948	EG	On-Demand	Mild	CYSLTR1	18	41
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	P2RX7	51	45
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	NPY2R	32	55
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	SLC9A1	15	41
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	RBP4	65	40
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	SCD1	37	58
O=C(c1ccccc1C(F)(F)F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872409955	GF	On-Demand	Anodyne	SCD	35	58
c1ccc(-c2cc(N3CCN4CCCC[C@H]4C3)ncn2)cc1	ZINC000872409996	CF	On-Demand	Anodyne	HRH3	16	53
c1ccc(-c2cc(N3CCN4CCCC[C@@H]4C3)ncn2)cc1	ZINC000872409997	CF	On-Demand	Anodyne	HRH3	16	53
CCCOc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872410012	DG	On-Demand	Anodyne	PDE5A	29	42
CCCOc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872410012	DG	On-Demand	Anodyne	EGFR	27	49
CCCOc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872410012	DG	On-Demand	Anodyne	PDE6A	47	37
CCCOc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872410012	DG	On-Demand	Anodyne	DRTS_TRYCR	48	35
O=C(O)C1CCC(=NNCc2ccc3ccccc3n2)CC1	ZINC000872410048	CF	On-Demand	Mild	ALOX5	27	49
CN(C)C(=O)c1cccc(CNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872410078	EE	On-Demand	Anodyne	ADORA3	45	38
CC(CC1CC1)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410093	CE	On-Demand	Reactive	ESRRG	17	41
Cc1c(F)ncnc1N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872410098	FE	On-Demand	Anodyne	ADRA1D	25	46
Cc1c(F)ncnc1N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872410098	FE	On-Demand	Anodyne	ADRA1A	17	46
Cc1c(F)ncnc1N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872410098	FE	On-Demand	Anodyne	ADRA1B	19	46
Cc1c(F)ncnc1N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000872410098	FE	On-Demand	Anodyne	SFRP1	43	32
CC(CC(F)(F)F)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410099	CE	On-Demand	Reactive	ESRRG	17	40
Cc1c(F)ncnc1N1CCC(CN2CCCCCC2)CC1	ZINC000872410116	DG	On-Demand	Anodyne	SIRT3	40	47
Cc1c(F)ncnc1N1CCC(CN2CCCCCC2)CC1	ZINC000872410116	DG	On-Demand	Anodyne	SIRT2	28	47
CON(C)C(=O)CCC(C)=NNCc1ccc2ccccc2n1	ZINC000872410119	DF	On-Demand	Mild	CYSLTR1	32	41
COc1cc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)ccc1Cl	ZINC000872410128	FD	On-Demand	Anodyne	HTR6	16	42
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	HTR1A	31	49
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	DRD2	29	41
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	HTR4	24	44
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	KCNQ2	51	34
COc1ccccc1NC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872410149	FF	On-Demand	Anodyne	RBP4	16	42
O=C(CN=c1cc[nH]cc1C1CC1)NCc1ccccc1	ZINC000872410154	CE	On-Demand	Anodyne	PLG	40	32
COCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410173	CD	On-Demand	Reactive	PLA2G4B	42	36
COCCCC(C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410173	CD	On-Demand	Reactive	PPO2	43	39
NC(=O)c1cc(N2CCC(CN3CCCCCC3)CC2)nc(Cl)n1	ZINC000872410180	FE	On-Demand	Anodyne	SIRT3	16	47
O=S(=O)(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872410255	GF	On-Demand	Anodyne	ADRA1D	27	47
O=S(=O)(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872410255	GF	On-Demand	Anodyne	ADRA1A	19	47
O=S(=O)(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872410255	GF	On-Demand	Anodyne	ADRA1B	21	47
O=S(=O)(NC1CCN(c2ccnc3ncccc23)CC1)c1ccc(F)cc1	ZINC000872410255	GF	On-Demand	Anodyne	SFRP1	72	35
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	DRD2	18	40
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	DRD4	27	40
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	ACHE	18	44
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	HTR2A	22	43
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	DRD3	20	41
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	HRP1_PLAFA	69	35
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	HTR7	26	45
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	SIGMAR1	28	44
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	BCHE	19	44
Nc1nc(NCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872410368	GE	On-Demand	Anodyne	HNMT	60	37
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(F)(F)CC)c1	ZINC000872410369	GI	On-Demand	Anodyne	LIMK2	29	42
CNC(=O)CN1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872410372	FE	On-Demand	Anodyne	AVPR1B	40	36
CNC(=O)CN1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872410372	FE	On-Demand	Anodyne	GRM5	17	41
CNC(=O)CN1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872410372	FE	On-Demand	Anodyne	MCHR1	24	41
CCCn1nc(C)c(C=NNC(=O)c2ccc(C(=O)O)cc2)c1C	ZINC000872410390	EE	On-Demand	Reactive	ESRRG	19	41
Cn1nc2c(c1S(=O)(=O)Nc1ccc3c(c1)SCC(=O)N3)CCCC2	ZINC000872410422	GE	On-Demand	Anodyne	PKM	39	40
Cc1c(F)ncnc1NCc1cccc(C(=O)N(C)C)c1	ZINC000872410440	CE	On-Demand	Anodyne	CLK4	31	40
O=C(NC1CC1)[C@@H]1CCCN1c1ccnc2ncccc12	ZINC000872410446	CD	On-Demand	Anodyne	EPHX2	16	40
O=C(NC1CC1)[C@H]1CCCN1c1ccnc2ncccc12	ZINC000872410448	CD	On-Demand	Anodyne	EPHX2	16	40
CC(=NNC(=O)c1ccc(C(=O)O)cc1)C1CCC(F)(F)CC1	ZINC000872410455	DG	On-Demand	Reactive	RARA	41	33
O=C(O)c1ccc(C(=O)NN=C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1	ZINC000872410458	GG	On-Demand	Reactive	DRD4	23	41
O=C(O)c1ccc(C(=O)NN=C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1	ZINC000872410458	GG	On-Demand	Reactive	ACHE	23	44
O=C(O)c1ccc(C(=O)NN=C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1	ZINC000872410458	GG	On-Demand	Reactive	OPRM1	17	51
O=C(O)c1ccc(C(=O)NN=C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1	ZINC000872410458	GG	On-Demand	Reactive	LTA4H	26	52
O=C(O)c1ccc(C(=O)NN=C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1	ZINC000872410458	GG	On-Demand	Reactive	SIGMAR1	28	42
O=C(O)c1ccc(C(=O)NN=C2CCN3CCC[C@H]23)cc1	ZINC000872410466	CD	On-Demand	Reactive	L3MBTL3	44	37
O=C(O)c1ccc(C(=O)NN=C2CCN3CCC[C@@H]23)cc1	ZINC000872410467	CD	On-Demand	Reactive	L3MBTL3	44	37
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410491	GG	On-Demand	Reactive	DRD4	30	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410491	GG	On-Demand	Reactive	ACHE	29	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410491	GG	On-Demand	Reactive	SIGMAR1	37	42
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410491	GG	On-Demand	Reactive	NOD2	41	34
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410492	GG	On-Demand	Reactive	DRD4	30	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410492	GG	On-Demand	Reactive	ACHE	29	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410492	GG	On-Demand	Reactive	SIGMAR1	37	42
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872410492	GG	On-Demand	Reactive	NOD2	41	34
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410493	GG	On-Demand	Reactive	DRD4	30	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410493	GG	On-Demand	Reactive	ACHE	29	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410493	GG	On-Demand	Reactive	SIGMAR1	37	42
O=C(O)c1ccc(C(=O)NN=C2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410493	GG	On-Demand	Reactive	NOD2	41	34
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410494	GG	On-Demand	Reactive	DRD4	30	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410494	GG	On-Demand	Reactive	ACHE	29	44
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410494	GG	On-Demand	Reactive	SIGMAR1	37	42
O=C(O)c1ccc(C(=O)NN=C2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1	ZINC000872410494	GG	On-Demand	Reactive	NOD2	41	34
CN1CCn2nc(NS(=O)(=O)c3ccc(C(F)(F)F)c(C#N)c3)cc2C1	ZINC000872410519	GE	On-Demand	Mild	SFRP1	42	31
CN1CCn2nc(NS(=O)(=O)c3ccc(C(F)(F)F)c(C#N)c3)cc2C1	ZINC000872410519	GE	On-Demand	Mild	WNT3	49	32
NC(=O)c1cc(NCC2CCC2)nc(Cl)n1	ZINC000872410522	BD	On-Demand	Anodyne	VCP	48	36
CNC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872410552	ED	On-Demand	Anodyne	PTPN2	43	33
CNC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872410552	ED	On-Demand	Anodyne	MAPK9	15	44
CNC(=O)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872410552	ED	On-Demand	Anodyne	HPGDS	27	40
O=S(=O)(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872410554	GD	On-Demand	Anodyne	ADRA1D	27	45
O=S(=O)(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872410554	GD	On-Demand	Anodyne	ADRA1A	19	45
O=S(=O)(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872410554	GD	On-Demand	Anodyne	ADRA1B	21	45
O=S(=O)(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872410554	GD	On-Demand	Anodyne	SFRP1	103	37
O=S(=O)(NC1CCN(c2cc(Cl)nnc2O)CC1)c1ccc(F)cc1	ZINC000872410554	GD	On-Demand	Anodyne	WNT3	55	32
CC(=NNC[C@H]1CCCC1(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872410601	EE	On-Demand	Mild	CA2	49	43
CC(=NNC[C@@H]1CCCC1(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000872410602	EE	On-Demand	Mild	CA2	49	43
CCS(=O)(=O)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872410645	DD	On-Demand	Anodyne	CCR8	48	36
FC1(F)CCC[C@H]1CNN=Cc1ccc(N2CCOCC2)cc1	ZINC000872410646	DF	On-Demand	Mild	STAT6	42	32
FC1(F)CCC[C@@H]1CNN=Cc1ccc(N2CCOCC2)cc1	ZINC000872410647	DF	On-Demand	Mild	STAT6	42	32
Oc1nnc(Cl)cc1NCCN1CCCCCC1	ZINC000872410658	CE	On-Demand	Anodyne	HNMT	79	45
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	DRD2	25	48
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	DRD4	57	47
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	ACHE	49	50
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	DRD3	19	41
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	LTA4H	27	43
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	SIGMAR1	58	48
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	CCR3	21	40
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	HDAC6	18	40
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	SLC6A5	23	42
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	MCHR1	23	43
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	CACNA1G	38	44
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	CYP2J2	46	33
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410678	FG	On-Demand	Reactive	NOD2	47	39
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	DRD2	25	48
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	DRD4	57	47
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	ACHE	49	50
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	DRD3	19	41
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	LTA4H	27	43
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	SIGMAR1	58	48
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	CCR3	21	40
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	HDAC6	18	40
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	SLC6A5	23	42
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	MCHR1	23	43
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	CACNA1G	38	44
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	CYP2J2	46	33
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410679	FG	On-Demand	Reactive	NOD2	47	39
CO[C@@]1(C)CC(=NNC(=O)c2ccc(C(=O)O)cc2)C1(C)C	ZINC000872410713	DE	On-Demand	Reactive	RARA	41	33
COCCOc1ccc(CNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872410752	ED	On-Demand	Anodyne	PROKR1	59	34
CCc1nn(C)c(CC)c1C=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872410757	EE	On-Demand	Reactive	ESRRG	19	41
CCC(=O)c1c(Cl)cccc1N(C)Cc1c(C)noc1C	ZINC000872410830	DI	On-Demand	Anodyne	GPBAR1	29	41
O=C(NC1CC1)[C@@H]1CCCN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872410850	EG	On-Demand	Anodyne	GRM5	18	42
O=C(NC1CC1)[C@H]1CCCN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872410851	EG	On-Demand	Anodyne	GRM5	18	42
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872410958	FF	On-Demand	Anodyne	TRPV1	18	44
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872410958	FF	On-Demand	Anodyne	P2RX7	38	45
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872410958	FF	On-Demand	Anodyne	RBP4	62	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872410958	FF	On-Demand	Anodyne	SCD1	31	53
Cc1c(F)ncnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000872410958	FF	On-Demand	Anodyne	SCD	32	53
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	DRD2	18	42
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	DRD4	48	39
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	HTR2A	18	41
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	HTR2C	17	41
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	DRD3	26	42
CCC(=O)c1c(Cl)cccc1NCCN1CCN(CC)CC1	ZINC000872410983	DF	On-Demand	Anodyne	HTR4	16	44
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	DRD2	24	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	DRD4	56	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	ACHE	47	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	SLC6A1	76	33
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	DRD3	20	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	LTA4H	28	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	SIGMAR1	53	47
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	CCR5	19	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	SLC18A3	30	47
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	SLC6A5	23	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	MCHR1	29	42
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	CACNA1G	40	48
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	CYP2J2	48	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872410997	FG	On-Demand	Reactive	NOD2	41	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	DRD2	24	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	DRD4	56	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	ACHE	47	52
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	SLC6A1	76	33
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	DRD3	20	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	LTA4H	28	45
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	SIGMAR1	53	47
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	CCR5	19	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	SLC18A3	30	47
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	SLC6A5	23	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	MCHR1	29	42
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	CACNA1G	40	48
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	CYP2J2	48	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872410999	FG	On-Demand	Reactive	NOD2	41	35
NC(=O)c1cc(NC2CCN(C[C@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872411001	ED	On-Demand	Anodyne	PDE8B	46	33
NC(=O)c1cc(NC2CCN(C[C@@H]3CCCO3)CC2)nc(Cl)n1	ZINC000872411004	ED	On-Demand	Anodyne	PDE8B	46	33
CCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1C(C)C	ZINC000872411006	GF	On-Demand	Anodyne	PDE5A	19	40
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@H]3CCC[C@H]23)cc1	ZINC000872411028	GH	On-Demand	Reactive	ACHE	18	41
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@H]3CCC[C@H]23)cc1	ZINC000872411028	GH	On-Demand	Reactive	SIGMAR1	21	44
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@H]3CCC[C@@H]23)cc1	ZINC000872411030	GH	On-Demand	Reactive	ACHE	18	41
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@H]3CCC[C@@H]23)cc1	ZINC000872411030	GH	On-Demand	Reactive	SIGMAR1	21	44
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@@H]3CCC[C@@H]23)cc1	ZINC000872411031	GH	On-Demand	Reactive	ACHE	18	41
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@@H]3CCC[C@@H]23)cc1	ZINC000872411031	GH	On-Demand	Reactive	SIGMAR1	21	44
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@@H]3CCC[C@H]23)cc1	ZINC000872411032	GH	On-Demand	Reactive	ACHE	18	41
O=C(O)c1ccc(C(=O)NN=C2CCN(Cc3ccccc3)[C@@H]3CCC[C@H]23)cc1	ZINC000872411032	GH	On-Demand	Reactive	SIGMAR1	21	44
COC(=O)c1c(F)cccc1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872411117	FD	On-Demand	Anodyne	BDKRB1	26	40
COc1ccc(Cl)cc1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872411157	FD	On-Demand	Anodyne	CPT1A	75	41
COc1ccc(Cl)cc1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872411157	FD	On-Demand	Anodyne	CPT2	48	36
COc1ccc(Cl)cc1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872411157	FD	On-Demand	Anodyne	CPT1B	73	38
Nc1nc(NC[C@@H](O)c2cccc(Cl)c2)nc(C(F)F)n1	ZINC000872411178	DE	On-Demand	Anodyne	CYP3A4	46	34
Nc1nc(NC[C@H](O)c2cccc(Cl)c2)nc(C(F)F)n1	ZINC000872411179	DE	On-Demand	Anodyne	CYP3A4	46	34
C[C@H]1CC(C)(C)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411219	CF	On-Demand	Reactive	RARA	41	33
CCS(=O)(=O)NC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872411220	EE	On-Demand	Anodyne	HRH4	15	55
C[C@@H]1CC(C)(C)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411221	CF	On-Demand	Reactive	RARA	41	33
Nc1nc(NCCN2CCCCCC2)nc(C(F)F)n1	ZINC000872411238	CD	On-Demand	Anodyne	HNMT	50	36
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RARA	48	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RARG	58	36
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RXRG	45	36
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RARB	53	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RXRA	38	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@]1(C)CCCO1	ZINC000872411256	CE	On-Demand	Reactive	RXRB	47	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RARA	48	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RARG	58	36
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RXRG	45	36
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RARB	53	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RXRA	38	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@]1(C)CCCO1	ZINC000872411257	CE	On-Demand	Reactive	RXRB	47	38
c1ccc(-c2cc(NC3CCN(C[C@H]4CCCO4)CC3)ncn2)cc1	ZINC000872411263	EG	On-Demand	Anodyne	PRKD1	45	33
c1ccc(-c2cc(NC3CCN(C[C@H]4CCCO4)CC3)ncn2)cc1	ZINC000872411263	EG	On-Demand	Anodyne	TNK2	61	42
c1ccc(-c2cc(NC3CCN(C[C@@H]4CCCO4)CC3)ncn2)cc1	ZINC000872411265	EG	On-Demand	Anodyne	PRKD1	45	33
c1ccc(-c2cc(NC3CCN(C[C@@H]4CCCO4)CC3)ncn2)cc1	ZINC000872411265	EG	On-Demand	Anodyne	TNK2	61	42
O=C(c1ccc(Cl)cc1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872411289	GG	On-Demand	Anodyne	P2RX7	22	49
COCCOc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872411319	EE	On-Demand	Anodyne	DRTS_TRYCR	45	32
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	DRD2	17	46
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	DRD4	46	46
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	ACHE	33	46
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	SIGMAR1	39	44
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	CACNA1G	27	40
C[C@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411332	FF	On-Demand	Reactive	NOD2	44	37
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	DRD2	17	46
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	DRD4	46	46
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	ACHE	33	46
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	SIGMAR1	39	44
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	CACNA1G	27	40
C[C@@H]1CN(Cc2ccccc2)CC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411333	FF	On-Demand	Reactive	NOD2	44	37
Cn1ncc2c(NCCN3CCCCCC3)nc(Cl)nc21	ZINC000872411350	DE	On-Demand	Anodyne	HNMT	55	36
CCCCCNC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872411364	DG	On-Demand	Anodyne	TBK1	70	39
CN1CCn2nc(NS(=O)(=O)c3ccc4c5c(cccc35)C(=O)N4C)cc2C1	ZINC000872411372	GD	On-Demand	Anodyne	RORC	16	41
O=C(O)c1ccc(C(=O)NN=C2CCC(F)(F)CC2)cc1	ZINC000872411404	CF	On-Demand	Reactive	RARA	40	33
O=C(O)c1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872411410	GG	On-Demand	Reactive	DRD4	33	45
O=C(O)c1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872411410	GG	On-Demand	Reactive	ACHE	32	45
O=C(O)c1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872411410	GG	On-Demand	Reactive	SIGMAR1	37	43
O=C(O)c1ccc(C(=O)NN=C2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1	ZINC000872411410	GG	On-Demand	Reactive	NOD2	42	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411413	CF	On-Demand	Reactive	RARA	44	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411413	CF	On-Demand	Reactive	RARG	54	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411413	CF	On-Demand	Reactive	RXRG	40	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411413	CF	On-Demand	Reactive	RARB	49	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411413	CF	On-Demand	Reactive	RXRB	40	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411414	CF	On-Demand	Reactive	RARA	44	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411414	CF	On-Demand	Reactive	RARG	54	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411414	CF	On-Demand	Reactive	RXRG	40	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411414	CF	On-Demand	Reactive	RARB	49	38
CC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411414	CF	On-Demand	Reactive	RXRB	40	38
CCCCCNC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872411421	EG	On-Demand	Anodyne	HTR1A	15	42
CCCCCNC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872411421	EG	On-Demand	Anodyne	CNR2	15	42
O=C(O)c1ccc(C(=O)NN=C2CCCC[C@@H]2N2CCCCC2)cc1	ZINC000872411464	EF	On-Demand	Reactive	L3MBTL3	63	37
O=C(O)c1ccc(C(=O)NN=C2CCCC[C@H]2N2CCCCC2)cc1	ZINC000872411465	EF	On-Demand	Reactive	L3MBTL3	63	37
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN1Cc1ccccc1	ZINC000872411493	FF	On-Demand	Reactive	ACHE	20	43
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN1Cc1ccccc1	ZINC000872411493	FF	On-Demand	Reactive	SIGMAR1	22	41
COC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872411500	GF	On-Demand	Anodyne	NPY2R	66	44
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN(Cc2ccccc2)C1	ZINC000872411508	FG	On-Demand	Reactive	DRD2	17	43
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN(Cc2ccccc2)C1	ZINC000872411508	FG	On-Demand	Reactive	DRD4	42	43
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN(Cc2ccccc2)C1	ZINC000872411508	FG	On-Demand	Reactive	ACHE	36	46
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN(Cc2ccccc2)C1	ZINC000872411508	FG	On-Demand	Reactive	SIGMAR1	39	42
C[C@H]1CC(=NNC(=O)c2ccc(C(=O)O)cc2)CN(Cc2ccccc2)C1	ZINC000872411508	FG	On-Demand	Reactive	NOD2	43	37
Oc1nnc(Cl)cc1N1CCC(CN2CCCCCC2)CC1	ZINC000872411516	DF	On-Demand	Anodyne	SIRT3	15	45
O=C(O)c1ccc(C(=O)NN=C2CC3(CCCCC3)C2)cc1	ZINC000872411520	DG	On-Demand	Reactive	RARA	41	33
CN1CCn2nc(NS(=O)(=O)c3cccc4cccnc34)cc2C1	ZINC000872411524	ED	On-Demand	Anodyne	C0L093_TOBAC	59	36
CN1CCn2nc(NS(=O)(=O)c3ccc(CCCCl)cc3)cc2C1	ZINC000872411538	FE	On-Demand	Reactive	NMT1	15	42
CN1CCn2nc(NS(=O)(=O)c3cnccc3C(F)(F)F)cc2C1	ZINC000872411545	FD	On-Demand	Anodyne	WNT3	41	33
CCC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411561	CF	On-Demand	Reactive	RARA	40	33
CCC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000872411561	CF	On-Demand	Reactive	DPEP1	57	36
CCC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411562	CF	On-Demand	Reactive	RARA	40	33
CCC(=NNC(=O)c1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000872411562	CF	On-Demand	Reactive	DPEP1	57	36
CN1CCn2nc(NS(=O)(=O)c3ccc(C#N)c(C(F)(F)F)c3)cc2C1	ZINC000872411576	GE	On-Demand	Mild	AR	43	36
Cc1ccc2cccnc2c1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872411588	FD	On-Demand	Anodyne	C0L093_TOBAC	62	35
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)c2ccccc12	ZINC000872411639	GE	On-Demand	Anodyne	CCR8	100	39
Cc1ccc2cccc(S(=O)(=O)Nc3cc4n(n3)CCN(C)C4)c2n1	ZINC000872411669	FD	On-Demand	Anodyne	C0L093_TOBAC	53	30
CC(CC(C)(C)C)=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411689	CF	On-Demand	Reactive	ESRRG	18	41
CN1CCn2nc(NS(=O)(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)cc2C1	ZINC000872411691	GD	On-Demand	Anodyne	MGAT1	57	33
CC[C@]1(C)CCCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411728	CG	On-Demand	Reactive	RARA	42	35
CC[C@]1(C)CCCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411728	CG	On-Demand	Reactive	RARG	45	33
CC[C@]1(C)CCCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411728	CG	On-Demand	Reactive	RXRG	43	36
CC[C@]1(C)CCCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411728	CG	On-Demand	Reactive	RARB	41	35
CC[C@]1(C)CCCC1=NNC(=O)c1ccc(C(=O)O)cc1	ZINC000872411728	CG	On-Demand	Reactive	RXRB	43	36
CN1CCn2nc(NS(=O)(=O)c3ccc(C(F)(F)F)c(F)c3)cc2C1	ZINC000872411801	GE	On-Demand	Anodyne	SFRP1	54	34
CN1CCn2nc(NS(=O)(=O)c3ccc(C(F)(F)F)c(F)c3)cc2C1	ZINC000872411801	GE	On-Demand	Anodyne	WNT3	61	34
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc2c(c1)CCNCC2	ZINC000872411811	FE	On-Demand	Reactive	RARA	41	35
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc2c(c1)CCNCC2	ZINC000872411811	FE	On-Demand	Reactive	ABAT	19	41
CC(=NNC(=O)c1ccc(C(=O)O)cc1)c1ccc2c(c1)CCNCC2	ZINC000872411811	FE	On-Demand	Reactive	PPO2	24	40
O=C(Cc1ccc(Nc2cc(Cl)nnc2O)cc1)N1CCOCC1	ZINC000872411834	ED	On-Demand	Anodyne	STAT6	53	34
CCCCCNC(=O)C1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872411843	ED	On-Demand	Anodyne	TPP2	25	40
CCCCCNC(=O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872411850	EE	On-Demand	Anodyne	ASAH1	48	35
CCCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872411858	DE	On-Demand	Anodyne	SIRT3	61	36
CCCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872411858	DE	On-Demand	Anodyne	SIRT2	52	33
CCCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872411858	DE	On-Demand	Anodyne	SIRT1	51	32
CCCCCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872411858	DE	On-Demand	Anodyne	ASAH1	51	35
O=C(O)c1ccc(C(=O)NN=C2COC3(CCC3)C2)cc1	ZINC000872411866	CD	On-Demand	Reactive	RARA	40	33
O=C(O)c1ccc(C(=O)NN=C2COC3(CCC3)C2)cc1	ZINC000872411866	CD	On-Demand	Reactive	RARG	40	31
O=C(O)c1ccc(C(=O)NN=C2CCCN3CCCC[C@@H]23)cc1	ZINC000872411877	DE	On-Demand	Reactive	L3MBTL3	72	37
O=C(O)c1ccc(C(=O)NN=C2CCCN3CCCC[C@H]23)cc1	ZINC000872411878	DE	On-Demand	Reactive	L3MBTL3	72	37
CN1CCn2nc(NS(=O)(=O)c3ccc(OCc4ccccc4)cc3)cc2C1	ZINC000872411887	GF	On-Demand	Anodyne	MMP13	36	41
CN1CCn2nc(NS(=O)(=O)c3ccc(OCc4ccccc4)cc3)cc2C1	ZINC000872411887	GF	On-Demand	Anodyne	ADAM17	48	41
CN1CCn2nc(NS(=O)(=O)c3ccc(OCc4ccccc4)cc3)cc2C1	ZINC000872411887	GF	On-Demand	Anodyne	MMP2	15	41
CN1CCn2nc(NS(=O)(=O)c3ccc(OCc4ccccc4)cc3)cc2C1	ZINC000872411887	GF	On-Demand	Anodyne	MMP9	15	41
Cc1c(F)ncnc1NCc1ccc(NC(=O)NC(C)C)cc1	ZINC000872411899	DG	On-Demand	Anodyne	FLT1	18	40
COc1ccc(OC)c2sc(NCC(=O)N3CCCCC3)nc12	ZINC000872411942	EF	On-Demand	Anodyne	ADORA2B	19	51
CC(=O)c1cccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)c1	ZINC000872411960	ED	On-Demand	Anodyne	AKR1C3	50	35
CN1CCn2nc(NS(=O)(=O)c3ccc4c(c3)CC(=O)N4)cc2C1	ZINC000872411965	EC	On-Demand	Anodyne	PKM	23	42
CN1CCn2nc(NS(=O)(=O)c3ccc(Cl)s3)cc2C1	ZINC000872411998	ED	On-Demand	Anodyne	CCR4	64	37
Cc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872412007	DE	On-Demand	Anodyne	AKT3	22	40
Cc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872412007	DE	On-Demand	Anodyne	AKT1	23	40
Cc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872412007	DE	On-Demand	Anodyne	SMO	21	48
Cc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872412007	DE	On-Demand	Anodyne	HPGD	35	40
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cc4n(n3)CCN(C)C4)ccc21	ZINC000872412012	GD	On-Demand	Anodyne	HSD17B3	44	32
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C(C)=O)CC1	ZINC000872412016	EF	On-Demand	Anodyne	DRD4	46	38
CCC(=O)c1c(Cl)cccc1NCCN1CCN(C(C)=O)CC1	ZINC000872412016	EF	On-Demand	Anodyne	DRD3	23	41
CCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412068	FD	On-Demand	Anodyne	MMP13	26	40
CCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412068	FD	On-Demand	Anodyne	MMP3	18	40
CCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412068	FD	On-Demand	Anodyne	MMP7	18	40
NS(=O)(=O)c1ccc(N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872412078	FD	On-Demand	Anodyne	CA12	17	54
NS(=O)(=O)c1ccc(N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872412078	FD	On-Demand	Anodyne	CA9	19	54
CN1CCn2nc(NS(=O)(=O)c3ccccc3C(F)(F)F)cc2C1	ZINC000872412079	FE	On-Demand	Anodyne	SFRP1	101	34
CN1CCn2nc(NS(=O)(=O)c3ccccc3C(F)(F)F)cc2C1	ZINC000872412079	FE	On-Demand	Anodyne	WNT3	77	34
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	HTR1A	20	40
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	ADRA1D	16	40
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	ADRA1A	18	41
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	DRD3	22	41
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	P2RY12	45	37
CC(=O)N1CCN(CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872412142	ED	On-Demand	Anodyne	FAAH	17	45
COc1ccc(OC)c2sc(NCCN3CCN(C(C)=O)CC3)nc12	ZINC000872412148	FD	On-Demand	Anodyne	HTR1A	40	41
COc1ccc(OC)c2sc(NCCN3CCN(C(C)=O)CC3)nc12	ZINC000872412148	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(OC)c2sc(NCCN3CCN(C(C)=O)CC3)nc12	ZINC000872412148	FD	On-Demand	Anodyne	ADRA1D	48	39
COc1ccc(OC)c2sc(NCCN3CCN(C(C)=O)CC3)nc12	ZINC000872412148	FD	On-Demand	Anodyne	ADRA1A	40	39
COc1ccc(OC)c2sc(NCCN3CCN(C(C)=O)CC3)nc12	ZINC000872412148	FD	On-Demand	Anodyne	ADORA2B	20	47
Cc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872412164	DG	On-Demand	Anodyne	SMO	17	41
Cc1ccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872412164	DG	On-Demand	Anodyne	L3MBTL3	50	36
O[C@H](CNc1ccnc2ncccc12)CN1CCCCC1	ZINC000872412166	CD	On-Demand	Anodyne	HNMT	86	45
O[C@@H](CNc1ccnc2ncccc12)CN1CCCCC1	ZINC000872412167	CD	On-Demand	Anodyne	HNMT	86	45
CN1CCn2nc(NS(=O)(=O)c3cccc(C(=O)NC4CC4)c3)cc2C1	ZINC000872412178	GD	On-Demand	Anodyne	MAPK13	72	32
CN1CCn2nc(NS(=O)(=O)c3cccc(C(=O)NC4CC4)c3)cc2C1	ZINC000872412178	GD	On-Demand	Anodyne	AKR1C3	44	36
CN1CCn2nc(NS(=O)(=O)c3cccc(Cl)c3)cc2C1	ZINC000872412214	ED	On-Demand	Anodyne	HTR6	22	41
CC(C)c1nnc(N2CCC(C(=O)NCCCN3CCCC3)CC2)o1	ZINC000872412227	EE	On-Demand	Anodyne	TBK1	43	33
Cc1c(F)ncnc1N1CCC(NC(=O)C(C)C)CC1	ZINC000872412268	CD	On-Demand	Anodyne	SIRT3	76	35
Cc1c(F)ncnc1N1CCC(NC(=O)C(C)C)CC1	ZINC000872412268	CD	On-Demand	Anodyne	SIRT2	60	34
Cc1c(F)ncnc1N1CCC(NC(=O)C(C)C)CC1	ZINC000872412268	CD	On-Demand	Anodyne	SIRT1	51	33
CN(C)c1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872412294	EF	On-Demand	Anodyne	PRTN3	50	32
CN1CCn2nc(NS(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)cc2C1	ZINC000872412335	GF	On-Demand	Anodyne	WNT3	40	31
CCOC(=O)N1CCC(NC(=O)CCCNc2ncnc(F)c2C)CC1	ZINC000872412339	FD	On-Demand	Anodyne	CCR8	19	41
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412345	ED	On-Demand	Anodyne	IDO1	31	41
CN1CCn2nc(NS(=O)(=O)c3ccc4c(c3)CCCC(=O)N4)cc2C1	ZINC000872412364	GD	On-Demand	Anodyne	PKM	37	48
Cc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872412372	EE	On-Demand	Anodyne	NPY2R	30	40
Cc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872412372	EE	On-Demand	Anodyne	SMO	29	45
CN1CCn2nc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)cc2C1	ZINC000872412386	FE	On-Demand	Anodyne	CACNA1B	50	36
O=C(CNc1cc(-c2ccccc2)ncn1)N1CCCCC1	ZINC000872412387	CF	On-Demand	Anodyne	DPP7	57	43
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HTR1A	58	48
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	DRD2	52	43
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	DRD4	23	41
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	ADRA1D	26	40
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HTR2A	46	42
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HTR2C	30	40
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	ADRA1A	33	40
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	DRD3	69	43
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HRP1_PLAFA	43	46
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HTR7	44	36
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	PRKD1	22	43
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	HNMT	82	40
O=C(NCCCN1CCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872412426	FE	On-Demand	Anodyne	TBK1	65	35
c1ccc(-c2cc(NC3CCN(c4ncccn4)CC3)ncn2)cc1	ZINC000872412492	EG	On-Demand	Anodyne	HRH4	18	40
c1ccc(-c2cc(NC3CCN(c4ncccn4)CC3)ncn2)cc1	ZINC000872412492	EG	On-Demand	Anodyne	PRKD1	81	39
CC(=O)N1CCc2cc(S(=O)(=O)Nc3cc4n(n3)CCN(C)C4)ccc21	ZINC000872412527	GD	On-Demand	Anodyne	HSD17B3	45	32
CC(=O)N1CCN(CCNc2cc(Cl)nnc2O)CC1	ZINC000872412537	CC	On-Demand	Anodyne	HRP1_PLAFA	42	38
COCC[C@H](C=NNc1nc2ccncc2s1)NC(=O)OC(C)(C)C	ZINC000872412538	FG	On-Demand	Mild	CTSK	16	44
COCC[C@@H](C=NNc1nc2ccncc2s1)NC(=O)OC(C)(C)C	ZINC000872412539	FG	On-Demand	Mild	CTSK	16	44
CN1CCn2nc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)cc2C1	ZINC000872412549	FC	On-Demand	Anodyne	AKR1C3	41	46
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cc2n(n1)CCN(C)C2	ZINC000872412581	EC	On-Demand	Anodyne	NMT1	42	42
CC(=O)Nc1cccc(CN=c2cc[nH]cc2C2CC2)c1	ZINC000872412600	CF	On-Demand	Anodyne	HTR1F	44	39
C[C@H]1CCCCN1Cc1ccc(CNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872412620	FG	On-Demand	Anodyne	HRH3	31	42
O=C(Cc1ccccc1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872412629	DF	On-Demand	Anodyne	PREP	41	33
CC(=O)N1CCN(CCNc2ccnc3ncccc23)CC1	ZINC000872412714	CD	On-Demand	Anodyne	HRP1_PLAFA	95	43
CC(=O)N1CCN(CCNc2ccnc3ncccc23)CC1	ZINC000872412714	CD	On-Demand	Anodyne	HNMT	91	50
O=C(COc1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872412763	FD	On-Demand	Anodyne	HTR1D	17	42
O=C(COc1ccc(F)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872412763	FD	On-Demand	Anodyne	HTR1B	19	42
CN1CCn2nc(NS(=O)(=O)c3ccc(F)c(C(F)(F)F)c3)cc2C1	ZINC000872412789	GE	On-Demand	Anodyne	WNT3	46	32
Cc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872412798	EF	On-Demand	Anodyne	SMO	43	52
CN1CCn2nc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2C1	ZINC000872412824	FC	On-Demand	Anodyne	PKM	37	42
CCOC(=O)N1CCC(NC(=O)CCCNc2ccnc3ncccc23)CC1	ZINC000872412830	GF	On-Demand	Anodyne	HRP1_PLAFA	41	36
CCOC(=O)N1CCC(NC(=O)CCCNc2ccnc3ncccc23)CC1	ZINC000872412830	GF	On-Demand	Anodyne	SSTR5	41	36
CCOC(=O)N1CCC(NC(=O)CCCNc2ccnc3ncccc23)CC1	ZINC000872412830	GF	On-Demand	Anodyne	HNMT	45	35
CCOC(=O)N1CCC(NC(=O)CCCNc2ccnc3ncccc23)CC1	ZINC000872412830	GF	On-Demand	Anodyne	CCR8	73	49
Cc1c(F)ncnc1N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000872412835	ED	On-Demand	Anodyne	PDGFRB	44	40
Cc1c(F)ncnc1N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000872412835	ED	On-Demand	Anodyne	AKT1	33	42
COCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412865	FD	On-Demand	Anodyne	MMP13	32	42
COCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412865	FD	On-Demand	Anodyne	MMP2	17	42
COCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412865	FD	On-Demand	Anodyne	MMP3	23	42
COCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412865	FD	On-Demand	Anodyne	MMP7	21	42
COCCOc1ccc(S(=O)(=O)Nc2cc3n(n2)CCN(C)C3)cc1	ZINC000872412865	FD	On-Demand	Anodyne	MMP1	23	42
CN(C)C(=O)c1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872412873	GE	On-Demand	Anodyne	PRTN3	54	34
CN(C)C(=O)c1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872412873	GE	On-Demand	Anodyne	LIMK2	34	44
C[C@@H]1CCCCN1Cc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872412912	EH	On-Demand	Anodyne	HRH3	39	44
C[C@H]1CCCCN1Cc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872412913	EH	On-Demand	Anodyne	HRH3	39	44
O=C(CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1)N1CCCC1	ZINC000872412964	GI	On-Demand	Anodyne	GRM5	18	42
COC(=O)c1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1F	ZINC000872412966	GG	On-Demand	Anodyne	PRTN3	53	33
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	EGFR	20	50
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	DRD3	17	48
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	CASR	45	40
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	SIGMAR1	20	46
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	BCHE	17	46
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	CHRNA7	18	44
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	HNMT	70	37
c1ccc(-c2cc(NCCCCN3CCOCC3)ncn2)cc1	ZINC000872412969	DF	On-Demand	Anodyne	EPHX2	17	41
COCCc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872412978	FH	On-Demand	Anodyne	KCNA5	24	40
COCCc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872412978	FH	On-Demand	Anodyne	PRTN3	43	30
COCCc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872412978	FH	On-Demand	Anodyne	FFAR4	22	40
CCNC(=O)COc1ccc(CNc2ccnc3ncccc23)cc1OC	ZINC000872413000	FF	On-Demand	Anodyne	PDE5A	31	42
CCNC(=O)COc1ccc(CNc2ccnc3ncccc23)cc1OC	ZINC000872413000	FF	On-Demand	Anodyne	PDE6A	45	36
CCNC(=O)COc1ccc(CNc2ccnc3ncccc23)cc1OC	ZINC000872413000	FF	On-Demand	Anodyne	MT-ND1	18	40
CCNC(=O)COc1ccc(CNc2ccnc3ncccc23)cc1OC	ZINC000872413000	FF	On-Demand	Anodyne	DRTS_TRYCR	46	32
CCNC(=O)COc1ccc(CNc2ccnc3ncccc23)cc1OC	ZINC000872413000	FF	On-Demand	Anodyne	SUCNR1	65	41
COCC(=O)NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872413018	FF	On-Demand	Anodyne	GRM5	16	43
COCC(=O)NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872413018	FF	On-Demand	Anodyne	MCHR1	20	47
O=C(CC1CCN(c2nc(Cl)nc3sccc23)CC1)N1CCCC1	ZINC000872413021	FH	On-Demand	Anodyne	PREP	18	40
C=CCNC(=O)c1cccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413023	GG	On-Demand	Mild	DRD4	43	33
COCCS(=O)(=O)Nc1cc(C(=O)OC)c2ccccc2c1	ZINC000872413027	DE	On-Demand	Anodyne	PTPRB	42	33
NC(=O)c1cc(NCCCCN2CCOCC2)nc(Cl)n1	ZINC000872413034	DC	On-Demand	Anodyne	STAT6	53	33
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	CA2	18	43
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	CA1	23	41
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	KCNA5	24	44
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	MTNR1A	46	51
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	MTNR1B	46	51
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	PRTN3	52	33
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	CA12	19	42
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	CA9	21	42
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413040	FH	On-Demand	Anodyne	IDO1	29	41
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCCC2)CC1	ZINC000872413048	DE	On-Demand	Anodyne	SIRT3	64	38
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCCC2)CC1	ZINC000872413048	DE	On-Demand	Anodyne	SIRT2	53	37
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCCC2)CC1	ZINC000872413048	DE	On-Demand	Anodyne	SIRT1	51	33
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	GRIN2B	34	50
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	C3AR1	49	47
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	MLNR	36	46
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	FAAH	17	43
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	EPHX2	15	40
Cc1c(F)ncnc1NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000872413055	EF	On-Demand	Anodyne	CCR8	51	35
c1cnc2nccc(NCCCCN3CCOCC3)c2c1	ZINC000872413057	CE	On-Demand	Anodyne	HRP1_PLAFA	94	41
c1cnc2nccc(NCCCCN3CCOCC3)c2c1	ZINC000872413057	CE	On-Demand	Anodyne	BCHE	15	47
c1cnc2nccc(NCCCCN3CCOCC3)c2c1	ZINC000872413057	CE	On-Demand	Anodyne	HNMT	117	57
c1cnc2nccc(NCCCCN3CCOCC3)c2c1	ZINC000872413057	CE	On-Demand	Anodyne	HPGDS	22	41
O=S(=O)(Nc1cccc2c1OCCCO2)c1ccc2c(c1)OCO2	ZINC000872413066	EE	On-Demand	Anodyne	PKM	36	43
CC(C)(C#N)c1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413079	FG	On-Demand	Mild	PRTN3	52	33
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872413180	DD	On-Demand	Anodyne	AKT2	25	41
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872413180	DD	On-Demand	Anodyne	AKT3	37	41
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872413180	DD	On-Demand	Anodyne	AKT1	36	41
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000872413180	DD	On-Demand	Anodyne	LIMK2	16	46
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	HTR1A	15	42
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	RPS6KB1	45	35
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	SIRT3	81	37
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	SIRT2	65	37
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	SIRT1	55	35
Cc1c(F)ncnc1N1CCC(C(=O)NCCCN2CCCC2)CC1	ZINC000872413221	ED	On-Demand	Anodyne	TBK1	61	34
Cc1ccc(CNC(=O)C2CCN(c3nc(N)nc(C(F)F)n3)CC2)cc1F	ZINC000872413226	GE	On-Demand	Anodyne	EPHX2	18	47
COc1ccc(O)c(S(=O)(=O)Nc2cccc3c2OCCCO3)c1	ZINC000872413233	FE	On-Demand	Anodyne	PRTN3	51	32
CCOc1ccncc1S(=O)(=O)Nc1cc(OC)ccc1C1CC1	ZINC000872413246	EG	On-Demand	Anodyne	ALPL	19	43
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	HTR1A	20	45
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	DRD2	23	43
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	DRD3	45	44
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	HTR4	22	40
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	HRP1_PLAFA	34	46
O=C(NCCCN1CCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872413255	FD	On-Demand	Anodyne	TBK1	52	34
Cn1ncc2c(N3CCN(c4cccc([N+](=O)[O-])c4)CC3)nc(Cl)nc21	ZINC000872413258	FE	On-Demand	Bother	MET	15	40
Cc1c(F)ncnc1NC1CCN(c2ccccn2)CC1	ZINC000872413275	CE	On-Demand	Anodyne	EBP	26	43
O=C(CC1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCCC1	ZINC000872413319	FG	On-Demand	Anodyne	P2RY12	41	41
O=C(CC1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCCC1	ZINC000872413319	FG	On-Demand	Anodyne	CPT1A	71	37
O=C(CCc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872413320	FH	On-Demand	Anodyne	GRIN2B	42	55
O=C(CCc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872413320	FH	On-Demand	Anodyne	C3AR1	49	48
O=C(CCc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872413320	FH	On-Demand	Anodyne	CES1	47	38
O=C(CCc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872413320	FH	On-Demand	Anodyne	CCR8	59	41
O=C(CCc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872413320	FH	On-Demand	Anodyne	SCD	20	42
Cc1c(F)ncnc1NCCCCN1CCOCC1	ZINC000872413350	CD	On-Demand	Anodyne	EGFR	22	45
Cc1c(F)ncnc1NCCCCN1CCOCC1	ZINC000872413350	CD	On-Demand	Anodyne	HNMT	42	37
COC(=O)c1ccoc1S(=O)(=O)Nc1cc(OC)ccc1C1CC1	ZINC000872413362	FF	On-Demand	Anodyne	AKR1C2	40	35
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	HTR1A	27	46
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	DRD2	24	44
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	ADRA1D	22	42
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	ADRA1A	23	42
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	DRD3	44	46
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	PRKD1	22	44
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	IKBKE	18	42
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	MARK3	24	42
O=C(NCCCN1CCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872413413	FF	On-Demand	Anodyne	TBK1	77	43
NC(=O)c1cc(NC2CCN(c3ccccn3)CC2)nc(Cl)n1	ZINC000872413432	ED	On-Demand	Anodyne	PRKD1	73	41
NC(=O)c1cc(NC2CCN(c3ccccn3)CC2)nc(Cl)n1	ZINC000872413432	ED	On-Demand	Anodyne	SCD1	15	41
C[C@@H](Nc1cc(Cl)nnc1O)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872413447	EG	On-Demand	Anodyne	EPHX2	43	41
COc1cncc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413452	EF	On-Demand	Anodyne	CYP11B2	24	41
COc1ccc(OC)c2sc(N3CCC(CC(=O)N4CCCC4)CC3)nc12	ZINC000872413484	GH	On-Demand	Anodyne	ADORA2B	15	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413514	GG	On-Demand	Anodyne	AKR1C3	15	40
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413514	GG	On-Demand	Anodyne	LIMK2	25	45
Nc1nc(NC2CCN(C(=O)CCc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872413515	GE	On-Demand	Anodyne	GRIN2B	30	48
Nc1nc(NC2CCN(C(=O)CCc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872413515	GE	On-Demand	Anodyne	C3AR1	44	44
Oc1nnc(Cl)cc1NCCCCN1CCOCC1	ZINC000872413518	CD	On-Demand	Anodyne	HRP1_PLAFA	80	36
Oc1nnc(Cl)cc1NCCCCN1CCOCC1	ZINC000872413518	CD	On-Demand	Anodyne	HNMT	56	41
COCC(=O)NC1CCN(c2ncnc(F)c2C)CC1	ZINC000872413547	CC	On-Demand	Anodyne	SIRT3	54	35
COCC(=O)NC1CCN(c2ncnc(F)c2C)CC1	ZINC000872413547	CC	On-Demand	Anodyne	SIRT2	45	32
COCC(=O)NC1CCN(c2ncnc(F)c2C)CC1	ZINC000872413547	CC	On-Demand	Anodyne	SIRT1	41	32
COc1cccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413549	EG	On-Demand	Anodyne	HTR6	22	44
COc1cccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)c1	ZINC000872413549	EG	On-Demand	Anodyne	FFAR4	24	40
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(OC)ccc1C1CC1	ZINC000872413555	FF	On-Demand	Anodyne	RELA	15	40
CCNC(=O)COc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872413564	EE	On-Demand	Anodyne	PDE5A	35	45
CCNC(=O)COc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872413564	EE	On-Demand	Anodyne	PDE6A	54	42
CCNC(=O)COc1ccc(CNc2ncnc(F)c2C)cc1OC	ZINC000872413564	EE	On-Demand	Anodyne	DRTS_TRYCR	47	34
COCC(=O)NC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872413577	ED	On-Demand	Anodyne	P2RY12	88	36
COCC(=O)NC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872413577	ED	On-Demand	Anodyne	MCHR1	20	42
CCNC(=O)COc1ccc(CNc2cc(C)nc3c2cnn3C)cc1OC	ZINC000872413580	GE	On-Demand	Anodyne	DRTS_TRYCR	45	32
c1cnc2nccc(NCc3ccc(N4CCCCC4)nc3)c2c1	ZINC000872413595	DH	On-Demand	Anodyne	HNMT	58	39
O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872413622	FF	On-Demand	Anodyne	GRIN2B	36	48
O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872413622	FF	On-Demand	Anodyne	SIGMAR1	15	41
O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872413622	FF	On-Demand	Anodyne	C3AR1	44	43
O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872413622	FF	On-Demand	Anodyne	MLNR	23	42
O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872413622	FF	On-Demand	Anodyne	CCR8	45	35
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	DRD2	28	41
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	ADRA1D	26	44
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	ADRA1A	29	44
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	HTR4	40	35
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	HRP1_PLAFA	106	46
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	HRH3	17	50
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	HNMT	102	50
COC(=O)C1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872413655	EE	On-Demand	Anodyne	PTR1	46	34
CC(C)(C)C(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872413666	EH	On-Demand	Anodyne	PRKD1	54	33
CC(C)(C)C(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872413666	EH	On-Demand	Anodyne	SFRP1	50	33
COC(=O)c1sccc1S(=O)(=O)Nc1cccc2c1OCCCO2	ZINC000872413674	FE	On-Demand	Anodyne	EDNRA	19	47
Cc1c(F)ncnc1NC[C@@H](O)COc1cccc(F)c1	ZINC000872413691	CD	On-Demand	Anodyne	ADRB2	25	45
Cc1c(F)ncnc1NC[C@@H](O)COc1cccc(F)c1	ZINC000872413691	CD	On-Demand	Anodyne	ADRB1	17	45
Cc1c(F)ncnc1NC[C@H](O)COc1cccc(F)c1	ZINC000872413693	CD	On-Demand	Anodyne	ADRB2	25	45
Cc1c(F)ncnc1NC[C@H](O)COc1cccc(F)c1	ZINC000872413693	CD	On-Demand	Anodyne	ADRB1	17	45
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413694	GF	On-Demand	Anodyne	CA2	17	45
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413694	GF	On-Demand	Anodyne	CA1	20	40
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413694	GF	On-Demand	Anodyne	CA4	18	40
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413694	GF	On-Demand	Anodyne	PRTN3	53	34
COC(=O)[C@@H](CS(=O)(=O)Nc1cc(OC)ccc1C1CC1)c1ccccc1	ZINC000872413748	GG	On-Demand	Anodyne	MTNR1B	30	40
Oc1nnc(Cl)cc1NCCN1CCCCC1	ZINC000872413776	CD	On-Demand	Anodyne	HNMT	79	45
Cn1ncc2c(NCCCCN3CCOCC3)nc(Cl)nc21	ZINC000872413809	DD	On-Demand	Anodyne	SRC	15	40
Cc1ccc(CNC(=O)C2CCN(c3ccnc4ncccc34)CC2)cc1F	ZINC000872413826	GH	On-Demand	Anodyne	EPHX2	23	42
Cc1ccc(CNC(=O)C2CCN(c3cc(Cl)nnc3O)CC2)cc1F	ZINC000872413835	GF	On-Demand	Anodyne	EPHX2	21	46
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872413842	GE	On-Demand	Anodyne	PRTN3	52	33
C[C@H]1CCCC(=NNc2nc3ccncc3s2)C1	ZINC000872413844	CH	On-Demand	Mild	MAOB	20	48
COc1ccc(OCCS(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872413905	GE	On-Demand	Anodyne	FFAR4	21	43
Cc1c(F)ncnc1N1CCC(C(=O)NCCCOC(C)C)CC1	ZINC000872413916	EE	On-Demand	Anodyne	SIRT3	42	34
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000872413917	EF	On-Demand	Anodyne	MLNR	25	40
Cc1c(F)ncnc1NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000872413917	EF	On-Demand	Anodyne	CCR8	46	31
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	ABCC1	46	34
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	EPHX2	21	43
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	SIRT3	61	35
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	SIRT2	52	32
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	SIRT1	51	32
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872413918	FF	On-Demand	Anodyne	LIMK2	35	43
COCCc1ccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872413928	GE	On-Demand	Anodyne	FFAR4	32	47
COCCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413954	GG	On-Demand	Anodyne	KCNA5	15	41
COCCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413954	GG	On-Demand	Anodyne	MMP13	48	39
COCCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413954	GG	On-Demand	Anodyne	PRTN3	53	32
COCCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872413954	GG	On-Demand	Anodyne	FFAR4	19	40
COCCOc1ccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872413987	GE	On-Demand	Anodyne	ALPL	17	49
COCCOc1ccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872413987	GE	On-Demand	Anodyne	FFAR4	33	45
O=C(CCCNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872414000	CF	On-Demand	Anodyne	FAAH	15	45
O=C(CCCNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872414000	CF	On-Demand	Anodyne	TNKS	64	36
O=C(CCCNc1cc(-c2ccccc2)ncn1)NC1CC1	ZINC000872414000	CF	On-Demand	Anodyne	VCP	47	35
COC(=O)C1CCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872414006	ED	On-Demand	Anodyne	HTR4	58	39
COC(=O)C1CCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872414006	ED	On-Demand	Anodyne	HRP1_PLAFA	85	41
COC(=O)C1CCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872414006	ED	On-Demand	Anodyne	HNMT	44	37
COC(=O)C1CCN(CCCNc2cc(C)nc3c2cnn3C)CC1	ZINC000872414022	ED	On-Demand	Anodyne	HRP1_PLAFA	42	35
COC(=O)C1CCN(CCCNc2cc(C)nc3c2cnn3C)CC1	ZINC000872414022	ED	On-Demand	Anodyne	HNMT	41	31
NC(=O)c1cc(NCCN2CCCCC2)nc(Cl)n1	ZINC000872414050	CD	On-Demand	Anodyne	HNMT	47	34
O=C1CCCc2cc(S(=O)(=O)Nc3cccc4c3OCCCO4)ccc2N1	ZINC000872414062	GF	On-Demand	Anodyne	PKM	36	49
CN1CCN(C(=O)c2ccc(CNc3ccnc4ncccc34)cc2)CC1	ZINC000872414107	FF	On-Demand	Anodyne	HNMT	43	32
O=C(NCC1CC1)[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872414116	DE	On-Demand	Anodyne	GPBAR1	21	47
O=C(NCC1CC1)[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872414117	DE	On-Demand	Anodyne	GPBAR1	21	47
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414118	GE	On-Demand	Anodyne	NPY2R	81	40
O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414125	GF	On-Demand	Anodyne	NPY2R	37	43
O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414125	GF	On-Demand	Anodyne	CACNA1B	40	33
O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414125	GF	On-Demand	Anodyne	RBP4	16	47
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	DYRK1A	39	40
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	CLK1	54	40
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	CLK2	43	40
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	CLK4	67	40
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	DYRK2	45	35
Cc1c(F)ncnc1NCCOc1ccc2c(c1)OCO2	ZINC000872414133	CE	On-Demand	Anodyne	DYRK1B	31	40
NC(=O)NC[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414151	DE	On-Demand	Anodyne	DPP4	15	45
NC(=O)NC[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414151	DE	On-Demand	Anodyne	VCP	49	37
NC(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414152	DE	On-Demand	Anodyne	DPP4	15	45
NC(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414152	DE	On-Demand	Anodyne	VCP	49	37
C[C@@H]1CCCCN1Cc1ccc(Nc2cc(Cl)nnc2O)cc1	ZINC000872414153	EH	On-Demand	Anodyne	HRH3	34	44
C[C@H]1CCCCN1Cc1ccc(Nc2cc(Cl)nnc2O)cc1	ZINC000872414154	EH	On-Demand	Anodyne	HRH3	34	44
CC(C)c1ccc(OCCNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872414159	DG	On-Demand	Anodyne	HTR7	16	60
CC(C)(C)OC(=O)N1CCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872414187	FE	On-Demand	Anodyne	HRP1_PLAFA	87	43
CCCOc1ccc(CNc2nc(Cl)nc3c2cnn3C)cc1	ZINC000872414189	EG	On-Demand	Anodyne	ABL1	16	40
COc1ccc(OC)c2sc(NCCC(=O)N(C)C)nc12	ZINC000872414193	DE	On-Demand	Anodyne	ADORA2B	18	43
O=C(NC1CC1)c1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872414196	DE	On-Demand	Anodyne	PLG	15	43
O=C(NC1CC1)c1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872414196	DE	On-Demand	Anodyne	MAPK13	40	34
O=C(NC1CC1)c1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872414196	DE	On-Demand	Anodyne	ST14	17	43
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000872414197	FE	On-Demand	Anodyne	NAMPT	42	43
O=C(c1ccccc1F)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872414217	FG	On-Demand	Anodyne	MLNR	18	43
O=C(c1ccccc1F)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872414217	FG	On-Demand	Anodyne	CCR8	46	31
CN1CCN(C(=O)c2ccc(CN=c3cc[nH]cc3C3CC3)cc2)CC1	ZINC000872414228	FE	On-Demand	Anodyne	HTR1F	70	36
CN1CCN(C(=O)c2ccc(CN=c3cc[nH]cc3C3CC3)cc2)CC1	ZINC000872414228	FE	On-Demand	Anodyne	L3MBTL3	50	40
CCOc1cccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)c1	ZINC000872414233	FF	On-Demand	Anodyne	ALPL	20	49
CCOc1cccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)c1	ZINC000872414233	FF	On-Demand	Anodyne	MTNN	59	35
COCCOc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872414238	GF	On-Demand	Anodyne	PRTN3	61	37
C[C@H]1CCCC1=NNc1nc2ccncc2s1	ZINC000872414251	BG	On-Demand	Mild	MAOB	18	49
CC(C)(C)C(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872414258	DG	On-Demand	Anodyne	MAPK8	18	41
CC(C)(C)C(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872414258	DG	On-Demand	Anodyne	CCR8	63	36
COc1ccc(OC)c2sc(NCCCC(=O)NC3CC3)nc12	ZINC000872414285	EF	On-Demand	Anodyne	ADORA2B	18	43
CC(C)(C)C(=O)N1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872414302	FH	On-Demand	Anodyne	SFRP1	87	35
CC(C)(C)C(=O)N1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872414302	FH	On-Demand	Anodyne	WNT3	63	35
O=C(Nc1ccc(F)cc1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414324	FF	On-Demand	Anodyne	CCR3	36	40
O=C(Nc1ccc(F)cc1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414324	FF	On-Demand	Anodyne	EPHX2	53	49
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)N1CCc2ccccc21	ZINC000872414326	FD	On-Demand	Anodyne	DRD2	21	58
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)N1CCc2ccccc21	ZINC000872414326	FD	On-Demand	Anodyne	DRD4	37	58
NC(=O)C1CCN(C(=O)C2CCN(c3cc(-c4ccccc4)ncn3)CC2)CC1	ZINC000872414327	GE	On-Demand	Anodyne	P2RY12	40	41
NC(=O)C1CCN(C(=O)C2CCN(c3cc(-c4ccccc4)ncn3)CC2)CC1	ZINC000872414327	GE	On-Demand	Anodyne	LUCI_LUCLA	16	41
NC(=O)C1CCN(C(=O)C2CCN(c3cc(-c4ccccc4)ncn3)CC2)CC1	ZINC000872414327	GE	On-Demand	Anodyne	VCP	43	35
CCOC(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414332	EF	On-Demand	Anodyne	P2RY12	131	40
CCOC(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414332	EF	On-Demand	Anodyne	FAAH	32	45
CCOC(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414333	EF	On-Demand	Anodyne	P2RY12	131	40
CCOC(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414333	EF	On-Demand	Anodyne	FAAH	32	45
O=C(Cc1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414338	FE	On-Demand	Anodyne	MC4R	67	40
Nc1nc(C(F)F)nc(N2CCN(CC(=O)N3CCc4ccccc43)CC2)n1	ZINC000872414340	GD	On-Demand	Anodyne	DRD4	17	52
Nc1nc(C(F)F)nc(N2CCN(CC(=O)N3CCc4ccccc43)CC2)n1	ZINC000872414340	GD	On-Demand	Anodyne	EIF2AK3	54	31
CC[C@H](C)NC(=O)c1cccc(CNc2ccnc3ncccc23)c1	ZINC000872414358	EH	On-Demand	Anodyne	SUCNR1	40	34
CCCCN1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872414365	CF	On-Demand	Anodyne	HTR4	47	42
Cc1c(F)ncnc1NCc1cccc(OCC(F)(F)F)c1	ZINC000872414385	DG	On-Demand	Anodyne	CLK4	17	45
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872414389	EE	On-Demand	Anodyne	AKT2	62	39
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872414389	EE	On-Demand	Anodyne	AKT3	75	44
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872414389	EE	On-Demand	Anodyne	ABCC1	73	36
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	ZINC000872414389	EE	On-Demand	Anodyne	AKT1	60	48
CCOc1ccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872414390	FF	On-Demand	Anodyne	ALPL	26	67
CCOc1ccc(S(=O)(=O)Nc2cc(C)cc(S(C)(=O)=O)c2)cc1	ZINC000872414390	FF	On-Demand	Anodyne	FFAR4	34	45
O=C(NCC1CC1)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414394	EF	On-Demand	Anodyne	SLC6A1	84	35
O=C(NCC1CC1)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414394	EF	On-Demand	Anodyne	P2RY12	40	34
O=C(NCC1CC1)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414394	EF	On-Demand	Anodyne	GPBAR1	22	45
O=C(NCC1CC1)[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414394	EF	On-Demand	Anodyne	VCP	63	42
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414396	EF	On-Demand	Anodyne	SLC6A1	84	35
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414396	EF	On-Demand	Anodyne	P2RY12	40	34
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414396	EF	On-Demand	Anodyne	GPBAR1	22	45
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872414396	EF	On-Demand	Anodyne	VCP	63	42
COc1ccc(OC)c2sc(N3CCC(CC(N)=O)CC3)nc12	ZINC000872414414	EE	On-Demand	Anodyne	SIRT3	59	33
COc1ccc(OC)c2sc(N3CCC(CC(N)=O)CC3)nc12	ZINC000872414414	EE	On-Demand	Anodyne	SIRT2	50	32
COc1ccc(OC)c2sc(N3CCC(CC(N)=O)CC3)nc12	ZINC000872414414	EE	On-Demand	Anodyne	SIRT1	49	30
C[C@@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414418	CF	On-Demand	Anodyne	HRP1_PLAFA	59	34
C[C@@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414418	CF	On-Demand	Anodyne	HRH3	44	43
C[C@@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414418	CF	On-Demand	Anodyne	HNMT	72	46
C[C@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414421	CF	On-Demand	Anodyne	HRP1_PLAFA	59	34
C[C@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414421	CF	On-Demand	Anodyne	HRH3	44	43
C[C@H]1CCCCN1CCNc1ccnc2ncccc12	ZINC000872414421	CF	On-Demand	Anodyne	HNMT	72	46
O=S(=O)(Nc1cccc2c1OCCCO2)c1ccc2c(c1)OCCO2	ZINC000872414437	FE	On-Demand	Anodyne	PKM	40	44
COc1cccc(OC)c1S(=O)(=O)Nc1cc(C)cc(S(C)(=O)=O)c1	ZINC000872414448	GE	On-Demand	Anodyne	ALPL	27	40
CCOc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872414457	EG	On-Demand	Anodyne	PRTN3	59	38
O=C(CCCNc1cc(Cl)nnc1O)NC1CC1	ZINC000872414484	CD	On-Demand	Anodyne	TNKS	46	32
COCCn1cc(C=NNC(=O)COc2ccccc2Br)cn1	ZINC000872414527	GD	On-Demand	Reactive	PDE10A	19	40
NC(=O)c1cc(N2CCC(CN3CCCC3)CC2)nc(Cl)n1	ZINC000872414538	DD	On-Demand	Anodyne	SIRT3	23	47
NC(=O)c1cc(N2CCC(CN3CCCC3)CC2)nc(Cl)n1	ZINC000872414538	DD	On-Demand	Anodyne	SIRT2	17	47
O=S(=O)(Nc1cccc2c1OCCCO2)c1ccc2c(c1)OCCCO2	ZINC000872414555	GF	On-Demand	Anodyne	PKM	38	45
Cn1ncc2c(NCCN3CCCCC3)nc(Cl)nc21	ZINC000872414580	CD	On-Demand	Anodyne	HNMT	55	36
COCC(=O)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872414581	EE	On-Demand	Anodyne	GRM5	21	48
COCCCC(C)=NNC(=O)COc1ccccc1Br	ZINC000872414583	EF	On-Demand	Reactive	ABAT	18	40
CC(=NNc1nc2ccncc2s1)c1ccc(OCC(=O)N2CCCC2)cc1	ZINC000872414605	GH	On-Demand	Mild	CPT1A	43	34
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	ZINC000872414619	GD	On-Demand	Anodyne	TNK2	60	45
COCCc1ccc(S(=O)(=O)Nc2cccc3c2OCCCO3)cc1	ZINC000872414620	FF	On-Demand	Anodyne	PRTN3	52	31
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	ZINC000872414621	GD	On-Demand	Anodyne	TNK2	60	45
CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872414644	CG	On-Demand	Anodyne	PPO2	21	41
C[C@H]1CCCCC1=NNc1nc2ccncc2s1	ZINC000872414656	CH	On-Demand	Mild	MAOB	19	49
CCCNC(=O)c1cccc(CNc2ncnc(F)c2C)c1	ZINC000872414672	DF	On-Demand	Anodyne	MAPK14	15	43
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	P2RY12	22	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	TRPV1	15	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	NPY2R	22	48
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	CACNA1B	46	39
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	CCR2	52	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	RBP4	15	46
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	SMO	21	40
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000872414674	FF	On-Demand	Anodyne	HPGD	40	46
COC(=O)C1CCN(CCCNc2ncnc(F)c2C)CC1	ZINC000872414676	DD	On-Demand	Anodyne	ADRA1D	26	40
COC(=O)C1CCN(CCCNc2ncnc(F)c2C)CC1	ZINC000872414676	DD	On-Demand	Anodyne	ADRA1A	32	40
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872414679	CD	On-Demand	Anodyne	PDE8B	16	41
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872414679	CD	On-Demand	Anodyne	SIRT3	47	37
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872414679	CD	On-Demand	Anodyne	GPBAR1	21	43
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872414680	CD	On-Demand	Anodyne	PDE8B	16	41
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872414680	CD	On-Demand	Anodyne	SIRT3	47	37
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872414680	CD	On-Demand	Anodyne	GPBAR1	21	43
O=C(NCC1CC1)[C@@H]1CCCN(c2nc(Cl)nc3sccc23)C1	ZINC000872414681	FG	On-Demand	Anodyne	GPBAR1	22	41
Cn1ncc2c1CCCC2=NNc1nc2ccncc2s1	ZINC000872414702	CF	On-Demand	Mild	BCL2L1	15	40
Nc1nc(NCCN2CCCCC2)nc(C(F)F)n1	ZINC000872414712	CD	On-Demand	Anodyne	HNMT	50	36
O=C(NCC1CC1)[C@H]1CCCN(c2nc(Cl)nc3sccc23)C1	ZINC000872414729	FG	On-Demand	Anodyne	GPBAR1	22	41
O=C(NCC1CC1)[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414733	DD	On-Demand	Anodyne	CACNA1I	51	35
O=C(NCC1CC1)[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414733	DD	On-Demand	Anodyne	SIRT3	42	36
O=C(NCC1CC1)[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414733	DD	On-Demand	Anodyne	GPBAR1	20	42
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414734	DD	On-Demand	Anodyne	CACNA1I	51	35
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414734	DD	On-Demand	Anodyne	SIRT3	42	36
O=C(NCC1CC1)[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872414734	DD	On-Demand	Anodyne	GPBAR1	20	42
Cc1c(F)ncnc1N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000872414741	FD	On-Demand	Anodyne	DRD4	26	51
Cc1c(F)ncnc1N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000872414741	FD	On-Demand	Anodyne	EIF2AK3	70	35
O=C(c1cc(F)ccc1F)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872414782	FI	On-Demand	Anodyne	SLC18A3	16	41
COc1ccc(OC)c2sc(NCC(C)(C)C(N)=O)nc12	ZINC000872414792	DE	On-Demand	Anodyne	ADORA2B	18	44
COc1ccc(OC)c2sc(NCC(C)(C)C(N)=O)nc12	ZINC000872414792	DE	On-Demand	Anodyne	DRTS_TRYCR	43	30
COCC(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872414806	CC	On-Demand	Anodyne	PDGFRB	47	35
O=C(c1cccc(Cl)c1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872414812	GG	On-Demand	Anodyne	P2RX7	54	48
Oc1nnc(Cl)cc1N1CCC(CN2CCCC2)CC1	ZINC000872414824	CE	On-Demand	Anodyne	SIRT3	19	46
CCC(=O)c1c(Cl)cccc1NCc1ccc(OCC(N)=O)c(OC)c1	ZINC000872414842	GG	On-Demand	Anodyne	PDE5A	38	41
CCC(=O)c1c(Cl)cccc1NCc1ccc(OCC(N)=O)c(OC)c1	ZINC000872414842	GG	On-Demand	Anodyne	PDE6A	47	38
CCC(=O)c1c(Cl)cccc1NCc1ccc(OCC(N)=O)c(OC)c1	ZINC000872414842	GG	On-Demand	Anodyne	DRTS_TRYCR	49	33
CC[C@@H](C)C(=O)Nc1cccc(CNc2ccnc3ncccc23)c1	ZINC000872414845	EI	On-Demand	Anodyne	SUCNR1	43	36
Cn1ncc2c(N3CCC[C@@H](C(=O)NCC4CC4)C3)nc(Cl)nc21	ZINC000872414880	ED	On-Demand	Anodyne	CACNA1I	46	34
Cn1ncc2c(N3CCC[C@H](C(=O)NCC4CC4)C3)nc(Cl)nc21	ZINC000872414881	ED	On-Demand	Anodyne	CACNA1I	46	34
Cn1ncc2c(NCc3cccc(C(=O)NC4CC4)c3)nc(Cl)nc21	ZINC000872414888	FF	On-Demand	Anodyne	MAPK14	45	43
Cn1ncc2c(NCc3cccc(C(=O)NC4CC4)c3)nc(Cl)nc21	ZINC000872414888	FF	On-Demand	Anodyne	MAPK13	34	40
Cn1ncc2c(NCc3cccc(C(=O)NC4CC4)c3)nc(Cl)nc21	ZINC000872414888	FF	On-Demand	Anodyne	ADORA3	48	38
C[C@@H](Nc1cc(Cl)nnc1O)c1ccc2c(c1)CCC(=O)N2	ZINC000872414897	DF	On-Demand	Anodyne	GRIN2B	15	44
NC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872414924	CE	On-Demand	Anodyne	SIRT3	61	34
NC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872414924	CE	On-Demand	Anodyne	SIRT2	52	33
NC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872414924	CE	On-Demand	Anodyne	SIRT1	51	32
CCCOc1ccc(CNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872414925	DF	On-Demand	Anodyne	PLA2G4B	53	33
CCCOc1ccc(CNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872414925	DF	On-Demand	Anodyne	PROKR1	33	42
COCC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872414927	CC	On-Demand	Anodyne	HTR1B	16	45
COCC(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872414927	CC	On-Demand	Anodyne	PDGFRB	17	40
O=C(NCC1CC1)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414940	CF	On-Demand	Anodyne	TBK1	51	34
O=C(NCC1CC1)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414940	CF	On-Demand	Anodyne	GPBAR1	21	43
O=C(NCC1CC1)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414941	CF	On-Demand	Anodyne	TBK1	51	34
O=C(NCC1CC1)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414941	CF	On-Demand	Anodyne	GPBAR1	21	43
O=S(=O)(c1ccc(CNc2ccnc3ncccc23)cc1)N1CCCC1	ZINC000872414944	FG	On-Demand	Anodyne	NAMPT	74	52
Nc1nc(C(F)F)nc(N2CCC[C@@H](C(=O)NCC3CC3)C2)n1	ZINC000872414945	ED	On-Demand	Anodyne	GPBAR1	20	41
Nc1nc(C(F)F)nc(N2CCC[C@H](C(=O)NCC3CC3)C2)n1	ZINC000872414946	ED	On-Demand	Anodyne	GPBAR1	20	41
CCCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872414948	DD	On-Demand	Anodyne	HTR4	61	43
CCCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872414948	DD	On-Demand	Anodyne	HTR1F	21	40
CCCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872414948	DD	On-Demand	Anodyne	SSTR5	40	35
CCOC(=O)N[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414960	CF	On-Demand	Anodyne	PIM3	15	43
CCOC(=O)N[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872414961	CF	On-Demand	Anodyne	PIM3	15	43
Cc1c(F)ncnc1NCc1cccc(C(=O)NC2CC2)c1	ZINC000872414979	DE	On-Demand	Anodyne	MAPK11	38	41
Cc1c(F)ncnc1NCc1cccc(C(=O)NC2CC2)c1	ZINC000872414979	DE	On-Demand	Anodyne	MAPK14	61	42
Cc1c(F)ncnc1NCc1cccc(C(=O)NC2CC2)c1	ZINC000872414979	DE	On-Demand	Anodyne	MAPK13	93	35
NC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872414980	CD	On-Demand	Anodyne	SIRT3	57	39
NC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872414980	CD	On-Demand	Anodyne	SIRT2	52	39
NC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872414980	CD	On-Demand	Anodyne	SIRT1	51	32
NC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872414988	EF	On-Demand	Anodyne	SIRT3	60	34
NC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872414988	EF	On-Demand	Anodyne	SIRT2	51	32
NC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872414988	EF	On-Demand	Anodyne	SIRT1	51	32
Cc1cc(N2CCC[C@H](C(=O)NCC3CC3)C2)c2cnn(C)c2n1	ZINC000872414990	EE	On-Demand	Anodyne	GPBAR1	21	41
NC(=O)c1cc(N2CCC(C(=O)c3cc(F)ccc3F)CC2)nc(Cl)n1	ZINC000872414996	GF	On-Demand	Anodyne	SCD1	26	45
CCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872415002	EH	On-Demand	Anodyne	KCNA5	15	40
CCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872415002	EH	On-Demand	Anodyne	PRTN3	50	32
CCOc1ccc(S(=O)(=O)Nc2cc(OC)ccc2C2CC2)cc1	ZINC000872415002	EH	On-Demand	Anodyne	FFAR4	28	42
Cc1c(F)ncnc1N1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000872415014	FE	On-Demand	Anodyne	NPY2R	40	37
Cc1c(F)ncnc1N1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000872415014	FE	On-Demand	Anodyne	LIMK2	57	36
Cc1c(F)ncnc1N1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000872415015	FE	On-Demand	Anodyne	NPY2R	40	37
Cc1c(F)ncnc1N1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000872415015	FE	On-Demand	Anodyne	LIMK2	57	36
O=S(=O)(c1ccc(CNc2cc(Cl)nnc2O)cc1)N1CCCC1	ZINC000872415020	FE	On-Demand	Anodyne	NAMPT	46	44
c1cnc2nccc(NCc3ccnc(N4CCCCC4)c3)c2c1	ZINC000872415036	DH	On-Demand	Anodyne	HNMT	60	39
CCC(=O)Nc1cccc(CNc2cc(C)nc3c2cnn3C)c1	ZINC000872415038	DG	On-Demand	Anodyne	HTR1D	23	44
CCC(=O)Nc1cccc(CNc2cc(C)nc3c2cnn3C)c1	ZINC000872415038	DG	On-Demand	Anodyne	HTR1B	19	44
CCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872415039	CF	On-Demand	Anodyne	EGFR	25	45
CCC(=O)Nc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872415039	CF	On-Demand	Anodyne	KCNK3	40	35
COc1cccc(OC)c1OC1CCN(c2ccnc3ncccc23)CC1	ZINC000872415047	FH	On-Demand	Anodyne	PDE3A	43	42
COc1cccc(OC)c1OC1CCN(c2ccnc3ncccc23)CC1	ZINC000872415047	FH	On-Demand	Anodyne	PDE3B	49	42
C[C@H]1CC[C@H](C(N)=O)CN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872415050	EF	On-Demand	Anodyne	PDPK1	20	41
C[C@@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872415051	EF	On-Demand	Anodyne	PDPK1	20	41
C[C@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872415052	EF	On-Demand	Anodyne	PDPK1	20	41
C[C@@H](Nc1cc(Cl)nnc1O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000872415072	FF	On-Demand	Anodyne	TNKS	53	35
CCOc1ccccc1C(=O)N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872415078	GD	On-Demand	Anodyne	HCN1	58	36
CCOc1ccccc1C(=O)N1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872415078	GD	On-Demand	Anodyne	HCN4	44	35
C[C@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415082	CE	On-Demand	Anodyne	PDPK1	20	43
C[C@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415082	CE	On-Demand	Anodyne	VCP	45	35
C[C@H]1CC[C@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415083	CE	On-Demand	Anodyne	PDPK1	20	43
C[C@H]1CC[C@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415083	CE	On-Demand	Anodyne	VCP	45	35
C[C@@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415085	CE	On-Demand	Anodyne	PDPK1	20	43
C[C@@H]1CC[C@@H](C(N)=O)CN1c1cc(-c2ccccc2)ncn1	ZINC000872415085	CE	On-Demand	Anodyne	VCP	45	35
CNC(=O)[C@@H]1CCCN1c1cc(-c2cccc(Cl)c2)ncn1	ZINC000872415098	DF	On-Demand	Anodyne	GRM5	19	45
c1ccc(-c2cc(N3CCC[C@H](N4CCCC4)C3)ncn2)cc1	ZINC000872415113	DG	On-Demand	Anodyne	HRH3	16	45
c1ccc(-c2cc(N3CCC[C@@H](N4CCCC4)C3)ncn2)cc1	ZINC000872415114	DG	On-Demand	Anodyne	HRH3	16	45
COc1ccc(OC)c2sc(N3CCC[C@@H](NC(C)=O)C3)nc12	ZINC000872415118	EE	On-Demand	Anodyne	PARE	42	31
COc1ccc(OC)c2sc(N3CCC[C@H](NC(C)=O)C3)nc12	ZINC000872415119	EE	On-Demand	Anodyne	PARE	42	31
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cn2)CC1	ZINC000872415137	GF	On-Demand	Anodyne	LIMK2	25	48
COc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872415163	EH	On-Demand	Anodyne	PDE3A	39	42
COc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872415163	EH	On-Demand	Anodyne	PDE3B	45	42
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)c(F)c1	ZINC000872415171	EE	On-Demand	Clean	MAPK9	31	41
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)c(F)c1	ZINC000872415171	EE	On-Demand	Clean	MAPK10	28	41
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)c(F)c1	ZINC000872415171	EE	On-Demand	Clean	STAT6	51	36
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	DRD4	41	46
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	ACHE	28	44
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	SIGMAR1	35	40
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	SSTR5	80	40
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	AKT2	51	40
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	PRKD1	53	34
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	SCN5A	45	35
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	AKT1	31	42
c1ccc(-c2cc(NC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000872415182	EH	On-Demand	Anodyne	MCHR1	24	44
COc1ccc(OC2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872415191	DF	On-Demand	Anodyne	PDE3A	47	47
COc1ccc(OC2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872415191	DF	On-Demand	Anodyne	DCK	59	51
COc1ccc(OC2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872415191	DF	On-Demand	Anodyne	PDE3B	54	47
COc1cccc(OC)c1OC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872415218	GE	On-Demand	Anodyne	DCK	47	44
COc1cccc(OC)c1OC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872415218	GE	On-Demand	Anodyne	PDE3B	45	38
COc1cccc(OC)c1OC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872415218	GE	On-Demand	Anodyne	SCD1	59	51
COc1cccc(OC)c1OC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872415218	GE	On-Demand	Anodyne	SCD	18	40
c1ccc(-c2cc(NC3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872415227	EH	On-Demand	Anodyne	DRD4	17	50
c1ccc(-c2cc(NC3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872415227	EH	On-Demand	Anodyne	PRKD1	41	34
c1ccc(-c2cc(NC3CCN(Cc4ccccn4)CC3)ncn2)cc1	ZINC000872415227	EH	On-Demand	Anodyne	SCN5A	62	41
Cc1cccc(NC(=O)[C@@H]2CCCN(c3ccncc3C3CC3)C2)n1	ZINC000872415234	EH	On-Demand	Anodyne	GPBAR1	15	42
Cc1c(F)ncnc1NCc1cccc(OCC(=O)N(C)C)c1	ZINC000872415246	DE	On-Demand	Anodyne	PDE6A	43	33
Cc1c(F)ncnc1NCc1cccc(OCC(=O)N(C)C)c1	ZINC000872415246	DE	On-Demand	Anodyne	CLK4	23	43
c1ccc(CN2CCC(Nc3ccnc4ncccc34)CC2)nc1	ZINC000872415257	DG	On-Demand	Anodyne	SCN5A	44	41
Nc1nc(NCCOc2cccc(C(F)(F)F)c2)nc(C(F)F)n1	ZINC000872415267	EF	On-Demand	Anodyne	PDS	43	40
CN(C)S(=O)(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000872415274	FD	On-Demand	Anodyne	ACACB	15	40
CN(C)S(=O)(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000872415275	FD	On-Demand	Anodyne	ACACB	15	40
C[C@@H](Nc1ccnc2ncccc12)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000872415287	FG	On-Demand	Anodyne	TNKS	53	34
O=C(Nc1cc(Cl)ccc1O)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415290	GG	On-Demand	Anodyne	KCNMA1	28	40
c1ccc(-c2cc(N3CCC(N4CCCCC4)CC3)ncn2)cc1	ZINC000872415293	DH	On-Demand	Anodyne	HRH3	33	50
c1ccc(-c2cc(N3CCC(N4CCCCC4)CC3)ncn2)cc1	ZINC000872415293	DH	On-Demand	Anodyne	L3MBTL3	91	43
COc1cccc(OC)c1OC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415296	FF	On-Demand	Anodyne	PDE3A	43	41
COc1cccc(OC)c1OC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415296	FF	On-Demand	Anodyne	PDE3B	49	41
COc1cccc(OC)c1OC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415296	FF	On-Demand	Anodyne	SCD1	50	38
O=C(NCc1ccc(F)cc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415304	FF	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(F)cc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415304	FF	On-Demand	Anodyne	CACNA1G	39	41
Cc1c(F)ncnc1N1CCN(C(=O)N(C)Cc2ccccc2)CC1	ZINC000872415307	EE	On-Demand	Anodyne	AKT1	29	41
CC(CCCCO)=NNC(=O)COc1ccccc1Br	ZINC000872415317	EE	On-Demand	Reactive	ABAT	19	41
O=C(Nc1cc(Cl)ccc1O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415318	GH	On-Demand	Anodyne	TYK2	44	34
CC(C)c1ccc(OC2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872415326	EI	On-Demand	Anodyne	PRSS2	40	31
NC(=O)c1cc(NCc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872415333	FD	On-Demand	Clean	MAPK9	33	42
NC(=O)c1cc(NCc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872415333	FD	On-Demand	Clean	MAPK10	34	42
NC(=O)c1cc(NCc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872415333	FD	On-Demand	Clean	STAT6	61	39
CCOc1cc(CNc2cc(C(N)=O)nc(Cl)n2)ccc1OC(F)F	ZINC000872415335	FF	On-Demand	Anodyne	DRTS_TRYCR	47	34
Nc1nc(C(F)F)nc(N2CCC(N3CCCCC3)CC2)n1	ZINC000872415359	DD	On-Demand	Anodyne	L3MBTL3	40	41
Fc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)c(F)c1	ZINC000872415362	EH	On-Demand	Anodyne	DCK	47	36
Fc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)c(F)c1	ZINC000872415362	EH	On-Demand	Anodyne	SCD1	45	41
Fc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)c(F)c1	ZINC000872415362	EH	On-Demand	Anodyne	SCD	27	43
CC(=O)N[C@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872415371	EF	On-Demand	Anodyne	PDPK1	16	43
CC(=O)N[C@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872415371	EF	On-Demand	Anodyne	GRM5	21	44
CC(=O)N[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872415373	EF	On-Demand	Anodyne	PDPK1	16	43
CC(=O)N[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872415373	EF	On-Demand	Anodyne	GRM5	21	44
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	PDE3A	41	40
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	DCK	60	46
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	PDE3B	47	40
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	SCD1	47	50
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	GPR119	43	39
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415381	DG	On-Demand	Anodyne	SCD	20	50
c1cc(N2CCC(N3CCCCC3)CC2)c(C2CC2)cn1	ZINC000872415396	CG	On-Demand	Anodyne	HRH3	25	51
c1cc(N2CCC(N3CCCCC3)CC2)c(C2CC2)cn1	ZINC000872415396	CG	On-Demand	Anodyne	L3MBTL3	93	46
Cc1c(F)ncnc1NCc1ccc(N2CCOCC2)c(F)c1	ZINC000872415404	DF	On-Demand	Clean	STAT6	45	35
Cn1ncc2c(N3CCC(N4CCCCC4)CC3)nc(Cl)nc21	ZINC000872415406	EE	On-Demand	Anodyne	L3MBTL3	44	37
Cc1c(F)ncnc1NC1CCN(Cc2ccccn2)CC1	ZINC000872415417	DE	On-Demand	Anodyne	SSTR5	48	38
Cc1c(F)ncnc1NC1CCN(Cc2ccccn2)CC1	ZINC000872415417	DE	On-Demand	Anodyne	SCN5A	77	46
NC(=O)c1cc(NC2CCN(Cc3ccncc3)CC2)nc(Cl)n1	ZINC000872415420	ED	On-Demand	Anodyne	SIGMAR1	22	42
NC(=O)c1cc(NC2CCN(Cc3ccncc3)CC2)nc(Cl)n1	ZINC000872415420	ED	On-Demand	Anodyne	SSTR5	79	41
NC(=O)c1cc(NC2CCN(Cc3ccncc3)CC2)nc(Cl)n1	ZINC000872415420	ED	On-Demand	Anodyne	PDK1	33	40
Nc1nc(C(F)F)nc(N2CCC[C@@H]2CCc2ccccc2)n1	ZINC000872415422	DF	On-Demand	Anodyne	SLC18A2	71	47
Nc1nc(C(F)F)nc(N2CCC[C@H]2CCc2ccccc2)n1	ZINC000872415424	DF	On-Demand	Anodyne	SLC18A2	71	47
O=C(Nc1ccc(Cl)cn1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415425	FF	On-Demand	Anodyne	F10	37	50
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	HTR1A	34	45
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	DRD2	41	41
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	DRD4	50	38
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	ACHE	34	47
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	HTR2A	29	48
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	DRD3	50	49
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	HRP1_PLAFA	90	39
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	HTR7	30	45
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	SIGMAR1	54	46
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	BCHE	22	47
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	FAAH	15	40
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	HNMT	80	41
Oc1nnc(Cl)cc1NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000872415431	GF	On-Demand	Anodyne	CACNA1G	18	44
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000872415439	EF	On-Demand	Anodyne	F10	31	48
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000872415439	EF	On-Demand	Anodyne	AKT3	54	34
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000872415439	EF	On-Demand	Anodyne	LIMK2	25	45
Oc1nnc(Cl)cc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415459	EG	On-Demand	Anodyne	SCD1	61	48
Oc1nnc(Cl)cc1N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000872415459	EG	On-Demand	Anodyne	SCD	23	40
Cc1ccccc1CN1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872415460	EG	On-Demand	Anodyne	DRD4	21	48
Cc1ccccc1CN1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872415460	EG	On-Demand	Anodyne	SSTR5	55	37
O=C(CCNc1ccnc2ncccc12)N1CCCCC1	ZINC000872415476	CE	On-Demand	Anodyne	HRP1_PLAFA	40	33
O=C(CCNc1ccnc2ncccc12)N1CCCCC1	ZINC000872415476	CE	On-Demand	Anodyne	HNMT	73	45
Cc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)cc1F	ZINC000872415505	EE	On-Demand	Anodyne	HPGD	41	35
Oc1nnc(Cl)cc1NC1CCN(Cc2ccccn2)CC1	ZINC000872415507	DE	On-Demand	Anodyne	SSTR5	54	35
Cc1c(F)ncnc1N1CCC(c2nc3cc(Cl)ccc3o2)CC1	ZINC000872415515	EI	On-Demand	Anodyne	PTGES	16	42
COc1ccc2[nH]cc(C3=CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872415519	EH	On-Demand	Clean	SLC6A4	15	60
CN(C)CCOc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872415524	DE	On-Demand	Anodyne	ESRRG	47	35
O=c1n(CCCNc2ccnc3ncccc23)nc2n1CCCC2	ZINC000872415531	DD	On-Demand	Anodyne	HRP1_PLAFA	93	36
O=c1n(CCCNc2ccnc3ncccc23)nc2n1CCCC2	ZINC000872415531	DD	On-Demand	Anodyne	HNMT	73	44
O=C(C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1)N1CCCC1	ZINC000872415537	FD	On-Demand	Anodyne	SMO	16	42
O=C(NCc1ccc(F)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415551	FG	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1ccc(F)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415551	FG	On-Demand	Anodyne	CACNA1G	51	41
O=C(NCc1ccc(F)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415551	FG	On-Demand	Anodyne	NAMPT	41	36
CCC(=O)Nc1cccc(CNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872415570	EF	On-Demand	Anodyne	ABL1	21	42
CCOc1ccccc1C(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415581	FE	On-Demand	Anodyne	HTR1A	16	42
CCOc1ccccc1C(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415581	FE	On-Demand	Anodyne	NPY2R	29	44
CCOc1ccccc1C(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415581	FE	On-Demand	Anodyne	HCN1	55	36
CCOc1ccccc1C(=O)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872415581	FE	On-Demand	Anodyne	HCN4	45	35
c1cnc2nccc(N3CCC(N4CCCCC4)CC3)c2c1	ZINC000872415585	CG	On-Demand	Anodyne	HRH3	26	56
c1cnc2nccc(N3CCC(N4CCCCC4)CC3)c2c1	ZINC000872415585	CG	On-Demand	Anodyne	L3MBTL3	96	45
Cn1ncc2c(N3CCC(Oc4ccc(F)cc4F)CC3)nc(Cl)nc21	ZINC000872415592	GG	On-Demand	Anodyne	DCK	48	36
COc1ccc([C@@H](C)Nc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872415593	EF	On-Demand	Anodyne	DRTS_TOXGO	16	40
Cc1ccccc1CN1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872415602	DG	On-Demand	Anodyne	SSTR5	46	37
Cc1ccccc1CN1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872415602	DG	On-Demand	Anodyne	SCN5A	60	34
Nc1nc(C(F)F)nc(N2CCC(Oc3ccc(F)cc3F)CC2)n1	ZINC000872415621	FF	On-Demand	Anodyne	DCK	49	36
Nc1nc(C(F)F)nc(N2CCC(Oc3ccc(F)cc3F)CC2)n1	ZINC000872415621	FF	On-Demand	Anodyne	SCD1	44	45
Nc1nc(C(F)F)nc(N2CCC(Oc3ccc(F)cc3F)CC2)n1	ZINC000872415621	FF	On-Demand	Anodyne	SCD	17	45
NC(=O)c1cc(NC2CCN(Cc3ccccn3)CC2)nc(Cl)n1	ZINC000872415627	ED	On-Demand	Anodyne	DRD4	16	53
NC(=O)c1cc(NC2CCN(Cc3ccccn3)CC2)nc(Cl)n1	ZINC000872415627	ED	On-Demand	Anodyne	SSTR5	65	38
NC(=O)c1cc(NC2CCN(Cc3ccccn3)CC2)nc(Cl)n1	ZINC000872415627	ED	On-Demand	Anodyne	MCHR1	20	45
COc1cccc(OC)c1OC1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872415629	GG	On-Demand	Anodyne	DCK	43	38
COc1cccc(OC)c1OC1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872415629	GG	On-Demand	Anodyne	PDE3B	46	38
c1ccc(-c2cc(Nc3cnn(C[C@@H]4CCCO4)c3)ncn2)cc1	ZINC000872415635	DG	On-Demand	Anodyne	TNK2	50	37
c1ccc(-c2cc(Nc3cnn(C[C@H]4CCCO4)c3)ncn2)cc1	ZINC000872415636	DG	On-Demand	Anodyne	TNK2	50	37
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	HTR1A	79	50
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	DRD2	56	50
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	DRD4	43	51
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	ADRA1D	20	42
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	HTR2A	58	50
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	HTR2C	21	45
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	ADRA1A	24	44
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	DRD3	73	50
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	HTR7	90	49
Nc1nc(NCCCCN2CCN(c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872415651	GE	On-Demand	Anodyne	HNMT	60	38
c1cc(CNc2ccnc3ncccc23)cc(CN2CCOCC2)c1	ZINC000872415652	EG	On-Demand	Anodyne	DDR2	16	43
CC[C@H](C)NC(=O)CCNc1cc(-c2ccccc2)ncn1	ZINC000872415654	CF	On-Demand	Anodyne	P2RY12	67	36
Oc1nnc(Cl)cc1NC1CCN(Cc2ccncc2)CC1	ZINC000872415657	DE	On-Demand	Anodyne	SIGMAR1	18	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccncc2)CC1	ZINC000872415657	DE	On-Demand	Anodyne	SSTR5	78	37
Oc1nnc(Cl)cc1NC1CCN(Cc2ccncc2)CC1	ZINC000872415657	DE	On-Demand	Anodyne	MCHR1	26	43
CCOc1cc(CNc2cc(Cl)nnc2O)ccc1OC(F)F	ZINC000872415669	EG	On-Demand	Anodyne	DRTS_TRYCR	44	31
Cc1cccc(NC(=O)[C@@H]2CCCN(c3cc(C)nc4c3cnn4C)C2)n1	ZINC000872415677	FF	On-Demand	Anodyne	GPBAR1	17	41
Cn1ncc2c(NCc3ccc(N4CCOCC4)c(F)c3)nc(Cl)nc21	ZINC000872415697	GF	On-Demand	Clean	ABL1	17	41
Cn1ncc2c(NCc3ccc(N4CCOCC4)c(F)c3)nc(Cl)nc21	ZINC000872415697	GF	On-Demand	Clean	STAT6	43	33
Fc1cc(CNc2ccnc3ncccc23)ccc1N1CCOCC1	ZINC000872415718	EG	On-Demand	Clean	STAT6	43	34
COc1cccc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)C(C)(C)CO3)c1	ZINC000872415722	GF	On-Demand	Anodyne	PKM	23	47
COc1cccc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)C(C)(C)CO3)c1	ZINC000872415722	GF	On-Demand	Anodyne	MGAT1	51	41
CCOCCCCNc1cc(-c2ccccc2)ncn1	ZINC000872415727	CG	On-Demand	Anodyne	METG	42	32
Cn1ncc2c(NC3CCC4(CC3)OCCO4)nc(Cl)nc21	ZINC000872415741	DE	On-Demand	Anodyne	Q4VQ11_PIG	59	36
C[C@@H](CNc1cc(C(N)=O)nc(Cl)n1)Cn1ccnc1	ZINC000872415749	CD	On-Demand	Anodyne	TBXAS1	28	49
CCOc1ccccc1C(=O)N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872415750	GF	On-Demand	Anodyne	HTR1A	18	40
CCOc1ccccc1C(=O)N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872415750	GF	On-Demand	Anodyne	HCN1	58	37
CCOc1ccccc1C(=O)N1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872415750	GF	On-Demand	Anodyne	HCN4	44	34
NC(=O)c1cc(NC[C@H]2CCN(CC(F)(F)F)C2)nc(Cl)n1	ZINC000872415765	ED	On-Demand	Anodyne	CACNA1I	46	32
NC(=O)c1cc(NC[C@@H]2CCN(CC(F)(F)F)C2)nc(Cl)n1	ZINC000872415766	ED	On-Demand	Anodyne	CACNA1I	46	32
CC(=O)N[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872415767	CE	On-Demand	Anodyne	PIM1	19	40
CC(=O)N[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872415767	CE	On-Demand	Anodyne	PIM3	15	44
CC(=O)N[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872415768	CE	On-Demand	Anodyne	PIM1	19	40
CC(=O)N[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872415768	CE	On-Demand	Anodyne	PIM3	15	44
Cn1ncc2c(N[C@@H]3CCC[C@@H](O)C3)nc(Cl)nc21	ZINC000872415780	CD	On-Demand	Anodyne	Q4VQ11_PIG	59	37
Cn1ncc2c(N[C@H]3CCC[C@@H](O)C3)nc(Cl)nc21	ZINC000872415781	CD	On-Demand	Anodyne	Q4VQ11_PIG	59	37
Cn1ncc2c(N[C@@H]3CCC[C@H](O)C3)nc(Cl)nc21	ZINC000872415782	CD	On-Demand	Anodyne	Q4VQ11_PIG	59	37
Cn1ncc2c(N[C@H]3CCC[C@H](O)C3)nc(Cl)nc21	ZINC000872415783	CD	On-Demand	Anodyne	Q4VQ11_PIG	59	37
O=C(CCNc1cc(-c2ccccc2)ncn1)N1CCCCC1	ZINC000872415800	DF	On-Demand	Anodyne	DPP7	45	39
CCOc1ccccc1C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872415801	EE	On-Demand	Anodyne	PDGFRB	41	42
CCOc1ccccc1C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872415801	EE	On-Demand	Anodyne	HCN1	63	39
CCOc1ccccc1C(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872415801	EE	On-Demand	Anodyne	HCN4	49	38
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872415805	FF	On-Demand	Anodyne	DCK	48	40
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872415805	FF	On-Demand	Anodyne	SCD1	69	62
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872415805	FF	On-Demand	Anodyne	SCD	24	43
Oc1nnc(Cl)cc1N1CCC[C@@H]1CCc1ccccc1	ZINC000872415833	DG	On-Demand	Anodyne	SLC18A2	58	43
Oc1nnc(Cl)cc1N1CCC[C@H]1CCc1ccccc1	ZINC000872415834	DG	On-Demand	Anodyne	SLC18A2	58	43
CN(C)c1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1F	ZINC000872415846	FE	On-Demand	Anodyne	SGK1	15	52
COc1ccc(OC2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872415852	FE	On-Demand	Anodyne	PRSS2	55	31
COc1ccc(OC2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872415852	FE	On-Demand	Anodyne	DCK	40	42
COc1ccc(OC2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872415852	FE	On-Demand	Anodyne	CHEK2	22	40
COc1ccc(OC2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872415852	FE	On-Demand	Anodyne	SCD1	43	47
CCOc1cc(CNc2ncnc(F)c2C)ccc1OC(F)F	ZINC000872415855	EH	On-Demand	Anodyne	PDE6A	42	33
Cc1c(F)ncnc1NCc1cccc(OC(C)C)c1	ZINC000872415862	CG	On-Demand	Anodyne	CLK4	19	44
Cc1c(F)ncnc1N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872415876	FE	On-Demand	Anodyne	AKT1	26	48
Cc1c(F)ncnc1N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000872415876	FE	On-Demand	Anodyne	LIMK2	27	41
CN(C)c1ccc(NS(=O)(=O)c2ccc3c(c2)CS(=O)(=O)C3)cc1F	ZINC000872415877	GE	On-Demand	Anodyne	PKM	24	43
O=C(Nc1ccc(Cl)cn1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415880	FH	On-Demand	Anodyne	F10	26	46
O=C(Nc1ccc(Cl)cn1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872415880	FH	On-Demand	Anodyne	TYK2	48	36
CN(C)c1ccc(NS(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)cc1F	ZINC000872415884	GF	On-Demand	Anodyne	CYP11B1	29	41
CN(C)c1ccc(NS(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)cc1F	ZINC000872415884	GF	On-Demand	Anodyne	CYP11B2	29	41
CN(C)c1ccc(NS(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)cc1F	ZINC000872415884	GF	On-Demand	Anodyne	PKM	29	42
COCc1ccccc1S(=O)(=O)Nc1ccc2c(c1)NC(=O)C(C)(C)CO2	ZINC000872415896	GF	On-Demand	Anodyne	PKM	26	40
COc1cccc(OC)c1OC1CCN(c2ncnc(F)c2C)CC1	ZINC000872415957	EF	On-Demand	Anodyne	PDE3A	54	49
COc1cccc(OC)c1OC1CCN(c2ncnc(F)c2C)CC1	ZINC000872415957	EF	On-Demand	Anodyne	DCK	60	46
COc1cccc(OC)c1OC1CCN(c2ncnc(F)c2C)CC1	ZINC000872415957	EF	On-Demand	Anodyne	PDE3B	59	49
COc1cccc(OC)c1OC1CCN(c2ncnc(F)c2C)CC1	ZINC000872415957	EF	On-Demand	Anodyne	SCD1	32	41
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	AKT2	21	46
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	EPHX2	17	45
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	AKT1	22	43
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	CACNA1G	42	42
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	SIRT3	55	33
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	SIRT2	50	31
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	SIRT1	48	30
Cc1c(F)ncnc1N1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000872415959	EF	On-Demand	Anodyne	LIMK2	45	46
CC(CCCO)=NNC(=O)COc1ccccc1Br	ZINC000872415965	EE	On-Demand	Reactive	ABAT	19	42
Oc1nnc(Cl)cc1N1CCC(N2CCCCC2)CC1	ZINC000872415970	CE	On-Demand	Anodyne	HRH3	25	51
Oc1nnc(Cl)cc1N1CCC(N2CCCCC2)CC1	ZINC000872415970	CE	On-Demand	Anodyne	L3MBTL3	95	43
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)cc1C(F)(F)F	ZINC000872416002	GG	On-Demand	Clean	STAT6	59	37
NC(=O)c1cc(N2CCC(N3CCCCC3)CC2)nc(Cl)n1	ZINC000872416004	DD	On-Demand	Anodyne	HRH3	26	44
NC(=O)c1cc(N2CCC(N3CCCCC3)CC2)nc(Cl)n1	ZINC000872416004	DD	On-Demand	Anodyne	L3MBTL3	105	39
NC(=O)c1cc(NCc2ccc(N3CCSCC3)cc2)nc(Cl)n1	ZINC000872416008	FE	On-Demand	Clean	STAT6	65	37
Cn1ncc2c(NC3CCN(Cc4ccccn4)CC3)nc(Cl)nc21	ZINC000872416011	FE	On-Demand	Anodyne	SCN5A	50	38
COc1cccc(OC)c1OC1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872416028	GE	On-Demand	Anodyne	DCK	46	39
COc1cccc(OC)c1OC1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872416028	GE	On-Demand	Anodyne	PDE3B	44	39
COc1cccc(OC)c1OC1CCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872416028	GE	On-Demand	Anodyne	SCD1	43	35
Cc1cccc(NC(=O)[C@@H]2CCCN(c3cc(Cl)nnc3O)C2)n1	ZINC000872416051	EE	On-Demand	Anodyne	SORT1	15	40
Cc1cccc(NC(=O)[C@@H]2CCCN(c3cc(Cl)nnc3O)C2)n1	ZINC000872416051	EE	On-Demand	Anodyne	GPBAR1	15	46
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HTR1A	99	51
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	DRD2	78	50
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	DRD4	63	51
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	ADRA1D	31	45
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HTR2A	74	50
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HTR2C	35	45
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	SLC6A4	18	45
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	ADRA1A	34	45
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	ADRA1B	18	42
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	DRD3	98	50
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HRP1_PLAFA	87	38
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HTR7	108	57
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	SIGMAR1	18	45
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000872416054	FF	On-Demand	Anodyne	HNMT	82	40
c1ccc(-c2cc(N[C@H]3CCCN(c4ncccn4)C3)ncn2)cc1	ZINC000872416081	EG	On-Demand	Anodyne	PRKD1	62	37
CCNC(=O)CN(C)c1nc2c(OC)ccc(OC)c2s1	ZINC000872416082	DD	On-Demand	Anodyne	ADORA2B	17	40
c1ccc(-c2cc(N[C@@H]3CCCN(c4ncccn4)C3)ncn2)cc1	ZINC000872416083	EG	On-Demand	Anodyne	PRKD1	62	37
COc1ccc(OC2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872416104	EF	On-Demand	Anodyne	PRSS2	51	32
Nc1nc(C(F)F)nc(N2CCC(Cc3cccc(F)c3)CC2)n1	ZINC000872416106	EF	On-Demand	Anodyne	GRIN2B	32	47
Cn1ncc2c(NCc3cccc(CN4CCOCC4)c3)nc(Cl)nc21	ZINC000872416117	FE	On-Demand	Anodyne	ABL1	15	45
Cn1ncc2c(NCc3cccc(CN4CCOCC4)c3)nc(Cl)nc21	ZINC000872416117	FE	On-Demand	Anodyne	PIK3CA	15	41
CC(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872416132	CE	On-Demand	Anodyne	PDPK1	18	46
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872416133	FF	On-Demand	Anodyne	F10	27	47
CC(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872416134	CE	On-Demand	Anodyne	PDPK1	18	46
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872416135	FF	On-Demand	Anodyne	F10	27	47
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000872416136	FG	On-Demand	Anodyne	PTGES	20	40
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000872416136	FG	On-Demand	Anodyne	LIMK2	21	43
O=C(NCc1ccc(F)cc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872416148	FH	On-Demand	Anodyne	CACNA1G	41	39
O=C(NCc1ccc(F)cc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872416148	FH	On-Demand	Anodyne	NAMPT	79	40
Oc1nnc(Cl)cc1N1CCC(Cc2cccc(F)c2)CC1	ZINC000872416167	DG	On-Demand	Anodyne	GRIN2B	33	43
Cc1cccc(NC(=O)[C@@H]2CCCN(c3ccnc4ncccc34)C2)n1	ZINC000872416172	EG	On-Demand	Anodyne	GRM5	15	44
Nc1nc(NCc2ccc(N3CCOCC3)c(F)c2)nc(C(F)F)n1	ZINC000872416179	FD	On-Demand	Clean	STAT6	45	35
Cc1cccc(NC(=O)[C@@H]2CCCN(c3nc(Cl)nc4c3cnn4C)C2)n1	ZINC000872416193	GF	On-Demand	Anodyne	GPBAR1	18	43
Cc1cccc(NC(=O)[C@@H]2CCCN(c3ncnc(F)c3C)C2)n1	ZINC000872416207	EE	On-Demand	Anodyne	GPBAR1	17	42
NC(=O)c1cc(NCc2cccc(CN3CCOCC3)c2)nc(Cl)n1	ZINC000872416217	FD	On-Demand	Anodyne	STAT6	68	43
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	DRD4	32	40
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	ACHE	21	45
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	HTR2A	26	45
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	DRD3	36	44
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	HRP1_PLAFA	51	33
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	HTR7	30	41
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	SIGMAR1	29	43
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	BCHE	22	45
Nc1nc(NCCCCN2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872416218	GE	On-Demand	Anodyne	HNMT	66	37
CC(C)(C)OC(=O)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416232	EE	On-Demand	Anodyne	SIRT3	40	41
CC(C)(C)OC(=O)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416232	EE	On-Demand	Anodyne	SIRT2	33	41
CC(C)(C)OC(=O)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416232	EE	On-Demand	Anodyne	SIRT1	34	41
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000872416239	EF	On-Demand	Anodyne	F10	22	43
Cc1c(F)ncnc1N1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000872416240	EF	On-Demand	Anodyne	F10	22	43
Cc1c(F)ncnc1N1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000872416275	DE	On-Demand	Anodyne	SIRT3	60	44
Cc1c(F)ncnc1N1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000872416275	DE	On-Demand	Anodyne	SIRT2	50	44
Cc1c(F)ncnc1N1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000872416275	DE	On-Demand	Anodyne	SIRT1	44	44
Nc1nc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872416284	FF	On-Demand	Anodyne	SIGMAR1	26	43
Nc1nc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872416284	FF	On-Demand	Anodyne	SSTR5	53	37
Nc1nc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872416284	FF	On-Demand	Anodyne	CCR3	22	40
Nc1nc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872416284	FF	On-Demand	Anodyne	MCHR1	27	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3c[nH]nc3Cl)cc2)CC1	ZINC000872416293	GD	On-Demand	Anodyne	SGK1	44	32
NC(=O)c1cc(Nc2ccc(N3CCCC3)c(F)c2)nc(Cl)n1	ZINC000872416297	EF	On-Demand	Anodyne	NPY2R	47	32
NC(=O)c1cc(Nc2ccc(N3CCCC3)c(F)c2)nc(Cl)n1	ZINC000872416297	EF	On-Demand	Anodyne	MAPK9	32	45
NC(=O)c1cc(Nc2ccc(N3CCCC3)c(F)c2)nc(Cl)n1	ZINC000872416297	EF	On-Demand	Anodyne	MAPK10	29	45
NC(=O)c1cc(Nc2ccc(N3CCCC3)c(F)c2)nc(Cl)n1	ZINC000872416297	EF	On-Demand	Anodyne	STAT6	41	30
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	DRD2	19	41
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	DRD4	43	34
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	DRD3	28	41
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	HTR4	44	35
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	HRP1_PLAFA	56	40
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	HNMT	44	33
CCC(=O)c1c(Cl)cccc1NCCCN1CCC(O)CC1	ZINC000872416303	DG	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)N1CCN(c2ccc(NS(=O)(=O)N3CCC(C)CC3)cc2)CC1	ZINC000872416313	GD	On-Demand	Anodyne	CSF1R	15	40
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC(F)F	ZINC000872416318	FG	On-Demand	Anodyne	AGPAT2	41	36
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC(F)F	ZINC000872416318	FG	On-Demand	Anodyne	DRTS_TRYCR	50	35
Cc1ccc([C@@H](C)Nc2nc(N)nc(C(F)F)n2)cc1	ZINC000872416321	CF	On-Demand	Anodyne	TPH1	22	40
O=C(CCN1CCOCC1)Nc1cccc(CNc2ccnc3ncccc23)c1	ZINC000872416325	GF	On-Demand	Anodyne	KIT	18	41
O=C(CCN1CCOCC1)Nc1cccc(CNc2ccnc3ncccc23)c1	ZINC000872416325	GF	On-Demand	Anodyne	HNMT	40	32
O=C(CCN1CCOCC1)Nc1cccc(CNc2ccnc3ncccc23)c1	ZINC000872416325	GF	On-Demand	Anodyne	EPHX2	20	42
COC(=O)[C@H]1CCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872416327	DG	On-Demand	Anodyne	PARE	75	32
CCC(CC)C(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872416332	EG	On-Demand	Anodyne	CCR8	51	38
CNC(=O)CCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872416339	CD	On-Demand	Anodyne	ADORA2B	18	45
Cc1c(F)ncnc1N1CCC(C(=O)Nc2nncs2)CC1	ZINC000872416340	DD	On-Demand	Anodyne	SIRT3	54	34
Cc1c(F)ncnc1N1CCC(C(=O)Nc2nncs2)CC1	ZINC000872416340	DD	On-Demand	Anodyne	SIRT2	44	32
Cc1c(F)ncnc1N1CCC(C(=O)Nc2nncs2)CC1	ZINC000872416340	DD	On-Demand	Anodyne	SIRT1	40	32
OC1CCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872416348	DE	On-Demand	Anodyne	ADRA1A	15	43
OC1CCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872416348	DE	On-Demand	Anodyne	HRP1_PLAFA	48	33
OC1CCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872416348	DE	On-Demand	Anodyne	SIGMAR1	18	47
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc4c(c3)CCC4)cc2)CC1	ZINC000872416350	GF	On-Demand	Anodyne	PKM	15	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	EGFR	37	53
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	KIT	15	45
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	MET	18	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	EPHX2	23	46
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	AURKA	27	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000872416353	FE	On-Demand	Anodyne	STAT6	65	41
CCOc1ccncc1S(=O)(=O)Nc1ccc(N(C)C)c(F)c1	ZINC000872416355	EE	On-Demand	Anodyne	ALPL	19	51
O=C(Nc1nncs1)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872416356	FF	On-Demand	Anodyne	GSK3B	19	43
O=C(Nc1nncs1)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872416356	FF	On-Demand	Anodyne	GSK3A	33	43
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cccc(CC#N)c3)cc2)CC1	ZINC000872416357	GE	On-Demand	Mild	TRY2_BOVIN	67	37
CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc(N(C)C)c(F)c3)ccc21	ZINC000872416363	GF	On-Demand	Anodyne	PKM	25	40
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC	ZINC000872416383	DE	On-Demand	Anodyne	DHFR	34	49
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC	ZINC000872416383	DE	On-Demand	Anodyne	DFR1	15	41
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC	ZINC000872416383	DE	On-Demand	Anodyne	DRTS_TOXGO	50	44
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC	ZINC000872416383	DE	On-Demand	Anodyne	DYR_PNECA	33	41
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC	ZINC000872416383	DE	On-Demand	Anodyne	DRTS_TRYCR	22	41
O=C(Nc1ccc(Cl)cn1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872416388	FH	On-Demand	Anodyne	F10	27	47
O=C(Nc1ccc(Cl)cn1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872416388	FH	On-Demand	Anodyne	TYK2	48	34
Cn1ncc2c(NCCCOCCc3ccccc3)nc(Cl)nc21	ZINC000872416390	EG	On-Demand	Anodyne	ABL1	19	41
Fc1cc(Cl)cc2sc(NC3CCOCC3)nc12	ZINC000872416393	CH	On-Demand	Anodyne	MAPK1	43	33
COc1ccc(OC)c2sc(NCC(=O)NCC(F)(F)F)nc12	ZINC000872416398	EE	On-Demand	Anodyne	ADORA2B	18	43
CNC(=O)CCCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872416409	DE	On-Demand	Anodyne	ADORA2B	17	44
Cc1c(F)ncnc1NCc1cccc(CN2CCOCC2)c1	ZINC000872416415	DE	On-Demand	Anodyne	EGFR	23	44
O=C(CCN1CCOCC1)Nc1cccc(CN=c2cc[nH]cc2C2CC2)c1	ZINC000872416421	GF	On-Demand	Anodyne	CASR	28	40
O=C(CCN1CCOCC1)Nc1cccc(CN=c2cc[nH]cc2C2CC2)c1	ZINC000872416421	GF	On-Demand	Anodyne	EPHX2	19	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C4CC4)cc3)cc2)CC1	ZINC000872416425	GG	On-Demand	Anodyne	LIMK2	17	45
CN(C)c1ccc(NS(=O)(=O)c2ccc3c(c2)COC3)cc1F	ZINC000872416434	EF	On-Demand	Anodyne	PKM	24	43
FC(F)(F)CO[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872416437	DH	On-Demand	Anodyne	LIPG	46	39
FC(F)(F)CO[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872416438	DH	On-Demand	Anodyne	LIPG	46	39
OC1CCN(CCCNc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872416448	EG	On-Demand	Anodyne	HRP1_PLAFA	84	39
OC1CCN(CCCNc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872416448	EG	On-Demand	Anodyne	HNMT	48	37
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416451	EG	On-Demand	Anodyne	DRD4	18	41
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416451	EG	On-Demand	Anodyne	SIGMAR1	18	49
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416451	EG	On-Demand	Anodyne	SSTR5	84	45
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416451	EG	On-Demand	Anodyne	ABCC1	58	33
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416451	EG	On-Demand	Anodyne	MCHR1	38	48
NC(=O)c1cc(NCCCOCCc2ccccc2)nc(Cl)n1	ZINC000872416459	EE	On-Demand	Anodyne	SCNN1A	46	36
NC(=O)c1cc(NCCCOCCc2ccccc2)nc(Cl)n1	ZINC000872416459	EE	On-Demand	Anodyne	METG	40	35
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C)c(F)c3)cc2)CC1	ZINC000872416468	GF	On-Demand	Anodyne	PKM	20	44
c1ccc(-c2cc(NC3CCOCC3)ncn2)cc1	ZINC000872416487	CF	On-Demand	Anodyne	CD38	16	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cc(F)ccc3F)cc2)CC1	ZINC000872416497	GE	On-Demand	Anodyne	SGK1	40	43
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(N(C)C)c(F)c2)c1	ZINC000872416506	GF	On-Demand	Anodyne	LIMK2	32	45
C=Cc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1	ZINC000872416526	GF	On-Demand	Anodyne	TGM2	59	38
C=Cc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1	ZINC000872416526	GF	On-Demand	Anodyne	F13A1	77	44
C=Cc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1	ZINC000872416526	GF	On-Demand	Anodyne	LIMK2	15	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3c(C)nn(C)c3C)cc2)CC1	ZINC000872416534	GD	On-Demand	Anodyne	NMT1	29	41
Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(N(C)C)c(F)c1	ZINC000872416540	DE	On-Demand	Anodyne	SGK1	46	37
c1cnc2nccc(N3CCN(CC4CC4)CC3)c2c1	ZINC000872416542	CE	On-Demand	Anodyne	DRD2	17	47
c1cnc2nccc(N3CCN(CC4CC4)CC3)c2c1	ZINC000872416542	CE	On-Demand	Anodyne	DRD3	15	47
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	DRD4	28	41
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	KCNH2	22	42
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	SIGMAR1	33	50
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	SSTR5	79	43
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	CCR3	87	48
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	MLNR	60	41
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	MCHR1	56	46
NC(=O)c1cc(NC2CCN(Cc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872416543	FE	On-Demand	Anodyne	CACNA1G	39	40
OC1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872416545	CD	On-Demand	Anodyne	ADRA1A	15	40
OC1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872416545	CD	On-Demand	Anodyne	HRP1_PLAFA	100	47
OC1CCN(CCCNc2ccnc3ncccc23)CC1	ZINC000872416545	CD	On-Demand	Anodyne	HNMT	103	54
CN(C)c1ccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1F	ZINC000872416569	GF	On-Demand	Anodyne	PKM	24	41
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	KCNH2	19	44
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	SIGMAR1	34	48
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	SSTR5	76	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	CCR3	51	44
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	MLNR	44	39
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416570	EG	On-Demand	Anodyne	MCHR1	46	44
NC(=O)c1cc(NC2CCOCC2)nc(Cl)n1	ZINC000872416572	CC	On-Demand	Anodyne	PRKD1	40	42
NC(=O)c1cc(NC2CCOCC2)nc(Cl)n1	ZINC000872416572	CC	On-Demand	Anodyne	MAPK1	58	32
O=C(CCN1CCOCC1)Nc1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872416584	GE	On-Demand	Anodyne	CASR	33	41
O=C(CCN1CCOCC1)Nc1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872416584	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(CCN1CCOCC1)Nc1cccc(CNc2cc(Cl)nnc2O)c1	ZINC000872416584	GE	On-Demand	Anodyne	STAT6	53	37
CCC(=O)c1c(Cl)cccc1NC1CCOCC1	ZINC000872416597	CH	On-Demand	Anodyne	MAPK1	60	36
O=C(COc1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416600	GE	On-Demand	Anodyne	HTR1D	17	43
O=C(COc1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416600	GE	On-Demand	Anodyne	HTR1B	21	43
O=C(COc1ccc(Cl)cc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872416600	GE	On-Demand	Anodyne	CPT1A	27	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cncc(F)c3)cc2)CC1	ZINC000872416614	GD	On-Demand	Anodyne	STAT6	56	34
CC(=O)N1CCN(c2ccc(NS(=O)(=O)CCC3CC3)cc2)CC1	ZINC000872416619	FD	On-Demand	Anodyne	DRD3	17	46
NC(=O)c1cc(N2CCC[C@@H](OCC(F)(F)F)C2)nc(Cl)n1	ZINC000872416649	ED	On-Demand	Anodyne	LIPG	44	34
NC(=O)c1cc(N2CCC[C@H](OCC(F)(F)F)C2)nc(Cl)n1	ZINC000872416650	ED	On-Demand	Anodyne	LIPG	44	34
CNC(=O)COc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872416657	DD	On-Demand	Anodyne	ADORA3	42	37
CNC(=O)COc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872416657	DD	On-Demand	Anodyne	CLK4	16	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cccc(F)c3F)cc2)CC1	ZINC000872416686	GE	On-Demand	Anodyne	PRNP	40	35
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cccc(F)c3F)cc2)CC1	ZINC000872416686	GE	On-Demand	Anodyne	SGK1	40	42
Nc1nc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(C(F)F)n1	ZINC000872416687	FF	On-Demand	Anodyne	SSTR5	61	41
Nc1nc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(C(F)F)n1	ZINC000872416687	FF	On-Demand	Anodyne	MCHR1	32	42
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(N(C)C)c(F)c3)ccc21	ZINC000872416695	GF	On-Demand	Anodyne	PKM	25	40
CC(=O)N1CCN(c2ccc(NS(=O)(=O)N3CCOCC3)cc2)CC1	ZINC000872416699	FC	On-Demand	Anodyne	AKR1C3	17	48
OC1CCN(CCCNc2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872416706	EG	On-Demand	Anodyne	HRP1_PLAFA	45	35
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	DRD4	24	43
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	SIGMAR1	23	52
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	SSTR5	77	42
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	CCR3	41	42
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	MLNR	36	41
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	CXCR3	42	42
NC(=O)c1cc(NC2CCN(Cc3ccc(F)c(F)c3)CC2)nc(Cl)n1	ZINC000872416712	GF	On-Demand	Anodyne	MCHR1	51	47
Oc1nnc(Cl)cc1Nc1ccc(N2CCCC2)c(F)c1	ZINC000872416717	DG	On-Demand	Anodyne	MAPK9	18	40
Oc1nnc(Cl)cc1Nc1ccc(N2CCCC2)c(F)c1	ZINC000872416717	DG	On-Demand	Anodyne	MAPK10	16	40
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416724	FG	On-Demand	Anodyne	SIGMAR1	25	50
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416724	FG	On-Demand	Anodyne	SSTR5	74	41
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416724	FG	On-Demand	Anodyne	CXCR3	35	41
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000872416724	FG	On-Demand	Anodyne	MCHR1	41	46
COC(=O)[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872416733	CE	On-Demand	Anodyne	SLC6A3	20	41
COC(=O)[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872416733	CE	On-Demand	Anodyne	P2RY12	66	35
COC(=O)[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872416733	CE	On-Demand	Anodyne	VCP	47	41
COc1ccc(OC)c2sc(NC3CCOCC3)nc12	ZINC000872416734	CF	On-Demand	Anodyne	GAK	22	45
Oc1nnc(Cl)cc1N1CCC[C@@H](OCC(F)(F)F)C1	ZINC000872416739	DE	On-Demand	Anodyne	LIPG	50	37
Oc1nnc(Cl)cc1N1CCC[C@H](OCC(F)(F)F)C1	ZINC000872416740	DE	On-Demand	Anodyne	LIPG	50	37
CNC(=O)COc1cccc(CNc2nc(Cl)nc3c2cnn3C)c1	ZINC000872416742	FD	On-Demand	Anodyne	ADORA3	75	40
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	DRD4	26	41
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	SIGMAR1	38	46
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	SSTR5	79	40
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	CCR3	29	41
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	MLNR	58	41
Cc1c(F)ncnc1NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000872416744	DG	On-Demand	Anodyne	MCHR1	37	48
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	DRD4	49	42
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	HTR7	17	43
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	MMP13	21	46
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	HTR6	21	46
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	MTNR1B	31	41
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	PTPRB	28	40
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	BCL2	26	47
COc1cccc(S(=O)(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000872416749	GE	On-Demand	Anodyne	AKR1C3	24	40
CCn1nccc1S(=O)(=O)Nc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000872416766	GD	On-Demand	Anodyne	PRNP	38	40
CNC(=O)COc1cccc(CNc2nc(SC)nc(Cl)c2F)c1	ZINC000872416778	FF	On-Demand	Anodyne	ADORA3	45	41
CNC(=O)COc1cccc(CNc2nc(SC)nc(Cl)c2F)c1	ZINC000872416778	FF	On-Demand	Anodyne	PDS	76	36
COC(=O)[C@H]1CCN(c2nc3c(OC)ccc(OC)c3s2)C1	ZINC000872416780	DE	On-Demand	Anodyne	PARE	49	33
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cc4ccccc4o3)cc2)CC1	ZINC000872416783	GF	On-Demand	Anodyne	LPL	44	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cc4ccccc4o3)cc2)CC1	ZINC000872416783	GF	On-Demand	Anodyne	LIPG	15	41
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(N(C)C)c(F)c2)s1	ZINC000872416791	FE	On-Demand	Anodyne	PIK3CG	15	44
CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(N(C)C)c(F)c2)s1	ZINC000872416791	FE	On-Demand	Anodyne	RORA	19	59
FC(F)(F)CO[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872416792	DG	On-Demand	Anodyne	LIPG	46	41
FC(F)(F)CO[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872416793	DG	On-Demand	Anodyne	LIPG	46	41
CC(=O)N1CCN(c2ccc(NS(=O)(=O)[C@@H]3C[C@H]3c3ccccc3)cc2)CC1	ZINC000872416797	GF	On-Demand	Anodyne	EPHX2	15	40
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cc(C)ccc3F)cc2)CC1	ZINC000872416806	GF	On-Demand	Anodyne	SGK1	50	44
COC(=O)[C@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872416816	DF	On-Demand	Anodyne	GRM5	19	47
COc1cccc(CNc2ncnc(F)c2C)c1OC	ZINC000872416817	CF	On-Demand	Anodyne	EGFR	21	44
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C)o3)cc2)CC1	ZINC000872416838	FE	On-Demand	Anodyne	LPL	44	38
CN(C)c1ccc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1F	ZINC000872416857	GF	On-Demand	Anodyne	MAPK13	54	31
CN(C)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1F	ZINC000872416867	EF	On-Demand	Anodyne	PKM	44	44
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cccc(C#N)c3)cc2)CC1	ZINC000872416879	GE	On-Demand	Mild	ITGA4	44	31
CSc1nnc(SC)n1N=Cc1ccc(C(=O)NC2CC2)cc1	ZINC000872416911	EE	On-Demand	Mild	MAPK13	90	34
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cccc(F)c3)cc2)CC1	ZINC000872416927	GE	On-Demand	Anodyne	BCL2	29	46
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	DRD4	24	43
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	ACHE	19	45
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	SIGMAR1	23	55
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	SSTR5	62	36
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	CCR2	41	45
Oc1nnc(Cl)cc1NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000872416959	GH	On-Demand	Anodyne	MCHR1	39	40
c1ccc(-c2cc(NC[C@@H]3COCCO3)ncn2)cc1	ZINC000872417103	CD	On-Demand	Anodyne	TNK2	49	38
c1ccc(-c2cc(NC[C@H]3COCCO3)ncn2)cc1	ZINC000872417104	CD	On-Demand	Anodyne	TNK2	49	38
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCCC2)c1	ZINC000872417111	EH	On-Demand	Anodyne	ADORA3	42	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCCC2)c1	ZINC000872417111	EH	On-Demand	Anodyne	TYK2	50	35
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCCC2)c1	ZINC000872417111	EH	On-Demand	Anodyne	LIMK2	17	40
Cc1c(F)ncnc1NCc1cccc(NC(=O)C2CCCC2)c1	ZINC000872417111	EH	On-Demand	Anodyne	KCNK3	16	45
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C#N)cc3)cc2)CC1	ZINC000872417140	GE	On-Demand	Mild	SLC6A9	19	44
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C#N)cc3)cc2)CC1	ZINC000872417140	GE	On-Demand	Mild	IDO1	31	40
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(C#N)cc3)cc2)CC1	ZINC000872417140	GE	On-Demand	Mild	LIMK2	17	43
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	HTR1A	44	44
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	DRD2	49	46
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	DRD4	50	44
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	DRD3	69	46
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	HTR7	33	43
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	MC4R	47	39
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	KCNQ2	70	41
CCC(=O)c1c(Cl)cccc1N1CCN(C(=O)OC)CC1	ZINC000872417154	DF	On-Demand	Anodyne	NPY2R	43	38
COc1ccc(OC)c2sc(N[C@@H](C)CN3CCCC3=O)nc12	ZINC000872417177	EF	On-Demand	Anodyne	ADORA2B	16	49
COc1ccc(OC)c2sc(N[C@H](C)CN3CCCC3=O)nc12	ZINC000872417178	EF	On-Demand	Anodyne	ADORA2B	16	49
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(Cl)s3)cc2)CC1	ZINC000872417193	GF	On-Demand	Anodyne	CCR4	57	36
CCNC(=O)COc1ccc(C=Nn2c(SC)nnc2SC)cc1OC	ZINC000872417220	GE	On-Demand	Mild	ENPP1	66	34
CNC(=O)Cn1cc(Nc2nc3c(OC)ccc(OC)c3s2)cn1	ZINC000872417221	ED	On-Demand	Anodyne	PDGFRB	25	41
CNC(=O)Cn1cc(Nc2nc3c(OC)ccc(OC)c3s2)cn1	ZINC000872417221	ED	On-Demand	Anodyne	FLT4	22	41
CNC(=O)Cn1cc(Nc2nc3c(OC)ccc(OC)c3s2)cn1	ZINC000872417221	ED	On-Demand	Anodyne	ENPP1	61	32
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	ESR1	66	35
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	ESR2	47	37
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	LTA4H	57	46
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	HRH3	59	44
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	PSMB2	47	45
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872417280	GG	On-Demand	Mild	PSMB1	51	45
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3cc(F)cc(F)c3)cc2)CC1	ZINC000872417295	GE	On-Demand	Anodyne	STAT6	40	34
O=C(Nc1cccc(CNc2cc(Cl)nnc2O)c1)C1CCCC1	ZINC000872417325	EH	On-Demand	Anodyne	TYK2	45	36
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccccc3F)cc2)CC1	ZINC000872417351	GE	On-Demand	Anodyne	PRNP	42	37
CSc1nnc(SC)n1N=C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000872417373	GG	On-Demand	Mild	GPR119	23	40
CSc1nnc(SC)n1N=C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000872417374	GG	On-Demand	Mild	GPR119	23	40
CSc1nnc(SC)n1N=C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000872417375	GG	On-Demand	Mild	GPR119	23	40
CSc1nnc(SC)n1N=C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000872417376	GG	On-Demand	Mild	GPR119	23	40
COCC[C@@H](C=Nn1c(SC)nnc1SC)NC(=O)OC(C)(C)C	ZINC000872417382	GE	On-Demand	Mild	CTSK	20	55
COCC[C@H](C=Nn1c(SC)nnc1SC)NC(=O)OC(C)(C)C	ZINC000872417383	GE	On-Demand	Mild	CTSK	20	55
CSc1nnc(SC)n1N=CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872417408	FG	On-Demand	Mild	GPR119	37	45
Brc1cnc(NC[C@@H]2COCCO2)nc1NC[C@@H]1COCCO1	ZINC000872417449	GC	On-Demand	Anodyne	TNK2	19	52
Brc1cnc(NC[C@H]2COCCO2)nc1NC[C@@H]1COCCO1	ZINC000872417457	GC	On-Demand	Anodyne	TNK2	19	52
Brc1cnc(NC[C@H]2COCCO2)nc1NC[C@H]1COCCO1	ZINC000872417459	GC	On-Demand	Anodyne	TNK2	19	52
Brc1cnc(NC[C@@H]2COCCO2)nc1NC[C@H]1COCCO1	ZINC000872417461	GC	On-Demand	Anodyne	TNK2	19	52
O=C(COc1ccc(CCNc2cc(Cl)nnc2O)cc1)NC1CC1	ZINC000872417497	FE	On-Demand	Anodyne	TNKS	46	33
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000872417515	GE	On-Demand	Anodyne	SLC6A9	27	40
CC(=O)N1CCN(c2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000872417515	GE	On-Demand	Anodyne	WNT3	40	33
CCOc1cc(C=Nn2c(SC)nnc2SC)ccc1OC	ZINC000872417531	EG	On-Demand	Mild	TUBB1	37	40
CSc1nnc(SC)n1N=C[C@@H](CC(F)F)NC(=O)OC(C)(C)C	ZINC000872417555	GG	On-Demand	Mild	CTSK	19	41
CSc1nnc(SC)n1N=C[C@H](CC(F)F)NC(=O)OC(C)(C)C	ZINC000872417556	GG	On-Demand	Mild	CTSK	19	41
CSc1nnc(SC)n1N=C[C@@H](CC1CC1)NC(=O)OC(C)(C)C	ZINC000872417576	FG	On-Demand	Mild	CTSK	19	49
CSc1nnc(SC)n1N=C[C@H](CC1CC1)NC(=O)OC(C)(C)C	ZINC000872417577	FG	On-Demand	Mild	CTSK	19	49
CCc1nc([C@H]2CCCCN2c2cc(-c3ccccc3)ncn2)no1	ZINC000872417673	EH	On-Demand	Anodyne	CPT1A	81	39
CSc1nnc(SC)n1N=C[C@@H](CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000872417711	GG	On-Demand	Mild	CTSK	18	43
CSc1nnc(SC)n1N=C[C@H](CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000872417712	GG	On-Demand	Mild	CTSK	18	43
c1ccc(-c2cc(N3CCCC[C@H]3c3noc(C4CC4)n3)ncn2)cc1	ZINC000872417718	EI	On-Demand	Anodyne	CPT1A	73	48
c1ccc(-c2cc(N3CCCC[C@@H]3c3noc(C4CC4)n3)ncn2)cc1	ZINC000872417719	EI	On-Demand	Anodyne	CPT1A	73	48
CSc1nnc(SC)n1N=C[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000872417724	FG	On-Demand	Mild	CTSK	20	53
CSc1nnc(SC)n1N=C[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000872417725	FG	On-Demand	Mild	CTSK	20	53
CSc1nnc(SC)n1N=C[C@@H](CC1CCC1)NC(=O)OC(C)(C)C	ZINC000872417766	GH	On-Demand	Mild	CTSK	19	53
CSc1nnc(SC)n1N=C[C@H](CC1CCC1)NC(=O)OC(C)(C)C	ZINC000872417767	GH	On-Demand	Mild	CTSK	19	53
CSc1nnc(SC)n1N=CCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872417797	GH	On-Demand	Mild	GPR119	40	44
CSc1nnc(SC)n1N=CCc1ccc(F)cc1Cl	ZINC000872417882	EH	On-Demand	Mild	P2RX7	45	35
CCOc1cc(C=Nn2c(SC)nnc2SC)ccc1OC(=O)CC	ZINC000872417909	GG	On-Demand	Mild	AKR1C3	18	41
CSc1nnc(SC)n1N=C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872417923	FF	On-Demand	Mild	GPR119	27	41
CSc1nnc(SC)n1N=C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872417924	FF	On-Demand	Mild	GPR119	27	41
CSc1nnc(SC)n1N=C[C@H](C)NC(=O)OC(C)(C)C	ZINC000872417954	EE	On-Demand	Mild	CTSK	16	48
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCCC2)CC1	ZINC000872418085	EF	On-Demand	Anodyne	SIRT3	57	35
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCCC2)CC1	ZINC000872418085	EF	On-Demand	Anodyne	SIRT2	47	33
Cc1c(F)ncnc1N1CCN(C(=O)CCC2CCCCC2)CC1	ZINC000872418085	EF	On-Demand	Anodyne	SIRT1	40	32
COc1cccc(C[C@@H]2CCCN2c2nc(N)nc(C(F)F)n2)c1	ZINC000872418087	EF	On-Demand	Anodyne	CHRNA10	47	41
NC(=O)c1cc(N2C[C@@H]3CNC[C@H]3C2)nc(Cl)n1	ZINC000872418117	CB	On-Demand	Anodyne	CHRNA4	31	40
NC(=O)c1cc(N2C[C@@H]3CNC[C@@H]3C2)nc(Cl)n1	ZINC000872418118	CB	On-Demand	Anodyne	CHRNA4	31	40
NC(=O)c1cc(N2C[C@H]3CNC[C@@H]3C2)nc(Cl)n1	ZINC000872418119	CB	On-Demand	Anodyne	CHRNA4	31	40
CCC(=O)N1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872418122	DF	On-Demand	Anodyne	P2RY12	55	40
CN1CCN(c2ncc(C=NNc3cc(Cl)ccc3F)cn2)CC1	ZINC000872418151	EE	On-Demand	Mild	HRH4	33	42
COc1ccc(N2CCCN(c3nc(Cl)nc4c3cnn4C)CC2)cc1	ZINC000872418170	FF	On-Demand	Clean	NPBWR1	45	35
COc1ccc(N2CCCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872418174	EF	On-Demand	Clean	DRD4	40	33
c1ccc(-c2cc(NC[C@H]3CCCOC3)ncn2)cc1	ZINC000872418231	CF	On-Demand	Anodyne	TNK2	47	35
c1ccc(-c2cc(NC[C@H]3CCCOC3)ncn2)cc1	ZINC000872418231	CF	On-Demand	Anodyne	VCP	54	36
c1ccc(-c2cc(NC[C@@H]3CCCOC3)ncn2)cc1	ZINC000872418232	CF	On-Demand	Anodyne	TNK2	47	35
c1ccc(-c2cc(NC[C@@H]3CCCOC3)ncn2)cc1	ZINC000872418232	CF	On-Demand	Anodyne	VCP	54	36
Cn1ncc2c(NCCC(=O)NC3CCCCC3)nc(Cl)nc21	ZINC000872418238	EE	On-Demand	Anodyne	Q4VQ11_PIG	46	36
COc1ccc(OC)c2sc(N3C[C@@H]4CNC[C@@H]4C3)nc12	ZINC000872418241	DD	On-Demand	Anodyne	CHRNA4	31	44
COc1ccc(OC)c2sc(N3C[C@H]4CNC[C@@H]4C3)nc12	ZINC000872418242	DD	On-Demand	Anodyne	CHRNA4	31	44
COc1ccc(OC)c2sc(N3C[C@@H]4CNC[C@H]4C3)nc12	ZINC000872418243	DD	On-Demand	Anodyne	CHRNA4	31	44
Cn1ncc2c(N3CCCN(C(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872418250	FE	On-Demand	Anodyne	MTOR	15	40
CCC(=O)c1c(Cl)cccc1N1CCCN(CC(N)=O)CC1	ZINC000872418308	DD	On-Demand	Anodyne	HTR1A	41	41
CCC(=O)c1c(Cl)cccc1N1CCCN(CC(N)=O)CC1	ZINC000872418308	DD	On-Demand	Anodyne	DRD2	45	43
CCC(=O)c1c(Cl)cccc1N1CCCN(CC(N)=O)CC1	ZINC000872418308	DD	On-Demand	Anodyne	DRD4	36	43
CCC(=O)c1c(Cl)cccc1N1CCCN(CC(N)=O)CC1	ZINC000872418308	DD	On-Demand	Anodyne	DRD3	61	43
CCC(=O)c1c(Cl)cccc1N1CCCN(CC(N)=O)CC1	ZINC000872418308	DD	On-Demand	Anodyne	KCNQ2	61	36
CC(C)(C)OC(=O)N1CCCN(c2nc(N)nc(C(F)F)n2)CC1	ZINC000872418339	ED	On-Demand	Anodyne	GPR119	20	43
CCC(=O)N1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872418346	EG	On-Demand	Anodyne	GRM5	17	42
O=C(CCNc1ccnc2ncccc12)NC1CCCCC1	ZINC000872418349	CF	On-Demand	Anodyne	CNR2	17	40
O=C(CCNc1ccnc2ncccc12)NC1CCCCC1	ZINC000872418349	CF	On-Demand	Anodyne	HNMT	50	37
O=C(CCNc1ccnc2ncccc12)NC1CCCCC1	ZINC000872418349	CF	On-Demand	Anodyne	TNKS	42	37
COc1cccc(C[C@@H]2CCCN2c2cc(Cl)nnc2O)c1	ZINC000872418370	DG	On-Demand	Anodyne	CHRNA10	35	41
CCC(=O)N1CCCN(c2nc3c(OC)ccc(OC)c3s2)CC1	ZINC000872418384	EF	On-Demand	Anodyne	ADORA2B	17	43
Cc1c(F)ncnc1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	ZINC000872418399	EE	On-Demand	Clean	STAT6	57	34
Cc1c(F)ncnc1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000872418400	EE	On-Demand	Clean	STAT6	57	34
Cc1c(F)ncnc1NCCC(=O)NC1CCCCC1	ZINC000872418428	CE	On-Demand	Anodyne	EPHX2	15	40
COc1ccc(N2CCCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cc1	ZINC000872418450	FD	On-Demand	Clean	GALR2	41	32
c1ccc(N2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872418502	DG	On-Demand	Anodyne	DRD4	15	44
c1ccc(N2CCCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872418502	DG	On-Demand	Anodyne	METAP1	45	42
COc1ccc(N2CCCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872418505	DF	On-Demand	Clean	PDE2A	16	40
CC(C)(C)OC(=O)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872418557	EG	On-Demand	Anodyne	GPR119	43	47
O=C(NCCN=c1cc[nH]cc1C1CC1)c1ccccc1F	ZINC000872418594	CE	On-Demand	Anodyne	HTR1F	17	41
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)c(OC)c1	ZINC000872418598	GF	On-Demand	Anodyne	ADRA1D	15	42
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)c(OC)c1	ZINC000872418598	GF	On-Demand	Anodyne	OXTR	23	44
COc1ccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)c(OC)c1	ZINC000872418598	GF	On-Demand	Anodyne	PDGFRB	47	45
CSc1nnc(SC)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872418603	FF	On-Demand	Mild	MLYCD	18	40
CSc1nnc(SC)n1N=Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000872418603	FF	On-Demand	Mild	L3MBTL3	55	37
Cc1c(F)ncnc1N1CCC(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872418612	EH	On-Demand	Anodyne	AKT3	52	34
NC(=O)c1cc(N2CCC[C@@H]2Cc2ccc(F)cc2)nc(Cl)n1	ZINC000872418613	EF	On-Demand	Anodyne	CCR3	76	34
NC(=O)c1cc(N2CCC[C@H]2Cc2ccc(F)cc2)nc(Cl)n1	ZINC000872418615	EF	On-Demand	Anodyne	CCR3	76	34
NC(=O)c1cc(Nc2ccc(CCN3CCOCC3)cc2)nc(Cl)n1	ZINC000872418617	FD	On-Demand	Anodyne	CASR	41	35
NC(=O)c1cc(Nc2ccc(CCN3CCOCC3)cc2)nc(Cl)n1	ZINC000872418617	FD	On-Demand	Anodyne	CSF1R	21	40
NC(=O)c1cc(Nc2ccc(CCN3CCOCC3)cc2)nc(Cl)n1	ZINC000872418617	FD	On-Demand	Anodyne	STAT6	79	40
CCOC(=O)C1CCN(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)CC1	ZINC000872418632	FD	On-Demand	Anodyne	PRSS2	59	38
Oc1nnc(Cl)cc1N1C[C@@H]2CNC[C@H]2C1	ZINC000872418641	BC	On-Demand	Anodyne	CHRNA4	37	48
Oc1nnc(Cl)cc1N1C[C@@H]2CNC[C@@H]2C1	ZINC000872418642	BC	On-Demand	Anodyne	CHRNA4	37	48
Oc1nnc(Cl)cc1N1C[C@H]2CNC[C@@H]2C1	ZINC000872418643	BC	On-Demand	Anodyne	CHRNA4	37	48
NC(=O)CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872418650	DD	On-Demand	Anodyne	SLC27A1	41	35
c1ccc(-c2cc(N3C[C@@H]4CNC[C@H]4C3)ncn2)cc1	ZINC000872418655	CD	On-Demand	Anodyne	CHRNA7	15	62
c1ccc(-c2cc(N3C[C@@H]4CNC[C@H]4C3)ncn2)cc1	ZINC000872418655	CD	On-Demand	Anodyne	CHRNA4	34	50
c1ccc(-c2cc(N3C[C@@H]4CNC[C@@H]4C3)ncn2)cc1	ZINC000872418656	CD	On-Demand	Anodyne	CHRNA7	15	62
c1ccc(-c2cc(N3C[C@@H]4CNC[C@@H]4C3)ncn2)cc1	ZINC000872418656	CD	On-Demand	Anodyne	CHRNA4	34	50
c1ccc(-c2cc(N3C[C@H]4CNC[C@@H]4C3)ncn2)cc1	ZINC000872418657	CD	On-Demand	Anodyne	CHRNA7	15	62
c1ccc(-c2cc(N3C[C@H]4CNC[C@@H]4C3)ncn2)cc1	ZINC000872418657	CD	On-Demand	Anodyne	CHRNA4	34	50
CSc1nnc(SC)n1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872418665	FG	On-Demand	Mild	DRD4	30	45
CSc1nnc(SC)n1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872418665	FG	On-Demand	Mild	ACHE	39	48
CSc1nnc(SC)n1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872418665	FG	On-Demand	Mild	SIGMAR1	68	45
Cc1c(F)ncnc1N1CCCN(CC(N)=O)CC1	ZINC000872418666	CB	On-Demand	Anodyne	RPS6KB1	42	33
Cc1c(F)ncnc1N1CCCN(CC(N)=O)CC1	ZINC000872418666	CB	On-Demand	Anodyne	SIRT3	49	41
Cc1c(F)ncnc1N1CCCN(CC(N)=O)CC1	ZINC000872418666	CB	On-Demand	Anodyne	SIRT2	32	41
Cc1c(F)ncnc1N1CCCN(CC(N)=O)CC1	ZINC000872418666	CB	On-Demand	Anodyne	SIRT1	18	41
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)c(OC)c1	ZINC000872418667	FD	On-Demand	Anodyne	OXTR	17	40
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)c(OC)c1	ZINC000872418667	FD	On-Demand	Anodyne	PDGFRB	67	42
Cc1c(F)ncnc1N1CCN(CCC(C)(C)C)CC1	ZINC000872418698	CE	On-Demand	Anodyne	ABCC1	57	36
Cc1c(F)ncnc1N1CCN(CCC(C)(C)C)CC1	ZINC000872418698	CE	On-Demand	Anodyne	RPS6KB1	44	38
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872418742	GE	On-Demand	Mild	LTA4H	40	45
CSc1nnc(SC)n1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872418742	GE	On-Demand	Mild	HRH3	15	41
CC(=O)c1ccc(N(C)S(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)cc1	ZINC000872418762	GF	On-Demand	Anodyne	CYP11B2	29	42
COc1ccc(OC)c2sc(NCCS(C)(=O)=O)nc12	ZINC000872418771	DD	On-Demand	Anodyne	ADORA2B	15	41
CC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000872418774	FG	On-Demand	Anodyne	COLA	24	40
CC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000872418774	FG	On-Demand	Anodyne	CA12	15	52
CC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000872418774	FG	On-Demand	Anodyne	P96878_MYCTU	42	50
Cn1ncc2c(NCc3ccccc3N3CCCC3)nc(Cl)nc21	ZINC000872418775	EG	On-Demand	Anodyne	KCNQ2	40	38
O=S(=O)(Nc1cccc2cnccc12)C1=CCCCC1	ZINC000872418776	CG	On-Demand	Anodyne	TRPV1	17	40
Cc1noc(C2CCN(c3cc(-c4cccc(Cl)c4)ncn3)CC2)n1	ZINC000872418778	FH	On-Demand	Anodyne	GRM5	19	41
N#Cc1ccc(N2CCN(c3nc(Cl)nc4sccc34)CC2)nc1	ZINC000872418787	FF	On-Demand	Mild	SMO	16	48
Cc1c(F)ncnc1N1CCN(c2ccc(C#N)cn2)CC1	ZINC000872418803	CD	On-Demand	Mild	SMO	15	49
Oc1nnc(Cl)cc1NCc1ccccc1N1CCCC1	ZINC000872418850	DG	On-Demand	Anodyne	KCNQ2	74	45
Oc1nnc(Cl)cc1NCc1ccccc1N1CCCC1	ZINC000872418850	DG	On-Demand	Anodyne	SCN2A	18	43
Oc1nnc(Cl)cc1NCc1ccccc1N1CCCC1	ZINC000872418850	DG	On-Demand	Anodyne	SCN10A	15	43
COCCNC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)c1	ZINC000872418851	GE	On-Demand	Anodyne	DRD4	41	31
COc1ccc(C(=O)N2CCN(c3cc(C)nc4c3cnn4C)CC2)c(OC)c1	ZINC000872418867	GE	On-Demand	Anodyne	OXTR	19	41
COc1ccc(C(=O)N2CCN(c3cc(C)nc4c3cnn4C)CC2)c(OC)c1	ZINC000872418867	GE	On-Demand	Anodyne	CCKAR	19	42
Cn1ncc2c(N3CCN(c4ccc(C#N)cn4)CC3)nc(Cl)nc21	ZINC000872418883	FD	On-Demand	Mild	SMO	16	48
c1ccc(N2CCCC2)c(CNc2ccnc3ncccc23)c1	ZINC000872418893	DH	On-Demand	Anodyne	KCNQ2	57	38
c1ccc(N2CCCC2)c(CNc2ccnc3ncccc23)c1	ZINC000872418893	DH	On-Demand	Anodyne	HNMT	55	41
COc1ccnc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)n1	ZINC000872418894	EE	On-Demand	Anodyne	HRH4	15	61
COc1ccnc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)n1	ZINC000872418894	EE	On-Demand	Anodyne	SORD	60	49
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)c(OC)c1	ZINC000872418902	GD	On-Demand	Anodyne	OXTR	20	43
COc1ccc(C(=O)N2CCN(c3cc(Cl)nnc3O)CC2)c(OC)c1	ZINC000872418902	GD	On-Demand	Anodyne	NPY2R	22	42
CCN(C)C(=O)c1cccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)c1	ZINC000872418911	FF	On-Demand	Anodyne	LIMK2	19	48
CC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(OC3CC3)cc2)cc1	ZINC000872418923	EG	On-Demand	Anodyne	PRSS2	67	39
CN(C)CC(C)(C)CNC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872418935	FF	On-Demand	Anodyne	TBK1	47	35
Cc1c(F)ncnc1NCc1ccccc1N1CCCC1	ZINC000872418957	CG	On-Demand	Anodyne	KCNQ2	60	36
NC(=O)c1cc(NCc2ccccc2N2CCCC2)nc(Cl)n1	ZINC000872418958	EE	On-Demand	Anodyne	KCNQ2	70	44
NC(=O)c1cc(NCc2ccccc2N2CCCC2)nc(Cl)n1	ZINC000872418958	EE	On-Demand	Anodyne	SCN2A	18	44
NC(=O)c1cc(NCc2ccccc2N2CCCC2)nc(Cl)n1	ZINC000872418958	EE	On-Demand	Anodyne	SCN10A	15	44
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	MMP13	32	43
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	ADAM17	18	43
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	MMP2	17	40
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	MMP3	17	40
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	MMP9	31	43
COCCOc1ccc(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)cc1	ZINC000872419007	FF	On-Demand	Anodyne	MMP1	20	40
CN(C)CC(C)(C)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872419011	GG	On-Demand	Anodyne	KCNA3	18	41
Nc1nc(NCc2ccccc2N2CCCC2)nc(C(F)F)n1	ZINC000872419027	DF	On-Demand	Anodyne	KCNQ2	66	38
CCOC(=O)N1CCN(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)CC1	ZINC000872419038	FD	On-Demand	Anodyne	PRSS2	58	37
CCOC(=O)N1CCN(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)CC1	ZINC000872419038	FD	On-Demand	Anodyne	TGM2	25	42
CCOC(=O)N1CCN(S(=O)(=O)N(C)c2ccc(C(C)=O)cc2)CC1	ZINC000872419038	FD	On-Demand	Anodyne	F13A1	33	42
COCCOc1ccccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872419070	EE	On-Demand	Anodyne	DHFR	21	41
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCCC2)cc1	ZINC000872419076	EH	On-Demand	Anodyne	HRH3	17	44
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCCC2)cc1	ZINC000872419076	EH	On-Demand	Anodyne	SIGMAR1	17	44
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCCC2)cc1	ZINC000872419076	EH	On-Demand	Anodyne	SPHK2	41	35
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCCC2)cc1	ZINC000872419076	EH	On-Demand	Anodyne	HNMT	60	40
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)c1cc(Cl)nnc1O	ZINC000872419086	GF	On-Demand	Anodyne	CDK4	18	40
CN(C[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1cc(Cl)nnc1O	ZINC000872419087	GF	On-Demand	Anodyne	CDK4	18	40
CC(=O)c1ccc(N(C)S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1	ZINC000872419093	FF	On-Demand	Anodyne	PKM	17	40
CO[C@@H](CS(=O)(=O)N(C)c1ccc(C(C)=O)cc1)c1ccc(F)cc1	ZINC000872419100	FG	On-Demand	Anodyne	LEF	28	41
Cc1c(F)ncnc1N1CCC(C(=O)NCC(C)(C)CN(C)C)CC1	ZINC000872419113	FD	On-Demand	Anodyne	SIRT3	46	36
CC(=O)c1ccc(N(C)S(=O)(=O)N2CCc3ccccc3C2)cc1	ZINC000872419155	EF	On-Demand	Anodyne	AKR1C3	64	52
COc1ccc(OC)c2sc(NCCn3cccn3)nc12	ZINC000872419196	DF	On-Demand	Anodyne	ADORA2B	15	42
O=C(c1c(Cl)cccc1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872419206	GG	On-Demand	Anodyne	P2RX7	15	42
CCOC(=O)N1CCN(S(=O)(=O)Nc2cccc3cnccc23)CC1	ZINC000872419209	FD	On-Demand	Anodyne	P2RY12	61	40
CCOC(=O)N1CCN(S(=O)(=O)Nc2cccc3cnccc23)CC1	ZINC000872419209	FD	On-Demand	Anodyne	TRPV1	18	46
CCOC(=O)N1CCN(S(=O)(=O)Nc2cccc3cnccc23)CC1	ZINC000872419209	FD	On-Demand	Anodyne	TGM2	46	44
CCOC(=O)N1CCN(S(=O)(=O)Nc2cccc3cnccc23)CC1	ZINC000872419209	FD	On-Demand	Anodyne	F13A1	59	44
CCOC(=O)C1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872419213	CE	On-Demand	Anodyne	CD38	56	33
CC(CCc1ccccc1)=NNc1cc(C)nc(N)n1	ZINC000872419218	CF	On-Demand	Mild	PPO2	30	40
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)cc1	ZINC000872419234	DE	On-Demand	Clean	EPHB4	46	33
Oc1nnc(Cl)cc1NCc1ccc(N2CCOCC2)cc1	ZINC000872419234	DE	On-Demand	Clean	STAT6	77	43
CN(C[C@H]1CCCCO1)c1nc(N)nc(C(F)F)n1	ZINC000872419294	CD	On-Demand	Anodyne	PDE8B	43	34
CN(C[C@@H]1CCCCO1)c1nc(N)nc(C(F)F)n1	ZINC000872419295	CD	On-Demand	Anodyne	PDE8B	43	34
NC(=O)c1cc(NC[C@@]2(N3CCOCC3)CCSC2)nc(Cl)n1	ZINC000872419304	FC	On-Demand	Anodyne	STAT6	47	34
NC(=O)c1cc(NC[C@]2(N3CCOCC3)CCSC2)nc(Cl)n1	ZINC000872419305	FC	On-Demand	Anodyne	STAT6	47	34
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000872419340	EG	On-Demand	Anodyne	CDC7	34	42
c1cnc2nccc(NCc3ccc(N4CCOCC4)cc3)c2c1	ZINC000872419362	DG	On-Demand	Clean	EPHB4	53	32
c1cnc2nccc(NCc3ccc(N4CCOCC4)cc3)c2c1	ZINC000872419362	DG	On-Demand	Clean	STAT6	67	40
CCN1CCC[C@@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872419364	CD	On-Demand	Anodyne	Q4VQ11_PIG	48	33
CCN1CCC[C@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872419365	CD	On-Demand	Anodyne	Q4VQ11_PIG	48	33
CCN1CCC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872419366	CD	On-Demand	Anodyne	PRKD1	40	38
CCN1CCC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872419367	CD	On-Demand	Anodyne	PRKD1	40	38
CS(=O)(=O)N1CCN(CCNc2cc(Cl)nnc2O)CC1	ZINC000872419396	EB	On-Demand	Anodyne	HRP1_PLAFA	58	35
COC(=O)c1c(NS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)ccc(C)c1C	ZINC000872419477	GE	On-Demand	Anodyne	FPR1	15	40
COC(=O)c1c(NS(=O)(=O)c2cnn([C@H]3CCOC3)c2)ccc(C)c1C	ZINC000872419478	GE	On-Demand	Anodyne	FPR1	15	40
Cc1c(F)ncnc1NCc1ccc(N2CCOCC2)cc1	ZINC000872419515	DE	On-Demand	Clean	EPHB4	56	35
Cc1c(F)ncnc1NCc1ccc(N2CCOCC2)cc1	ZINC000872419515	DE	On-Demand	Clean	STAT6	73	46
Cn1ncc2c(NCc3ccc(N4CCOCC4)cc3)nc(Cl)nc21	ZINC000872419536	FE	On-Demand	Clean	ABL1	15	44
Cn1ncc2c(NCc3ccc(N4CCOCC4)cc3)nc(Cl)nc21	ZINC000872419536	FE	On-Demand	Clean	STAT6	68	40
CCOc1ccccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872419549	CE	On-Demand	Anodyne	DHFR	24	41
CS(=O)(=O)N1CCN(CCNc2ccnc3ncccc23)CC1	ZINC000872419588	EC	On-Demand	Anodyne	HRP1_PLAFA	90	40
CS(=O)(=O)N1CCN(CCNc2ccnc3ncccc23)CC1	ZINC000872419588	EC	On-Demand	Anodyne	HNMT	79	49
c1cnc2nccc(NCCN3CCc4sccc4C3)c2c1	ZINC000872419647	DG	On-Demand	Anodyne	HRP1_PLAFA	54	33
c1cnc2nccc(NCCN3CCc4sccc4C3)c2c1	ZINC000872419647	DG	On-Demand	Anodyne	HNMT	61	48
CCOc1ccc(C=NNc2cc(C)nc(N)n2)cc1OC	ZINC000872419652	DE	On-Demand	Mild	DHFR	15	41
CCOc1ccc(C=NNc2cc(C)nc(N)n2)cc1OC	ZINC000872419652	DE	On-Demand	Mild	AGPAT2	59	39
COC(=O)c1c(NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)ccc(C)c1C	ZINC000872419661	GF	On-Demand	Anodyne	PRTN3	50	31
COC(=O)c1c(NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)ccc(C)c1C	ZINC000872419661	GF	On-Demand	Anodyne	LIMK2	31	45
C[C@@H](CNc1cccc(Cl)c1C(N)=O)COCc1ccccc1	ZINC000872419699	EH	On-Demand	Anodyne	CAPN2	41	34
Nc1nc(NCc2ccc(N3CCOCC3)cc2)nc(C(F)F)n1	ZINC000872419724	ED	On-Demand	Clean	STAT6	72	44
C[C@H](O)c1ccc(CNc2nc(Cl)nc3c2cnn3C)cc1	ZINC000872419745	DF	On-Demand	Anodyne	ABL1	21	42
CC(C)(C)OC(=O)NC[C@@H]1CCN(S(=O)(=O)N2CCCC2)c2ccccc21	ZINC000872419853	GF	On-Demand	Anodyne	SFRP1	55	33
CC(C)(C)OC(=O)NC[C@@H]1CCN(S(=O)(=O)N2CCCC2)c2ccccc21	ZINC000872419853	GF	On-Demand	Anodyne	WNT3	46	33
CC(C)(C)OC(=O)NC[C@H]1CCN(S(=O)(=O)N2CCCC2)c2ccccc21	ZINC000872419854	GF	On-Demand	Anodyne	SFRP1	55	33
CC(C)(C)OC(=O)NC[C@H]1CCN(S(=O)(=O)N2CCCC2)c2ccccc21	ZINC000872419854	GF	On-Demand	Anodyne	WNT3	46	33
NC(=O)c1cc(NCc2ccc(N3CCOCC3)cc2)nc(Cl)n1	ZINC000872419860	ED	On-Demand	Clean	STAT6	84	47
c1ccc(-c2cc(N3CCN(Cc4cscn4)CC3)ncn2)cc1	ZINC000872419907	EF	On-Demand	Anodyne	DRD4	18	40
c1ccc(-c2cc(N3CCN(Cc4cscn4)CC3)ncn2)cc1	ZINC000872419907	EF	On-Demand	Anodyne	SCN5A	46	41
CC(CCc1ccc(O)cc1)=NNc1cc(C)nc(N)n1	ZINC000872419908	CE	On-Demand	Mild	PPO2	31	49
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCCOCC1	ZINC000872419928	ED	On-Demand	Anodyne	TLR4	16	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn(C2CCOCC2)c1	ZINC000872419929	GE	On-Demand	Anodyne	TLR4	17	44
CCOc1cc(C=NNc2cc(C)nc(N)n2)ccc1OC	ZINC000872419934	DE	On-Demand	Mild	AGPAT2	59	39
CCOc1cc(C=NNc2cc(C)nc(N)n2)ccc1OC	ZINC000872419934	DE	On-Demand	Mild	DRTS_TRYCR	57	37
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn(CC)c1	ZINC000872419935	EE	On-Demand	Anodyne	TLR4	15	41
Nc1nc(C(F)F)nc(N2CCN(Cc3cscn3)CC2)n1	ZINC000872419936	ED	On-Demand	Anodyne	SCN5A	40	32
C=C(C)CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCC	ZINC000872419943	DE	On-Demand	Mild	TLR4	15	42
O=C(c1cccc(Cl)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872419944	FH	On-Demand	Anodyne	NPY2R	23	40
O=C(c1cccc(Cl)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872419944	FH	On-Demand	Anodyne	GRM5	15	41
O=C(c1cccc(Cl)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872419944	FH	On-Demand	Anodyne	PARP1	16	41
O=C(c1cccc(Cl)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872419944	FH	On-Demand	Anodyne	SMO	18	41
O=C(c1cccc(Cl)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872419944	FH	On-Demand	Anodyne	HPGD	25	42
O=C(Nc1ccccc1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872419957	EH	On-Demand	Anodyne	CHRNA7	28	46
O=C(Nc1ccccc1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872419957	EH	On-Demand	Anodyne	CCKBR	44	38
O=C(Nc1ccccc1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872419957	EH	On-Demand	Anodyne	EPHX2	44	44
O=C(Nc1ccccc1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872419957	EH	On-Demand	Anodyne	ACHP_LYMST	18	46
Cn1ncc2c(N3CCC(NC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872419971	GF	On-Demand	Anodyne	PIK3CA	32	49
Cn1ncc2c(N3CCC(NC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872419971	GF	On-Demand	Anodyne	MTOR	84	43
Cn1ncc2c(N3CCC(NC(=O)Nc4ccccc4)CC3)nc(Cl)nc21	ZINC000872419971	GF	On-Demand	Anodyne	EPHX2	42	39
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1c(C)nn(C)c1Cl	ZINC000872419973	GE	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1ccnn1CC	ZINC000872419976	EE	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCCC1	ZINC000872419978	DD	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCCC1	ZINC000872419978	DD	On-Demand	Anodyne	TLR4	20	47
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N(C)C	ZINC000872419979	CD	On-Demand	Anodyne	TLR4	17	47
NC(=O)c1cc(N2CCC(COc3ccccc3)CC2)nc(Cl)n1	ZINC000872419989	EF	On-Demand	Anodyne	P2RY12	46	35
NC(=O)c1cc(N2CCC(COc3ccccc3)CC2)nc(Cl)n1	ZINC000872419989	EF	On-Demand	Anodyne	GRIN2B	22	42
NC(=O)c1cc(N2CCC(COc3ccccc3)CC2)nc(Cl)n1	ZINC000872419989	EF	On-Demand	Anodyne	CHEK2	28	43
NC(=O)c1cc(N2CCC(COc3ccccc3)CC2)nc(Cl)n1	ZINC000872419989	EF	On-Demand	Anodyne	CPT1A	59	35
NC(=O)c1cc(N2CCC(COc3ccccc3)CC2)nc(Cl)n1	ZINC000872419989	EF	On-Demand	Anodyne	SCD1	18	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H](CC)OC	ZINC000872420001	EE	On-Demand	Anodyne	TLR4	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H](CC)OC	ZINC000872420002	EE	On-Demand	Anodyne	TLR4	15	40
CCC(=NNc1cc(C)nc(N)n1)c1ccc(OC)c(OC)c1	ZINC000872420007	DF	On-Demand	Mild	ENPP1	42	38
CCC(=NNc1cc(C)nc(N)n1)c1ccc(OC)c(OC)c1	ZINC000872420007	DF	On-Demand	Mild	DRTS_TRYCR	57	35
O=C(NC1CCCCC1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872420009	FE	On-Demand	Anodyne	EPHX2	29	43
CC(=NNc1cc(C)nc(N)n1)c1ccc(OCCN(C)C)cc1	ZINC000872420010	EE	On-Demand	Mild	ESRRG	46	37
Cc1c(F)ncnc1N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000872420014	FD	On-Demand	Anodyne	GCK	42	36
O=C(c1cccc(Cl)c1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872420024	FF	On-Demand	Anodyne	HPGD	20	41
Cc1c(F)ncnc1N[C@H](C)C(=O)NCc1ccccc1	ZINC000872420032	CE	On-Demand	Anodyne	ANPEP	25	42
Cc1c(F)ncnc1N[C@H](C)C(=O)NCc1ccccc1	ZINC000872420032	CE	On-Demand	Anodyne	AMP1_PLAFQ	52	42
Cc1c(F)ncnc1N[C@H](C)C(=O)NCc1ccccc1	ZINC000872420032	CE	On-Demand	Anodyne	CARM1	48	36
Cc1c(F)ncnc1N[C@H](C)C(=O)NCc1ccccc1	ZINC000872420032	CE	On-Demand	Anodyne	PDS	52	35
Cc1c(F)ncnc1N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872420033	CE	On-Demand	Anodyne	ANPEP	25	42
Cc1c(F)ncnc1N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872420033	CE	On-Demand	Anodyne	AMP1_PLAFQ	52	42
Cc1c(F)ncnc1N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872420033	CE	On-Demand	Anodyne	CARM1	48	36
Cc1c(F)ncnc1N[C@@H](C)C(=O)NCc1ccccc1	ZINC000872420033	CE	On-Demand	Anodyne	PDS	52	35
O=C(c1ccc(Cl)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872420042	FF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1ccc(Cl)cc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872420042	FF	On-Demand	Anodyne	HPGD	20	40
O=S(=O)(c1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872420050	FF	On-Demand	Anodyne	METAP1	21	47
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CC1(OC)CCOCC1	ZINC000872420051	GD	On-Demand	Anodyne	TLR4	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H](OC)C1CCOCC1	ZINC000872420084	GE	On-Demand	Anodyne	TLR4	15	42
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H](OC)C1CCOCC1	ZINC000872420085	GE	On-Demand	Anodyne	TLR4	15	42
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N(C)CCOC	ZINC000872420102	ED	On-Demand	Anodyne	TLR4	15	42
Cc1c(F)ncnc1N1CCN(Cc2cscn2)CC1	ZINC000872420103	CD	On-Demand	Anodyne	SCN5A	45	37
COc1ccc2[nH]cc(C3CCN(c4nc(N)nc(C(F)F)n4)CC3)c2c1	ZINC000872420111	FG	On-Demand	Anodyne	HTR1D	20	44
COc1ccc2[nH]cc(C3CCN(c4nc(N)nc(C(F)F)n4)CC3)c2c1	ZINC000872420111	FG	On-Demand	Anodyne	HTR1B	18	44
COc1ccc2[nH]cc(C3CCN(c4nc(N)nc(C(F)F)n4)CC3)c2c1	ZINC000872420111	FG	On-Demand	Anodyne	HTR1F	44	37
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCC(C)(C)C#N	ZINC000872420113	EF	On-Demand	Mild	P2RY12	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N(C)CC	ZINC000872420122	DD	On-Demand	Anodyne	TLR4	17	45
O=C(NC1CCCCC1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420125	FG	On-Demand	Anodyne	CNR1	16	44
O=C(NC1CCCCC1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420125	FG	On-Demand	Anodyne	CNR2	17	44
O=C(NC1CCCCC1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420125	FG	On-Demand	Anodyne	PRKD1	44	36
O=C(NC1CCCCC1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420125	FG	On-Demand	Anodyne	EPHX2	42	54
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCOCC1CC1	ZINC000872420129	EE	On-Demand	Anodyne	TLR4	16	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCC(OC)CC1	ZINC000872420153	FD	On-Demand	Anodyne	P2RY12	20	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCC(OC)CC1	ZINC000872420153	FD	On-Demand	Anodyne	TLR4	17	46
COc1ccc2[nH]cc(C3CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872420154	EH	On-Demand	Anodyne	HTR1A	16	47
COc1ccc2[nH]cc(C3CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872420154	EH	On-Demand	Anodyne	HTR1D	21	41
COc1ccc2[nH]cc(C3CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872420154	EH	On-Demand	Anodyne	HTR1B	18	41
COc1ccc2[nH]cc(C3CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872420154	EH	On-Demand	Anodyne	HTR1F	42	39
COc1ccc2[nH]cc(C3CCN(c4ncnc(F)c4C)CC3)c2c1	ZINC000872420154	EH	On-Demand	Anodyne	PDE3B	43	38
CCCN(C)S(=O)(=O)Nc1ccc(F)cc1C(=O)OCC	ZINC000872420157	DE	On-Demand	Anodyne	TLR4	16	44
O=C(Nc1ccccc1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872420158	EF	On-Demand	Anodyne	NPY2R	35	40
O=C(Nc1ccccc1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872420158	EF	On-Demand	Anodyne	CCKBR	54	39
O=C(Nc1ccccc1)NC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872420158	EF	On-Demand	Anodyne	EPHX2	46	44
c1csc(CCN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872420159	DG	On-Demand	Anodyne	DRD2	22	42
c1csc(CCN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872420159	DG	On-Demand	Anodyne	DRD4	21	42
c1csc(CCN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872420159	DG	On-Demand	Anodyne	DRD3	15	42
O=C(Nc1ccccc1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420164	EG	On-Demand	Anodyne	PPIA	34	40
O=C(Nc1ccccc1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420164	EG	On-Demand	Anodyne	CHRNA7	18	42
O=C(Nc1ccccc1)NC1CCN(c2ccnc3ncccc23)CC1	ZINC000872420164	EG	On-Demand	Anodyne	EPHX2	47	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cn(C)c(C)n1	ZINC000872420193	ED	On-Demand	Anodyne	TLR4	15	41
CC(=O)NCC1CCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872420204	DF	On-Demand	Anodyne	CACNA1I	70	39
O=C(NCCO)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420208	ED	On-Demand	Anodyne	PRKD1	18	41
O=C(NCCO)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420208	ED	On-Demand	Anodyne	GSK3A	25	41
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccsc2)CC1	ZINC000872420262	DE	On-Demand	Anodyne	MAPK13	68	35
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccsc2)CC1	ZINC000872420262	DE	On-Demand	Anodyne	SIRT3	63	33
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccsc2)CC1	ZINC000872420262	DE	On-Demand	Anodyne	SIRT2	67	33
Cc1c(F)ncnc1N1CCC(NC(=O)c2ccsc2)CC1	ZINC000872420262	DE	On-Demand	Anodyne	SIRT1	56	33
Nc1nc(NCCCCCCCN2CCCC2)nc(C(F)F)n1	ZINC000872420272	EF	On-Demand	Anodyne	HNMT	63	39
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H](C)OC	ZINC000872420285	DD	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H](C)OC	ZINC000872420287	DD	On-Demand	Anodyne	TLR4	15	41
c1cnc2nccc(N3CCN(Cc4cscn4)CC3)c2c1	ZINC000872420306	DE	On-Demand	Anodyne	SCN5A	43	35
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn([C@@H]2CCOC2)c1	ZINC000872420309	GD	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn([C@H]2CCOC2)c1	ZINC000872420310	GD	On-Demand	Anodyne	TLR4	15	41
Cc1c(F)ncnc1N1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000872420312	EF	On-Demand	Anodyne	EPHX2	39	47
Cc1c(F)ncnc1N1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000872420312	EF	On-Demand	Anodyne	SIRT3	57	33
Cc1c(F)ncnc1N1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000872420312	EF	On-Demand	Anodyne	SIRT2	47	32
Cc1c(F)ncnc1N1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000872420312	EF	On-Demand	Anodyne	SIRT1	40	32
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1c(C)cnn1C	ZINC000872420324	ED	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H]1CCCOC1	ZINC000872420335	EE	On-Demand	Anodyne	TLR4	16	43
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H]1CCCOC1	ZINC000872420336	EE	On-Demand	Anodyne	TLR4	16	43
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H](OC)C(C)C	ZINC000872420343	EE	On-Demand	Anodyne	TLR4	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H](OC)C(C)C	ZINC000872420344	EE	On-Demand	Anodyne	TLR4	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnc(C)n1C	ZINC000872420345	ED	On-Demand	Anodyne	TLR4	15	41
c1cc(N2CCN(Cc3cscn3)CC2)c(C2CC2)cn1	ZINC000872420364	DF	On-Demand	Anodyne	SCN5A	43	36
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn(C)c1C	ZINC000872420367	ED	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N(C)C(C)C	ZINC000872420368	DD	On-Demand	Anodyne	TLR4	16	44
CCOc1ccccc1C(C)=NNc1cc(C)nc(N)n1	ZINC000872420386	CF	On-Demand	Mild	AGPAT2	47	40
CC(=O)NCC1CCN(c2nc(Cl)nc3c2cnn3C)CC1	ZINC000872420421	DD	On-Demand	Anodyne	CACNA1I	56	36
COc1ccc(OC)c2sc(N3CCC(CNC(C)=O)CC3)nc12	ZINC000872420427	EF	On-Demand	Anodyne	MTNR1A	31	42
COc1ccc(OC)c2sc(N3CCC(CNC(C)=O)CC3)nc12	ZINC000872420427	EF	On-Demand	Anodyne	MTNR1B	29	42
COc1ccc(OC)c2sc(N3CCC(CNC(C)=O)CC3)nc12	ZINC000872420427	EF	On-Demand	Anodyne	SIRT3	43	36
COc1ccc(OC)c2sc(N3CCC(CNC(C)=O)CC3)nc12	ZINC000872420427	EF	On-Demand	Anodyne	SIRT1	40	33
Cc1c(F)ncnc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000872420439	CD	On-Demand	Anodyne	ADRB2	36	44
Cc1c(F)ncnc1NC[C@H](O)COc1ccc(F)cc1	ZINC000872420440	CD	On-Demand	Anodyne	ADRB2	36	44
CC(C)c1ccc(CNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872420444	CG	On-Demand	Anodyne	TPH1	48	37
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	P2RY12	74	37
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	CACNA1I	59	33
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	SIRT3	62	38
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	SIRT2	52	32
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	SIRT1	51	31
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	DGAT1	25	40
CC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872420453	DE	On-Demand	Anodyne	VCP	58	43
O=C(NCCO)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872420472	ED	On-Demand	Anodyne	PRKD1	22	43
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	AVPR1B	42	38
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	PDE4D	15	40
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	GRM5	16	42
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	CACNA1I	58	41
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	SIRT3	57	37
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	SIRT2	52	33
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	SIRT1	51	33
CC(=O)NCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420490	EG	On-Demand	Anodyne	VCP	27	43
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)c1ccsc1	ZINC000872420491	FH	On-Demand	Anodyne	HPGDS	38	43
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872420502	EF	On-Demand	Anodyne	AKT3	49	37
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872420502	EF	On-Demand	Anodyne	AKT1	40	41
Cc1c(F)ncnc1N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000872420502	EF	On-Demand	Anodyne	HPGD	39	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000872420504	FE	On-Demand	Anodyne	TLR4	16	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCCCF	ZINC000872420508	DE	On-Demand	Anodyne	TLR4	15	42
COc1ccc2[nH]cc(C3CCN(c4cc(Cl)nnc4O)CC3)c2c1	ZINC000872420512	FH	On-Demand	Anodyne	HTR1A	16	51
COc1ccc2[nH]cc(C3CCN(c4cc(Cl)nnc4O)CC3)c2c1	ZINC000872420512	FH	On-Demand	Anodyne	HTR1D	26	46
COc1ccc2[nH]cc(C3CCN(c4cc(Cl)nnc4O)CC3)c2c1	ZINC000872420512	FH	On-Demand	Anodyne	HTR1B	22	46
COc1ccc2[nH]cc(C3CCN(c4cc(Cl)nnc4O)CC3)c2c1	ZINC000872420512	FH	On-Demand	Anodyne	HTR1F	50	39
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCC(=O)OC	ZINC000872420514	ED	On-Demand	Anodyne	TLR4	18	42
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCC1	ZINC000872420517	DD	On-Demand	Anodyne	TLR4	20	47
Cc1c(F)ncnc1N1CCC(COc2ccccc2)CC1	ZINC000872420523	DG	On-Demand	Anodyne	SIGMAR1	17	49
Cc1c(F)ncnc1N1CCC(COc2ccccc2)CC1	ZINC000872420523	DG	On-Demand	Anodyne	CHRNA10	69	41
CC(CCc1ccc(OC(F)F)cc1)=NNc1cc(C)nc(N)n1	ZINC000872420525	EG	On-Demand	Mild	PPO2	34	43
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H]1CCCO1	ZINC000872420526	ED	On-Demand	Anodyne	TLR4	17	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H]1CCCO1	ZINC000872420527	ED	On-Demand	Anodyne	TLR4	17	44
C[C@H](N=c1cc[nH]cc1C1CC1)C(=O)NCc1ccccc1	ZINC000872420532	CE	On-Demand	Anodyne	PDS	45	34
Cc1c(F)ncnc1N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872420533	EF	On-Demand	Anodyne	NPY2R	20	40
Cc1c(F)ncnc1N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872420533	EF	On-Demand	Anodyne	GRM5	18	42
Cc1c(F)ncnc1N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000872420533	EF	On-Demand	Anodyne	HPGD	46	43
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000872420543	GF	On-Demand	Anodyne	P2RY12	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N1CCOCC1	ZINC000872420556	EC	On-Demand	Anodyne	TLR4	17	45
C[C@H](O)c1ccc(CNc2nc(N)nc(C(F)F)n2)cc1	ZINC000872420563	CE	On-Demand	Anodyne	TPH1	47	39
NC(=O)c1cc(NCC2(c3ccc(F)cc3)CCOCC2)nc(Cl)n1	ZINC000872420573	FF	On-Demand	Anodyne	STAT6	44	33
Cn1ncc2c(N3CCN(Cc4cscn4)CC3)nc(Cl)nc21	ZINC000872420574	ED	On-Demand	Anodyne	SCN5A	40	33
Oc1nnc(Cl)cc1N1CCC(COc2ccccc2)CC1	ZINC000872420575	DG	On-Demand	Anodyne	SIGMAR1	15	48
Oc1nnc(Cl)cc1N1CCC(COc2ccccc2)CC1	ZINC000872420575	DG	On-Demand	Anodyne	CHEK2	21	40
Oc1nnc(Cl)cc1N1CCC(COc2ccccc2)CC1	ZINC000872420575	DG	On-Demand	Anodyne	CPT1A	30	42
Oc1nnc(Cl)cc1N1CCC(COc2ccccc2)CC1	ZINC000872420575	DG	On-Demand	Anodyne	CHRNA10	51	37
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCOC(C)C	ZINC000872420580	EE	On-Demand	Anodyne	TLR4	15	40
Cc1c(F)ncnc1N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872420608	EF	On-Demand	Anodyne	CCR3	19	42
Cc1c(F)ncnc1N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872420608	EF	On-Demand	Anodyne	EPHX2	49	43
Cc1c(F)ncnc1N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872420608	EF	On-Demand	Anodyne	SIRT3	47	30
Cc1c(F)ncnc1N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872420608	EF	On-Demand	Anodyne	SIRT2	43	29
Cc1c(F)ncnc1N1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000872420608	EF	On-Demand	Anodyne	LIMK2	49	49
O=C(NCCO)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872420609	CD	On-Demand	Anodyne	PRKD1	22	44
O=C(NCCO)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872420609	CD	On-Demand	Anodyne	TBK1	55	37
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)N(C)CC1CC1	ZINC000872420617	EE	On-Demand	Anodyne	TLR4	18	48
Cn1ncc2c(N3CCC(C(=O)NCCO)CC3)nc(Cl)nc21	ZINC000872420643	EC	On-Demand	Anodyne	PRKD1	19	41
COc1cc2c(cc1OC)CCN(c1ncnc(F)c1C)CC2	ZINC000872420649	DF	On-Demand	Anodyne	PDE3A	51	36
COc1cc2c(cc1OC)CCN(c1ncnc(F)c1C)CC2	ZINC000872420649	DF	On-Demand	Anodyne	PDE3B	43	36
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCCO)CC1	ZINC000872420653	EE	On-Demand	Anodyne	DRD2	22	42
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCCO)CC1	ZINC000872420653	EE	On-Demand	Anodyne	DRD3	45	42
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCCO)CC1	ZINC000872420653	EE	On-Demand	Anodyne	KCNQ2	42	36
CCC(=O)c1c(Cl)cccc1N1CCC(C(=O)NCCO)CC1	ZINC000872420653	EE	On-Demand	Anodyne	EPHX2	23	41
CC(=O)NCC1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872420660	DD	On-Demand	Anodyne	CACNA1I	44	31
Oc1nnc(Cl)cc1NCCCCCCCN1CCCC1	ZINC000872420669	DG	On-Demand	Anodyne	HRP1_PLAFA	82	38
Oc1nnc(Cl)cc1NCCCCCCCN1CCCC1	ZINC000872420669	DG	On-Demand	Anodyne	HNMT	91	52
O=C(NCCO)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420678	FE	On-Demand	Anodyne	PRKD1	18	40
O=C(NCCO)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420678	FE	On-Demand	Anodyne	GRM5	15	42
O=C(NCCO)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872420678	FE	On-Demand	Anodyne	PTGES	20	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CC(C)(C)OC	ZINC000872420704	EE	On-Demand	Anodyne	TLR4	15	41
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CC1(OC)CCC1	ZINC000872420709	EE	On-Demand	Anodyne	TLR4	15	41
O=C(NC1CCCCC1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872420712	EH	On-Demand	Anodyne	C3AR1	42	40
O=C(NC1CCCCC1)NC1CCN(c2ccncc2C2CC2)CC1	ZINC000872420712	EH	On-Demand	Anodyne	EPHX2	37	47
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H]1CCCCO1	ZINC000872420719	EE	On-Demand	Anodyne	TLR4	17	45
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H]1CCCCO1	ZINC000872420720	EE	On-Demand	Anodyne	TLR4	17	45
Cc1c(F)ncnc1N1CCN(CCc2cccs2)CC1	ZINC000872420729	DE	On-Demand	Anodyne	ABCC1	93	38
Cc1c(F)ncnc1N1CCN(CCc2cccs2)CC1	ZINC000872420729	DE	On-Demand	Anodyne	ABCB1A	47	36
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnn(C(C)C)c1	ZINC000872420734	FF	On-Demand	Anodyne	TLR4	15	40
CCCCCN1C(=O)C(=NNc2cc(C)nc(N)n2)c2ccccc21	ZINC000872420737	EF	On-Demand	Mild	ALDH1A1	24	47
CCCCCN1C(=O)C(=NNc2cc(C)nc(N)n2)c2ccccc21	ZINC000872420737	EF	On-Demand	Mild	ALDH3A1	18	47
Nc1nc(C(F)F)nc(N2CCC(COc3ccccc3)CC2)n1	ZINC000872420742	EF	On-Demand	Anodyne	CHRNA10	47	38
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@H](OC)C1CC1	ZINC000872420747	EE	On-Demand	Anodyne	TLR4	16	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C[C@@H](OC)C1CC1	ZINC000872420748	EE	On-Demand	Anodyne	TLR4	16	44
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C1CC1	ZINC000872420756	CD	On-Demand	Anodyne	P2RY12	21	42
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)C1CC1	ZINC000872420756	CD	On-Demand	Anodyne	TLR4	21	56
O=C(c1ccc(Cl)cc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872420759	FH	On-Demand	Anodyne	NPY2R	23	40
O=C(c1ccc(Cl)cc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872420759	FH	On-Demand	Anodyne	SMO	24	47
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCOC	ZINC000872420788	DD	On-Demand	Anodyne	TLR4	18	42
O=C(Nc1ccccc1)NC1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872420789	GI	On-Demand	Anodyne	EPHX2	42	39
CC(=O)NCC1CCN(c2nnc(C(C)C)o2)CC1	ZINC000872420832	CD	On-Demand	Anodyne	CACNA1I	45	32
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cc(C(F)(F)F)nn1C	ZINC000872420843	GF	On-Demand	Anodyne	P2RY12	20	42
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cc(C(F)(F)F)nn1C	ZINC000872420843	GF	On-Demand	Anodyne	MOGAT2	40	32
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)CCOCCOC	ZINC000872420844	ED	On-Demand	Anodyne	TLR4	15	40
CCOC(=O)c1cc(F)ccc1NS(=O)(=O)c1cnc2n1CCC2	ZINC000872420845	FD	On-Demand	Anodyne	TLR4	15	40
COc1ccccc1N1CCC(=NNc2cc(C)nc(N)n2)CC1	ZINC000872420892	EE	On-Demand	Mild	HTR1A	59	40
COc1ccccc1N1CCC(=NNc2cc(C)nc(N)n2)CC1	ZINC000872420892	EE	On-Demand	Mild	DRD2	45	40
COc1ccccc1N1CCC(=NNc2cc(C)nc(N)n2)CC1	ZINC000872420892	EE	On-Demand	Mild	DRD3	50	40
COc1ccccc1N1CCC(=NNc2cc(C)nc(N)n2)CC1	ZINC000872420892	EE	On-Demand	Mild	HTR7	40	40
COc1ccc(OCCCNc2cc(Cl)nnc2O)cc1	ZINC000872420937	DF	On-Demand	Anodyne	SCNN1A	26	43
COc1ccc(OCCCNc2cc(Cl)nnc2O)cc1	ZINC000872420937	DF	On-Demand	Anodyne	PROKR1	60	32
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	HTR1A	57	47
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	DRD2	49	47
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	DRD4	23	45
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	ADRA1D	15	42
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	HTR2A	31	47
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	ADRA1A	21	42
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	DRD3	31	45
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	HTR7	31	40
FC(F)(F)COCCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872420938	FF	On-Demand	Anodyne	HNMT	46	34
COc1cc2c(cc1OC)CCN(c1ccnc3ncccc13)CC2	ZINC000872420947	EG	On-Demand	Anodyne	DRD1	15	42
COc1cc2c(cc1OC)CCN(c1ccnc3ncccc13)CC2	ZINC000872420947	EG	On-Demand	Anodyne	PDE3A	41	38
COc1cc2c(cc1OC)CCN(c1ccnc3ncccc13)CC2	ZINC000872420947	EG	On-Demand	Anodyne	PDE10A	19	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	DHFR	18	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	FOLA	25	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	DRTS_PLAFK	32	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	DFR1	18	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	DRTS_PLABA	16	40
CCC(Cc1ccc(OC)c(OC)c1)=NNc1cc(C)nc(N)n1	ZINC000872420950	EF	On-Demand	Mild	DRTS_TRYCR	59	38
O=C(NCCO)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872420981	DC	On-Demand	Anodyne	PRKD1	25	43
CC(=O)NCC1CCN(c2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872421024	EG	On-Demand	Anodyne	CACNA1I	59	36
CC(=O)NCC1CCN(c2ccncc2C2CC2)CC1	ZINC000872421040	CE	On-Demand	Anodyne	CACNA1I	48	32
COc1ccc(OC)c2sc(NCCCC(=O)N(C)C)nc12	ZINC000872421042	DF	On-Demand	Anodyne	ADORA2B	18	42
COc1ccc(OCCCNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872421112	EE	On-Demand	Anodyne	SCNN1A	36	45
COc1ccc(OCCCNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872421112	EE	On-Demand	Anodyne	PTGDR	23	41
COc1ccc(OCCCNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872421112	EE	On-Demand	Anodyne	PROKR1	60	32
CC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872421117	CD	On-Demand	Anodyne	HTR4	58	39
CC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872421117	CD	On-Demand	Anodyne	CACNA1I	41	31
CC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872421117	CD	On-Demand	Anodyne	SIRT3	52	41
CC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872421117	CD	On-Demand	Anodyne	SIRT2	52	33
CC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872421117	CD	On-Demand	Anodyne	SIRT1	52	41
CCN(Cc1ccccc1)C(=O)CNc1cc(C)nc2c1cnn2C	ZINC000872421151	EF	On-Demand	Anodyne	TSPO	40	42
Cc1c(F)ncnc1NC[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000872421152	EF	On-Demand	Anodyne	ADRB2	21	41
Cc1c(F)ncnc1NC[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000872421153	EF	On-Demand	Anodyne	ADRB2	21	41
O=C(CC1CCN(c2nc(Cl)nc3sccc23)CC1)NC1CCCC1	ZINC000872421188	GI	On-Demand	Anodyne	SIRT3	48	32
Oc1nnc(Cl)cc1Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000872421204	GG	On-Demand	Anodyne	DRD4	40	44
CCOc1cc(C=NNc2cc(C)nc(N)n2)c(F)cc1OC	ZINC000872421328	DE	On-Demand	Mild	AGPAT2	43	35
CCOc1cc(C=NNc2cc(C)nc(N)n2)c(F)cc1OC	ZINC000872421328	DE	On-Demand	Mild	DRTS_TRYCR	54	33
Cc1c(F)ncnc1NCC(=O)N1CCCc2ccccc21	ZINC000872421338	DE	On-Demand	Anodyne	AVPR2	53	42
Cc1c(F)ncnc1NCC(=O)N1CCCc2ccccc21	ZINC000872421338	DE	On-Demand	Anodyne	EIF2AK3	61	35
COc1ccc2c(c1)CN(c1cc(C)nc3c1cnn3C)CC2	ZINC000872421346	DF	On-Demand	Anodyne	DRD5	17	40
COc1ccc2c(c1)CN(c1ncnc(F)c1C)CC2	ZINC000872421377	CE	On-Demand	Anodyne	DRD5	18	43
CCN(Cc1ccccc1)C(=O)CNc1nc(Cl)nc2c1cnn2C	ZINC000872421399	FE	On-Demand	Anodyne	TSPO	23	40
CC(=NNc1cc(C)nc(N)n1)C1CCN(C)CC1	ZINC000872421438	CD	On-Demand	Mild	HRH4	20	42
Cc1c(F)ncnc1N1CCC(CC(=O)NC2CCCC2)CC1	ZINC000872421454	DF	On-Demand	Anodyne	SIRT3	75	39
Cc1c(F)ncnc1N1CCC(CC(=O)NC2CCCC2)CC1	ZINC000872421454	DF	On-Demand	Anodyne	SIRT2	61	37
Cc1c(F)ncnc1N1CCC(CC(=O)NC2CCCC2)CC1	ZINC000872421454	DF	On-Demand	Anodyne	SIRT1	55	36
CCN(Cc1ccccc1)C(=O)CNc1nc(N)nc(C(F)F)n1	ZINC000872421489	ED	On-Demand	Anodyne	TPH1	40	36
CN(CCNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872421529	CF	On-Demand	Anodyne	PKNB	17	43
O=C(CC1CCN(c2cc(Cl)nnc2O)CC1)NC1CCCC1	ZINC000872421571	EF	On-Demand	Anodyne	SIRT3	62	35
O=C(CC1CCN(c2cc(Cl)nnc2O)CC1)NC1CCCC1	ZINC000872421571	EF	On-Demand	Anodyne	SIRT2	53	35
O=C(CC1CCN(c2cc(Cl)nnc2O)CC1)NC1CCCC1	ZINC000872421571	EF	On-Demand	Anodyne	SIRT1	51	35
COC(=O)N1CCC(Nc2cc(C)nc3c2cnn3C)CC1	ZINC000872421577	DD	On-Demand	Anodyne	CD38	47	31
COC(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872421679	DF	On-Demand	Anodyne	P2RY12	159	41
COC(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872421679	DF	On-Demand	Anodyne	PTPN2	51	34
COC(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872421679	DF	On-Demand	Anodyne	PRKD1	50	34
COC(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872421679	DF	On-Demand	Anodyne	MAPK9	15	42
COC(=O)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872421679	DF	On-Demand	Anodyne	PTPN1	42	35
O=C(CNc1cc(Cl)nnc1O)N1CCCc2ccccc21	ZINC000872421756	DE	On-Demand	Anodyne	AVPR2	39	43
COC(=O)N1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872421760	EG	On-Demand	Anodyne	GPR119	53	38
COC(=O)N1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872421760	EG	On-Demand	Anodyne	SFRP1	76	35
COC(=O)N1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872421760	EG	On-Demand	Anodyne	WNT3	51	33
COc1ccc2c(c1)CN(c1cc(Cl)nnc1O)CC2	ZINC000872421816	CE	On-Demand	Anodyne	DRD5	23	41
COC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872421834	CE	On-Demand	Anodyne	MAPK8	19	40
COC(=O)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872421834	CE	On-Demand	Anodyne	CCR8	51	36
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872421866	EE	On-Demand	Anodyne	CA2	22	49
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872421866	EE	On-Demand	Anodyne	CA1	27	44
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872421866	EE	On-Demand	Anodyne	CA4	22	44
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872421866	EE	On-Demand	Anodyne	CA9	16	49
CCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872421866	EE	On-Demand	Anodyne	IDO1	34	40
CCC(=O)c1c(Cl)cccc1NCc1c(C)noc1C	ZINC000872421914	CI	On-Demand	Anodyne	P2RX7	15	54
NC(=O)c1cc(NC[C@H]2CCCO[C@H]2c2ccccc2)nc(Cl)n1	ZINC000872422116	EF	On-Demand	Anodyne	VCP	40	34
NC(=O)c1cc(NC[C@H]2CCCO[C@@H]2c2ccccc2)nc(Cl)n1	ZINC000872422117	EF	On-Demand	Anodyne	VCP	40	34
NC(=O)c1cc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)nc(Cl)n1	ZINC000872422118	EF	On-Demand	Anodyne	VCP	40	34
NC(=O)c1cc(NC[C@@H]2CCCO[C@H]2c2ccccc2)nc(Cl)n1	ZINC000872422119	EF	On-Demand	Anodyne	VCP	40	34
Cn1ncc2c(NCc3cccc(NC(=O)[C@@H]4CCCO4)c3)nc(Cl)nc21	ZINC000872422205	GF	On-Demand	Anodyne	ADORA3	62	38
Cn1ncc2c(NCc3cccc(NC(=O)[C@H]4CCCO4)c3)nc(Cl)nc21	ZINC000872422206	GF	On-Demand	Anodyne	ADORA3	62	38
Oc1nnc(Cl)cc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422298	FF	On-Demand	Anodyne	PDS	52	43
Oc1nnc(Cl)cc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422299	FF	On-Demand	Anodyne	PDS	52	43
CCCOc1ccc(S(=O)(=O)Nc2cnn(CC)c2C)cc1	ZINC000872422457	DF	On-Demand	Anodyne	PRTN3	45	34
Cc1c(F)ncnc1NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000872422472	EF	On-Demand	Anodyne	ADORA3	49	41
Cc1c(F)ncnc1NCc1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000872422474	EF	On-Demand	Anodyne	ADORA3	49	41
CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cnn(CC)c2C)c1	ZINC000872422529	FE	On-Demand	Anodyne	LIMK2	28	41
CCOC(=O)N1CCN(S(=O)(=O)Nc2cnn(CC)c2C)CC1	ZINC000872422603	EC	On-Demand	Anodyne	TGM2	36	44
CCOC(=O)N1CCN(S(=O)(=O)Nc2cnn(CC)c2C)CC1	ZINC000872422603	EC	On-Demand	Anodyne	F13A1	41	44
Cc1c(F)ncnc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422676	EF	On-Demand	Anodyne	ADRB2	18	42
Cc1c(F)ncnc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422676	EF	On-Demand	Anodyne	PDS	51	41
Cc1c(F)ncnc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422678	EF	On-Demand	Anodyne	ADRB2	18	42
Cc1c(F)ncnc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000872422678	EF	On-Demand	Anodyne	PDS	51	41
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cnn(CC)c2C)c1	ZINC000872422866	FG	On-Demand	Anodyne	CA6	17	41
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cnn(CC)c2C)c1	ZINC000872422866	FG	On-Demand	Anodyne	CA7	20	41
CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cnn(CC)c2C)c1	ZINC000872422866	FG	On-Demand	Anodyne	CA13	39	41
Cc1c(F)ncnc1NC[C@H]1CCCO[C@H]1c1ccccc1	ZINC000872422938	DH	On-Demand	Anodyne	TNK2	61	41
Cc1c(F)ncnc1NC[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000872422942	DH	On-Demand	Anodyne	TNK2	61	41
Cc1c(F)ncnc1NC[C@H]1CCCO[C@@H]1c1ccccc1	ZINC000872422944	DH	On-Demand	Anodyne	TNK2	61	41
Cc1c(F)ncnc1NC[C@@H]1CCCO[C@@H]1c1ccccc1	ZINC000872422945	DH	On-Demand	Anodyne	TNK2	61	41
COCCN1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872423079	EF	On-Demand	Anodyne	SSTR5	42	34
COCCN1CCC(Nc2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872423079	EF	On-Demand	Anodyne	EHMT2	41	30
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423081	DF	On-Demand	Anodyne	SIRT3	48	42
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423081	DF	On-Demand	Anodyne	SIRT2	41	42
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423081	DF	On-Demand	Anodyne	SIRT1	38	42
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423082	DF	On-Demand	Anodyne	SIRT3	48	42
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423082	DF	On-Demand	Anodyne	SIRT2	41	42
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872423082	DF	On-Demand	Anodyne	SIRT1	38	42
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2Cl)CC1	ZINC000872423083	EE	On-Demand	Anodyne	AKT2	35	41
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2Cl)CC1	ZINC000872423083	EE	On-Demand	Anodyne	AKT3	47	38
Cc1c(F)ncnc1N1CCN(C(=O)Cc2ccccc2Cl)CC1	ZINC000872423083	EE	On-Demand	Anodyne	AKT1	42	38
COCCN1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872423149	DC	On-Demand	Anodyne	EHMT2	52	30
Cc1c(F)ncnc1NCc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000872423150	FF	On-Demand	Anodyne	PTK2	43	37
Cn1ncc2c(N3CCC[C@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872423165	GF	On-Demand	Anodyne	ACACB	15	42
Cn1ncc2c(N3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872423166	GF	On-Demand	Anodyne	ACACB	15	42
COCCN1CCC(Nc2nc(Cl)nc3sccc23)CC1	ZINC000872423176	EF	On-Demand	Anodyne	EHMT2	85	38
COCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872423190	DC	On-Demand	Anodyne	HTR4	78	40
COCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872423190	DC	On-Demand	Anodyne	SSTR5	56	35
COCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872423190	DC	On-Demand	Anodyne	CACNA1I	43	36
COCCN1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872423190	DC	On-Demand	Anodyne	EHMT2	54	33
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872423200	EG	On-Demand	Anodyne	ACACB	16	43
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872423201	EG	On-Demand	Anodyne	ACACB	16	43
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	DRD2	22	43
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	DRD4	54	43
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	ACHE	58	53
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	DRD3	17	41
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	SLC6A3	15	44
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	GRIN2B	42	41
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	SIGMAR1	68	45
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	SSTR5	50	34
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	BCHE	19	43
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	CACNA1I	52	39
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2)CC1	ZINC000872423209	EG	On-Demand	Anodyne	VCP	43	35
COCCN1CCC(Nc2cc(C)nc3c2cnn3C)CC1	ZINC000872423246	DD	On-Demand	Anodyne	EHMT2	48	31
Cc1c(F)ncnc1NCC1(c2ccc3c(c2)OCO3)CCOCC1	ZINC000872423251	EF	On-Demand	Anodyne	CLK4	44	39
COCCN1CCC(Nc2nc(SC)nc(Cl)c2F)CC1	ZINC000872423261	EF	On-Demand	Anodyne	EHMT2	50	32
Cc1c(F)ncnc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423273	EE	On-Demand	Anodyne	EGFR	23	41
Cc1c(F)ncnc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423273	EE	On-Demand	Anodyne	LTA4H	24	44
Cc1c(F)ncnc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423273	EE	On-Demand	Anodyne	SRC	29	42
Cc1c(F)ncnc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423273	EE	On-Demand	Anodyne	EPHX2	15	43
Cc1c(F)ncnc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423273	EE	On-Demand	Anodyne	STAT6	40	38
Cc1c(F)ncnc1NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000872423274	EE	On-Demand	Anodyne	BDKRB1	16	41
Cc1c(F)ncnc1NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000872423274	EE	On-Demand	Anodyne	PARP1	15	46
Cc1c(F)ncnc1NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000872423274	EE	On-Demand	Anodyne	STAT6	50	40
COCCN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872423293	CE	On-Demand	Anodyne	EHMT2	47	31
COCCN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872423296	DD	On-Demand	Anodyne	EHMT2	84	36
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423313	EF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423313	EF	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423313	EF	On-Demand	Anodyne	SIRT3	37	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423313	EF	On-Demand	Anodyne	SIRT2	34	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423313	EF	On-Demand	Anodyne	SIRT1	30	41
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423314	EF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423314	EF	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423314	EF	On-Demand	Anodyne	SIRT3	37	41
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423314	EF	On-Demand	Anodyne	SIRT2	34	41
CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872423314	EF	On-Demand	Anodyne	SIRT1	30	41
O=C(Cc1ccccc1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872423315	FE	On-Demand	Anodyne	KCNQ2	22	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HTR1A	98	47
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	DRD2	86	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	DRD1	25	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	DRD4	51	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	ADRA1D	53	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HTR2A	67	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HTR2C	43	44
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	SLC6A4	21	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	ADRA1A	53	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	ADRA1B	35	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	DRD3	110	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HRP1_PLAFA	90	39
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HTR7	94	46
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000872423319	GG	On-Demand	Anodyne	HNMT	72	41
O=C(c1cccc(CNc2cc(Cl)nnc2O)c1)N1CCOCC1	ZINC000872423364	ED	On-Demand	Anodyne	PARP1	15	47
O=C(c1cccc(CNc2cc(Cl)nnc2O)c1)N1CCOCC1	ZINC000872423364	ED	On-Demand	Anodyne	STAT6	35	40
NC(=O)c1cc(N2CCC(C(=O)N3CCc4ccccc43)CC2)nc(Cl)n1	ZINC000872423368	GE	On-Demand	Anodyne	PIK3CB	15	46
Oc1nnc(Cl)cc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423374	FE	On-Demand	Anodyne	ESR1	47	38
Oc1nnc(Cl)cc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423374	FE	On-Demand	Anodyne	LTA4H	24	43
Oc1nnc(Cl)cc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423374	FE	On-Demand	Anodyne	SRC	21	42
Oc1nnc(Cl)cc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423374	FE	On-Demand	Anodyne	EPHX2	15	44
Oc1nnc(Cl)cc1NCc1cccc(OCCN2CCOCC2)c1	ZINC000872423374	FE	On-Demand	Anodyne	STAT6	49	37
Nc1nc(NCc2cccc(OCCN3CCOCC3)c2)nc(C(F)F)n1	ZINC000872423380	GD	On-Demand	Anodyne	LTA4H	25	43
Nc1nc(NCc2cccc(OCCN3CCOCC3)c2)nc(C(F)F)n1	ZINC000872423380	GD	On-Demand	Anodyne	STAT6	56	41
Cc1cc(N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c2cnn(C)c2n1	ZINC000872423387	FG	On-Demand	Anodyne	ACACB	15	44
COCCN1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872423392	CD	On-Demand	Anodyne	EHMT2	72	33
NC(=O)c1cc(N2CCN(C(=O)Cc3ccccc3Cl)CC2)nc(Cl)n1	ZINC000872423405	GD	On-Demand	Anodyne	PIK3CB	23	40
CCOc1ccc(Br)cc1S(=O)(=O)Nc1cnn(CC)c1C	ZINC000872423443	GG	On-Demand	Anodyne	ALPL	19	43
COCCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872423455	DF	On-Demand	Anodyne	P2RY12	32	40
COCCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872423455	DF	On-Demand	Anodyne	SSTR5	46	37
Cc1c(F)ncnc1NCc1cccc(NC(=O)CC(C)C)c1	ZINC000872423456	DH	On-Demand	Anodyne	SLC1A2	41	32
Cc1c(F)ncnc1NC[C@@H](O)COc1cccc(Cl)c1Cl	ZINC000872423486	EG	On-Demand	Anodyne	ADRB2	18	48
Cc1c(F)ncnc1NC[C@H](O)COc1cccc(Cl)c1Cl	ZINC000872423487	EG	On-Demand	Anodyne	ADRB2	18	48
c1ccc(-c2cc(NC[C@@H]3CCCCO3)ncn2)cc1	ZINC000872423517	CG	On-Demand	Anodyne	TNK2	70	49
c1ccc(-c2cc(NC[C@H]3CCCCO3)ncn2)cc1	ZINC000872423518	CG	On-Demand	Anodyne	TNK2	70	49
COCCN1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872423581	CD	On-Demand	Anodyne	HTR4	49	40
COCCN1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872423581	CD	On-Demand	Anodyne	EHMT2	48	31
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	DRD4	40	42
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	ACHE	48	47
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	SLC6A3	17	44
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	GRIN2B	32	44
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	SIGMAR1	48	43
Nc1nc(NCC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872423586	EF	On-Demand	Anodyne	VCP	62	36
CCC(=O)c1c(Cl)cccc1NC1CCN(CCOC)CC1	ZINC000872423591	DG	On-Demand	Anodyne	DRD4	44	36
CCC(=O)c1c(Cl)cccc1NC1CCN(CCOC)CC1	ZINC000872423591	DG	On-Demand	Anodyne	DRD3	24	41
CCC(=O)c1c(Cl)cccc1NC1CCN(CCOC)CC1	ZINC000872423591	DG	On-Demand	Anodyne	HTR4	71	39
CCC(=O)c1c(Cl)cccc1NC1CCN(CCOC)CC1	ZINC000872423591	DG	On-Demand	Anodyne	CCR3	15	41
Cc1c(F)ncnc1NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	ZINC000872423601	EE	On-Demand	Anodyne	TNK2	59	40
Cc1c(F)ncnc1NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	ZINC000872423602	EE	On-Demand	Anodyne	TNK2	59	40
O=C(c1cccc(CNc2ccnc3ncccc23)c1)N1CCOCC1	ZINC000872423611	EF	On-Demand	Anodyne	PARP1	17	51
Cn1ncc2c(NCCS(=O)(=O)Cc3ccccc3)nc(Cl)nc21	ZINC000872423624	FE	On-Demand	Anodyne	ABL1	16	40
Cn1ncc2c(NC[C@H]3CCCCO3)nc(Cl)nc21	ZINC000872423644	CD	On-Demand	Anodyne	TNK2	44	41
Cn1ncc2c(NC[C@@H]3CCCCO3)nc(Cl)nc21	ZINC000872423645	CD	On-Demand	Anodyne	TNK2	44	41
O=C1[C@H]2[C@H](C(=O)N1N=CCc1ccc(F)cc1Cl)[C@H]1C=C[C@H]2O1	ZINC000872424594	ED	On-Demand	Mild	P2RX7	35	40
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CCc1ccc(F)cc1Cl	ZINC000872424595	ED	On-Demand	Mild	P2RX7	35	40
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CCc1ccc(F)cc1Cl	ZINC000872424596	ED	On-Demand	Mild	P2RX7	35	40
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(O)c(Br)c1)[C@H]1C=C[C@H]2O1	ZINC000872424615	FD	On-Demand	Mild	HSD17B3	42	38
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(O)c(Br)c1	ZINC000872424616	FD	On-Demand	Mild	HSD17B3	42	38
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(O)c(Br)c1	ZINC000872424617	FD	On-Demand	Mild	HSD17B3	42	38
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	ESR1	75	37
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	ESR2	52	37
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	LTA4H	55	45
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	HRH3	50	42
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	PSMB2	43	42
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425123	GD	On-Demand	Mild	PSMB1	47	42
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	ESR1	75	37
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	ESR2	52	37
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	LTA4H	55	45
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	HRH3	50	42
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	PSMB2	43	42
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872425124	GD	On-Demand	Mild	PSMB1	47	42
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	ESR1	75	37
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	ESR2	52	37
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	LTA4H	55	45
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	HRH3	50	42
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	PSMB2	43	42
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCCC2)cc1	ZINC000872425125	GD	On-Demand	Mild	PSMB1	47	42
CC(=NN1C(=O)[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O)c1ccc(-n2cccn2)cc1	ZINC000872425223	ED	On-Demand	Mild	AMP1_PLAFQ	46	35
CC(=NN1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2O1)c1ccc(-n2cccn2)cc1	ZINC000872425225	ED	On-Demand	Mild	AMP1_PLAFQ	46	35
CC(=NN1C(=O)[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O)c1ccc(-n2cccn2)cc1	ZINC000872425228	ED	On-Demand	Mild	AMP1_PLAFQ	46	35
CCCCCOc1ccc(C=NN2C(=O)[C@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1	ZINC000872425321	FF	On-Demand	Mild	PLA2G4B	62	33
CCCCCOc1ccc(C=NN2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3O2)cc1	ZINC000872425323	FF	On-Demand	Mild	PLA2G4B	62	33
CCCCCOc1ccc(C=NN2C(=O)[C@@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1	ZINC000872425325	FF	On-Demand	Mild	PLA2G4B	62	33
C[C@@H](Nc1cc(C(N)=O)nc(Cl)n1)c1ccc(N2CCOCC2)cc1	ZINC000872425376	FE	On-Demand	Clean	STAT6	56	35
CC(=O)N(C)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872426136	EG	On-Demand	Anodyne	GRM5	15	44
CC(C)(C)OC(=O)N[C@@H](C=NN1C(=O)[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O)CC1CCC1	ZINC000872426232	GD	On-Demand	Mild	CTSK	16	48
CCn1cc([C@@H]2OCC[C@H]2C=NNC(=O)c2ccc(=O)n(C)c2)cn1	ZINC000872426427	ED	On-Demand	Reactive	PANC	40	30
COC1(CS(=O)(=O)Nc2ccc3[nH]c(-c4ccncc4)nc3c2)CCC1	ZINC000872426430	FF	On-Demand	Anodyne	CHEK2	48	38
COC1(CS(=O)(=O)Nc2ccc3[nH]c(-c4ccncc4)nc3c2)CCC1	ZINC000872426430	FF	On-Demand	Anodyne	NR2E3	68	37
COCCS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872426468	DC	On-Demand	Reactive	CSNK1D	18	40
COCCS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872426468	DC	On-Demand	Reactive	TMPRSS6	51	33
O=S(=O)(CCCCF)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426612	EG	On-Demand	Anodyne	CHEK2	40	40
O=S(=O)(CCCCF)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426612	EG	On-Demand	Anodyne	NR2E3	71	39
CN1CCN(c2ncccc2CNc2ccnc3ncccc23)CC1	ZINC000872426621	EE	On-Demand	Anodyne	HTR3A	21	42
CN1CCN(c2ncccc2CNc2nc(Cl)nc3sccc23)CC1	ZINC000872426679	FG	On-Demand	Anodyne	HTR3A	17	40
CN1CCN(c2ncccc2CNc2nc(Cl)nc3sccc23)CC1	ZINC000872426679	FG	On-Demand	Anodyne	HRH4	34	44
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872426687	FD	On-Demand	Reactive	TMPRSS6	56	34
O=S(=O)(C[C@@H]1CCCOC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426698	FF	On-Demand	Anodyne	CHEK2	43	37
O=S(=O)(C[C@@H]1CCCOC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426698	FF	On-Demand	Anodyne	NR2E3	67	38
O=S(=O)(C[C@H]1CCCOC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426699	FF	On-Demand	Anodyne	CHEK2	43	37
O=S(=O)(C[C@H]1CCCOC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426699	FF	On-Demand	Anodyne	NR2E3	67	38
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872426715	FD	On-Demand	Reactive	ST14	40	32
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872426715	FD	On-Demand	Reactive	TMPRSS6	52	32
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872426746	GE	On-Demand	Reactive	ALOX5	27	41
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872426746	GE	On-Demand	Reactive	ST14	46	33
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872426746	GE	On-Demand	Reactive	TMPRSS6	59	33
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(C(C)C)c1	ZINC000872426753	DF	On-Demand	Reactive	ABAT	20	43
O=S(=O)(CCOCC1CC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426758	FF	On-Demand	Anodyne	CHEK2	62	38
O=S(=O)(CCOCC1CC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872426758	FF	On-Demand	Anodyne	NR2E3	67	38
CN1CCC(C=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872426765	CC	On-Demand	Reactive	HTR1F	46	34
O=C(NNS(=O)(=O)CCCCF)c1nc2ccccc2s1	ZINC000872426779	ED	On-Demand	Reactive	TMPRSS6	54	32
CN1CCN(c2ncccc2CNc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872426782	FD	On-Demand	Anodyne	HRH4	31	40
CN1CCN(c2ncccc2CNc2cc(Cl)nnc2O)CC1	ZINC000872426792	ED	On-Demand	Anodyne	HRH4	29	41
NC(=O)c1cc(NC[C@@H](c2cccc(F)c2)N2CCOCC2)nc(Cl)n1	ZINC000872426802	GD	On-Demand	Anodyne	STAT6	50	38
NC(=O)c1cc(NC[C@H](c2cccc(F)c2)N2CCOCC2)nc(Cl)n1	ZINC000872426803	GD	On-Demand	Anodyne	STAT6	50	38
CCO[C@H](CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872426812	GG	On-Demand	Anodyne	NR2E3	70	39
CCO[C@@H](CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872426813	GG	On-Demand	Anodyne	NR2E3	70	39
CC(=NNC(=O)c1ccc(=O)n(C)c1)C1CCN(C)CC1	ZINC000872426817	CC	On-Demand	Reactive	HTR1F	65	35
CCCCN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872426824	CG	On-Demand	Anodyne	HRP1_PLAFA	42	37
CCCCN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872426824	CG	On-Demand	Anodyne	HNMT	74	39
CO[C@@H](CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872426846	FF	On-Demand	Anodyne	CHEK2	60	38
CO[C@@H](CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1)C1CC1	ZINC000872426846	FF	On-Demand	Anodyne	NR2E3	73	41
Cn1ncc2c(NC[C@@H](c3cccc(F)c3)N3CCOCC3)nc(Cl)nc21	ZINC000872426856	GF	On-Demand	Anodyne	ABL1	23	40
Cn1ncc2c(NC[C@H](c3cccc(F)c3)N3CCOCC3)nc(Cl)nc21	ZINC000872426857	GF	On-Demand	Anodyne	ABL1	23	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(CN(C)C)c1	ZINC000872426882	ED	On-Demand	Reactive	ABAT	19	41
CC(CCCc1cccnc1)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872426886	DD	On-Demand	Reactive	TBXAS1	36	42
CC(CCCc1cccnc1)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872426886	DD	On-Demand	Reactive	PTAFR	36	41
CCCCN1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872426897	CF	On-Demand	Anodyne	EHMT2	50	30
CCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC(=O)CC	ZINC000872426899	FD	On-Demand	Reactive	ADCYAP1R1	63	36
Cc1c(F)ncnc1NCc1cccnc1N1CCN(C)CC1	ZINC000872426905	DD	On-Demand	Anodyne	HRH4	25	40
CO[C@@H](C)CS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872426927	EC	On-Demand	Reactive	ST14	40	35
CO[C@@H](C)CS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872426927	EC	On-Demand	Reactive	TMPRSS6	57	35
CCCCN1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872426944	DF	On-Demand	Anodyne	EHMT2	76	34
COC[C@@H](C)Oc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872426954	ED	On-Demand	Reactive	GCK	28	41
COC[C@@H](C)Oc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872426954	ED	On-Demand	Reactive	ADCYAP1R1	60	37
CN1CCN(c2ncccc2CNc2nc(N)nc(C(F)F)n2)CC1	ZINC000872426965	FD	On-Demand	Anodyne	HRH4	58	48
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)c(O)c(C(C)(C)C)c1	ZINC000872426984	FE	On-Demand	Reactive	ADCYAP1R1	48	30
CO[C@@H](CC(C)C)CS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427002	FD	On-Demand	Reactive	ST14	40	36
CO[C@@H](CC(C)C)CS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427002	FD	On-Demand	Reactive	TMPRSS6	58	38
O=S(=O)(CCC1CC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427009	EG	On-Demand	Anodyne	CHEK2	67	39
O=S(=O)(CCC1CC1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427009	EG	On-Demand	Anodyne	NR2E3	72	41
O=C(NNS(=O)(=O)N1CCCC1)c1nc2ccccc2s1	ZINC000872427027	EC	On-Demand	Reactive	TMPRSS6	43	30
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCCC1	ZINC000872427032	GE	On-Demand	Reactive	ALOX5	29	42
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCCC1	ZINC000872427032	GE	On-Demand	Reactive	ST14	45	32
CO[C@@H](CS(=O)(=O)NNC(=O)c1nc2ccccc2s1)C1CCCCC1	ZINC000872427032	GE	On-Demand	Reactive	TMPRSS6	58	32
O=C1[C@H]2[C@H](C(=O)N1N=Cc1cc3ccncc3s1)[C@H]1C=C[C@H]2O1	ZINC000872427059	ED	On-Demand	Mild	CYP2A6	15	48
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1cc2ccncc2s1	ZINC000872427060	ED	On-Demand	Mild	CYP2A6	15	48
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1cc2ccncc2s1	ZINC000872427061	ED	On-Demand	Mild	CYP2A6	15	48
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427071	GC	On-Demand	Mild	ESR1	56	36
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427071	GC	On-Demand	Mild	LTA4H	40	43
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427071	GC	On-Demand	Mild	PSMB1	40	35
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCOCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872427072	GC	On-Demand	Mild	ESR1	56	36
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCOCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872427072	GC	On-Demand	Mild	LTA4H	40	43
O=C1[C@H]2[C@H](C(=O)N1N=Cc1ccc(OCCN3CCOCC3)cc1)[C@H]1C=C[C@H]2O1	ZINC000872427072	GC	On-Demand	Mild	PSMB1	40	35
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427073	GC	On-Demand	Mild	ESR1	56	36
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427073	GC	On-Demand	Mild	LTA4H	40	43
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=Cc1ccc(OCCN2CCOCC2)cc1	ZINC000872427073	GC	On-Demand	Mild	PSMB1	40	35
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(C2CC2)c1	ZINC000872427134	DE	On-Demand	Reactive	ABAT	19	41
CO[C@@H](C)CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427138	EE	On-Demand	Anodyne	CHEK2	47	41
CO[C@@H](C)CS(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427138	EE	On-Demand	Anodyne	NR2E3	70	40
CCCN(C)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427140	ED	On-Demand	Reactive	TMPRSS6	44	32
C[C@@H]1CCN(S(=O)(=O)NNC(=O)c2nc3ccccc3s2)C1	ZINC000872427152	ED	On-Demand	Reactive	TMPRSS6	44	31
C[C@H]1CCN(S(=O)(=O)NNC(=O)c2nc3ccccc3s2)C1	ZINC000872427153	ED	On-Demand	Reactive	TMPRSS6	44	31
CN(CC1CC1)S(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427154	FF	On-Demand	Anodyne	CHEK2	54	38
CN(CC1CC1)S(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427154	FF	On-Demand	Anodyne	NR2E3	70	39
CC(C)(C)CCS(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427156	EE	On-Demand	Reactive	TMPRSS6	49	32
CCC(CCc1ccccc1)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872427170	DF	On-Demand	Reactive	HDAC8	18	40
CCCCN(C)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427172	ED	On-Demand	Reactive	TMPRSS6	50	33
O=S(=O)(C[C@@H]1CCCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427173	FF	On-Demand	Anodyne	CHEK2	65	40
O=S(=O)(C[C@@H]1CCCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427173	FF	On-Demand	Anodyne	NR2E3	69	39
O=S(=O)(C[C@H]1CCCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427174	FF	On-Demand	Anodyne	CHEK2	65	40
O=S(=O)(C[C@H]1CCCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427174	FF	On-Demand	Anodyne	NR2E3	69	39
CCCN(CCC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427185	FD	On-Demand	Reactive	ST14	42	33
CCCN(CCC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427185	FD	On-Demand	Reactive	TMPRSS6	54	32
O=S(=O)(C[C@@H]1CCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427217	FF	On-Demand	Anodyne	CHEK2	65	40
O=S(=O)(C[C@@H]1CCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427217	FF	On-Demand	Anodyne	NR2E3	70	39
O=S(=O)(C[C@H]1CCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427218	FF	On-Demand	Anodyne	CHEK2	65	40
O=S(=O)(C[C@H]1CCCO1)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427218	FF	On-Demand	Anodyne	NR2E3	70	39
Cc1c(F)ncnc1N1CCN(c2ccc(Cl)cc2)CC1	ZINC000872427240	DF	On-Demand	Anodyne	AKT3	41	36
O=C(Cc1ccccc1F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872427266	FD	On-Demand	Anodyne	DPP4	20	41
COc1cccc(C(=O)O)c1NS(=O)(=O)C1=CCCCC1	ZINC000872427270	DF	On-Demand	Anodyne	FABP4	16	40
O=C(NNS(=O)(=O)N1CCC1)c1nc2ccccc2s1	ZINC000872427272	DC	On-Demand	Reactive	TMPRSS6	43	30
CCCN(C)S(=O)(=O)Nc1ccc2[nH]c(-c3ccncc3)nc2c1	ZINC000872427285	EF	On-Demand	Anodyne	NR2E3	69	40
CCC[C@H](CC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427296	EE	On-Demand	Reactive	ST14	40	35
CCC[C@H](CC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427296	EE	On-Demand	Reactive	TMPRSS6	57	35
CCC[C@@H](CC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427297	EE	On-Demand	Reactive	ST14	40	35
CCC[C@@H](CC)S(=O)(=O)NNC(=O)c1nc2ccccc2s1	ZINC000872427297	EE	On-Demand	Reactive	TMPRSS6	57	35
O=S(=O)(Nc1ccc2[nH]c(-c3ccncc3)nc2c1)N1CCCC1	ZINC000872427314	EE	On-Demand	Anodyne	CHEK2	73	43
O=S(=O)(Nc1ccc2[nH]c(-c3ccncc3)nc2c1)N1CCCC1	ZINC000872427314	EE	On-Demand	Anodyne	NR2E3	78	42
O=C(Nc1cccc(CNc2cc(Cl)nnc2O)c1)C1CCCCC1	ZINC000872427460	FH	On-Demand	Anodyne	TYK2	45	35
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872427504	FD	On-Demand	Mild	ACHE	34	41
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872427504	FD	On-Demand	Mild	SIGMAR1	60	41
O=C1[C@H]2[C@H](C(=O)N1N=CC1CCN(Cc3ccccc3)CC1)[C@H]1C=C[C@H]2O1	ZINC000872427505	FD	On-Demand	Mild	ACHE	34	41
O=C1[C@H]2[C@H](C(=O)N1N=CC1CCN(Cc3ccccc3)CC1)[C@H]1C=C[C@H]2O1	ZINC000872427505	FD	On-Demand	Mild	SIGMAR1	60	41
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872427506	FD	On-Demand	Mild	ACHE	34	41
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1N=CC1CCN(Cc2ccccc2)CC1	ZINC000872427506	FD	On-Demand	Mild	SIGMAR1	60	41
NC(=O)c1cc(NCc2cccnc2N2CCCCC2)nc(Cl)n1	ZINC000872427547	EE	On-Demand	Anodyne	SCN2A	19	46
NC(=O)c1cc(NCc2cccnc2N2CCCCC2)nc(Cl)n1	ZINC000872427547	EE	On-Demand	Anodyne	SCN10A	20	46
COc1ccc(Cn2cc(C=NN3C(=O)[C@H]4[C@H]5C=C[C@@H](O5)[C@@H]4C3=O)nn2)cc1	ZINC000872427604	GC	On-Demand	Mild	PROKR1	59	32
COc1ccc(Cn2cc(C=NN3C(=O)[C@H]4[C@H](C3=O)[C@H]3C=C[C@H]4O3)nn2)cc1	ZINC000872427605	GC	On-Demand	Mild	PROKR1	59	32
COc1ccc(Cn2cc(C=NN3C(=O)[C@@H]4[C@H]5C=C[C@@H](O5)[C@@H]4C3=O)nn2)cc1	ZINC000872427606	GC	On-Demand	Mild	PROKR1	59	32
O=C(c1ccc(C=NN2C(=O)[C@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1)N1CCCC1	ZINC000872427752	FD	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NN2C(=O)[C@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1)N1CCCC1	ZINC000872427752	FD	On-Demand	Mild	L3MBTL3	60	38
O=C(c1ccc(C=NN2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3O2)cc1)N1CCCC1	ZINC000872427753	FD	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NN2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3O2)cc1)N1CCCC1	ZINC000872427753	FD	On-Demand	Mild	L3MBTL3	60	38
O=C(c1ccc(C=NN2C(=O)[C@@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1)N1CCCC1	ZINC000872427754	FD	On-Demand	Mild	MLYCD	18	40
O=C(c1ccc(C=NN2C(=O)[C@@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1)N1CCCC1	ZINC000872427754	FD	On-Demand	Mild	L3MBTL3	60	38
Oc1nnc(Cl)cc1NCc1cccnc1N1CCCCC1	ZINC000872428099	DF	On-Demand	Anodyne	SCN2A	18	45
Oc1nnc(Cl)cc1NCc1cccnc1N1CCCCC1	ZINC000872428099	DF	On-Demand	Anodyne	SCN10A	18	45
COC(=O)CCCCNc1cc(-c2ccccc2)ncn1	ZINC000872428166	CF	On-Demand	Anodyne	LTB4R	29	53
COC(=O)CCCCNc1cc(-c2ccccc2)ncn1	ZINC000872428166	CF	On-Demand	Anodyne	FAAH	29	50
NC(=O)c1cc(NCc2ccc(N3CCCCC3)cc2)nc(Cl)n1	ZINC000872428303	EF	On-Demand	Clean	STAT6	68	45
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	DRD2	20	45
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	DRD4	45	45
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	ACHE	35	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	HTR2A	15	42
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	SLC6A1	89	34
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	DRD3	17	41
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	SIGMAR1	43	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	SLC18A3	24	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	CACNA1G	29	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000872428305	FE	On-Demand	Reactive	CYP2J2	50	35
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	DRD2	20	45
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	DRD4	45	45
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	ACHE	35	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	HTR2A	15	42
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	SLC6A1	89	34
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	DRD3	17	41
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	SIGMAR1	43	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	SLC18A3	24	43
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	CACNA1G	29	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000872428306	FE	On-Demand	Reactive	CYP2J2	50	35
Oc1nnc(Cl)cc1N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1	ZINC000872428315	GE	On-Demand	Anodyne	DRD4	18	49
Cc1c(F)ncnc1NCc1ccccc1N1CCOCC1	ZINC000872428326	DE	On-Demand	Anodyne	STAT6	56	39
c1cc(N2CCN(C3CC3)CC2)c(C2CC2)cn1	ZINC000872428372	BE	On-Demand	Anodyne	EBP	27	45
CC(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872428458	DE	On-Demand	Anodyne	P2RY12	31	45
CC(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872428458	DE	On-Demand	Anodyne	CCR3	16	41
Nc1nc(NCc2ccccc2OCCN2CCOCC2)nc(C(F)F)n1	ZINC000872428468	GD	On-Demand	Anodyne	STAT6	50	39
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872428519	FD	On-Demand	Reactive	GPR119	26	41
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872428521	FD	On-Demand	Reactive	GPR119	26	41
COc1cc(C)c(C(C)=NNC(=O)c2ccc(=O)n(C)c2)cc1C	ZINC000872428532	EE	On-Demand	Reactive	PYK	43	37
Oc1nnc(Cl)cc1NCc1ccc(N2CCCCC2)cc1	ZINC000872428590	DG	On-Demand	Clean	STAT6	32	42
CC(C)(C)OC(=O)N[C@@H](C=NN1C(=O)[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O)CC1CC1	ZINC000872428615	GD	On-Demand	Mild	CTSK	17	45
NC(=O)c1cc(NC2CCN(CC(F)(F)F)CC2)nc(Cl)n1	ZINC000872428647	ED	On-Demand	Anodyne	HPGDS	37	41
Oc1nnc(Cl)cc1NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872428651	EG	On-Demand	Anodyne	DRD4	28	42
Oc1nnc(Cl)cc1NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872428651	EG	On-Demand	Anodyne	ACHE	27	42
Oc1nnc(Cl)cc1NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872428651	EG	On-Demand	Anodyne	SIGMAR1	31	44
Oc1nnc(Cl)cc1NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872428651	EG	On-Demand	Anodyne	CCR3	20	44
Oc1nnc(Cl)cc1NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872428652	EG	On-Demand	Anodyne	DRD4	28	42
Oc1nnc(Cl)cc1NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872428652	EG	On-Demand	Anodyne	ACHE	27	42
Oc1nnc(Cl)cc1NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872428652	EG	On-Demand	Anodyne	SIGMAR1	31	44
Oc1nnc(Cl)cc1NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872428652	EG	On-Demand	Anodyne	CCR3	20	44
FC(F)(F)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872428745	EH	On-Demand	Anodyne	PRKD1	52	35
FC(F)(F)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872428745	EH	On-Demand	Anodyne	HPGDS	43	55
CC(=O)NC[C@@H]1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872428751	DF	On-Demand	Anodyne	CACNA1I	50	33
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cnn(C)c1C	ZINC000872428779	CC	On-Demand	Reactive	HPD	43	31
CC(=O)NC[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872428812	EG	On-Demand	Anodyne	GRM5	17	42
FC(F)(F)CN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872428825	DG	On-Demand	Anodyne	HPGDS	37	40
NC(=O)c1cc(NCc2ccccc2N2CCOCC2)nc(Cl)n1	ZINC000872428827	ED	On-Demand	Anodyne	PIK3CD	28	40
NC(=O)c1cc(NCc2ccccc2N2CCOCC2)nc(Cl)n1	ZINC000872428827	ED	On-Demand	Anodyne	SCN10A	16	48
NC(=O)c1cc(NCc2ccccc2N2CCOCC2)nc(Cl)n1	ZINC000872428827	ED	On-Demand	Anodyne	PIK3CB	49	42
NC(=O)c1cc(NCc2ccccc2N2CCOCC2)nc(Cl)n1	ZINC000872428827	ED	On-Demand	Anodyne	STAT6	62	44
Cc1c(F)ncnc1N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1	ZINC000872428856	FF	On-Demand	Anodyne	DRD4	15	44
c1ccc(-c2cc(N3CCN(C4CC4)CC3)ncn2)cc1	ZINC000872428871	CE	On-Demand	Anodyne	EBP	32	49
Nc1nc(NC[C@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872428897	EF	On-Demand	Anodyne	DRD4	16	42
Nc1nc(NC[C@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872428897	EF	On-Demand	Anodyne	VCP	42	32
Nc1nc(NC[C@@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872428898	EF	On-Demand	Anodyne	DRD4	16	42
Nc1nc(NC[C@@H]2CCCN(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872428898	EF	On-Demand	Anodyne	VCP	42	32
Oc1nnc(Cl)cc1NCc1ccccc1N1CCOCC1	ZINC000872428926	DE	On-Demand	Anodyne	PIK3CB	28	40
Oc1nnc(Cl)cc1NCc1ccccc1N1CCOCC1	ZINC000872428926	DE	On-Demand	Anodyne	STAT6	52	40
Oc1nnc(Cl)cc1NCc1ccccc1OCCN1CCOCC1	ZINC000872428951	FE	On-Demand	Anodyne	STAT6	41	39
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	DRD2	17	41
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	DRD4	40	41
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	ACHE	34	41
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	SIGMAR1	42	41
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	CYP2J2	47	33
C[C@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428952	FE	On-Demand	Reactive	NOD2	40	34
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	DRD2	17	41
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	DRD4	40	41
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	ACHE	34	41
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	SIGMAR1	42	41
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	CYP2J2	47	33
C[C@@H]1CCN(Cc2ccccc2)CC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872428953	FE	On-Demand	Reactive	NOD2	40	34
Nc1nc(NCc2ccccc2N2CCOCC2)nc(C(F)F)n1	ZINC000872428968	ED	On-Demand	Anodyne	PIK3CB	23	40
Nc1nc(NCc2ccccc2N2CCOCC2)nc(C(F)F)n1	ZINC000872428968	ED	On-Demand	Anodyne	STAT6	54	37
NC(=O)c1cc(N2CCC(OCCc3ccccc3)CC2)nc(Cl)n1	ZINC000872428990	FE	On-Demand	Anodyne	P2RY12	46	38
NC(=O)c1cc(N2CCC(OCCc3ccccc3)CC2)nc(Cl)n1	ZINC000872428990	FE	On-Demand	Anodyne	SCD1	34	46
Cc1c(F)ncnc1NCc1ccccc1OCCN1CCOCC1	ZINC000872429009	EE	On-Demand	Anodyne	EGFR	19	40
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc(OC)c1OCC(F)F	ZINC000872429052	GD	On-Demand	Reactive	GCGR	22	51
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc(OC)c1OCC(F)F	ZINC000872429052	GD	On-Demand	Reactive	PDE10A	26	48
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc(OC)c1OCC(F)F	ZINC000872429052	GD	On-Demand	Reactive	ADCYAP1R1	75	48
Nc1nc(C(F)F)nc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)n1	ZINC000872429062	GE	On-Demand	Anodyne	DRD4	17	47
O=[N+]([O-])c1cccc(CN=c2cc[nH]cc2C2CC2)c1	ZINC000872429100	CF	On-Demand	Bother	CACNA1D	51	33
CCC(=NNC(=O)c1ccc(=O)n(C)c1)c1cc(C)ccc1OC	ZINC000872429108	EE	On-Demand	Reactive	KCNK3	41	41
CCC(=NNC(=O)c1ccc(=O)n(C)c1)c1cc(C)ccc1OC	ZINC000872429108	EE	On-Demand	Reactive	KCNK9	44	41
c1cnc2nccc(N3CCN(C4CC4)CC3)c2c1	ZINC000872429124	CD	On-Demand	Anodyne	EBP	29	45
C[C@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872429140	FE	On-Demand	Reactive	DRD4	28	40
C[C@@H]1CN(Cc2ccccc2)CCC1=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872429141	FE	On-Demand	Reactive	DRD4	28	40
O=C(CNc1cc(Cl)nnc1O)N1CCN(c2ccccc2)CC1	ZINC000872429145	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	HTR1A	93	48
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	DRD2	71	48
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	DRD1	22	46
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	DRD4	42	48
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	ADRA1D	76	43
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	HTR2A	23	42
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	ADRA1A	69	45
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	ADRA1B	55	43
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	DRD3	83	47
COc1ccccc1N1CCC(=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429152	FD	On-Demand	Reactive	HTR7	58	46
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872429161	FD	On-Demand	Reactive	DRD4	30	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872429161	FD	On-Demand	Reactive	CYP2J2	45	32
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872429162	FD	On-Demand	Reactive	DRD4	30	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872429162	FD	On-Demand	Reactive	CYP2J2	45	32
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	HTR1A	115	48
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	DRD2	91	49
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	DRD1	28	43
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	DRD4	56	45
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	ADRA1D	51	41
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	HTR2A	63	42
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	HTR2C	40	42
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	SLC6A4	29	42
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	ADRA1A	46	41
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	ADRA1B	38	41
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	DRD3	109	49
C#CCCN1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872429170	DG	On-Demand	Mild	HTR7	76	39
CCCCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429178	FF	On-Demand	Reactive	GCGR	15	41
CCCCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429178	FF	On-Demand	Reactive	PDE10A	22	42
CCCCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429178	FF	On-Demand	Reactive	ADCYAP1R1	67	40
O=C(NC1CCN(c2ccnc3ncccc23)CC1)C1CCCCC1	ZINC000872429199	EG	On-Demand	Anodyne	PRKD1	34	41
O=C(NC1CCN(c2ccnc3ncccc23)CC1)C1CCCCC1	ZINC000872429199	EG	On-Demand	Anodyne	EPHX2	28	47
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C)CC1	ZINC000872429200	CC	On-Demand	Mild	PKM	21	41
Nc1nc(C(F)F)nc(N2CCC(C(=O)NC3CCCCC3)CC2)n1	ZINC000872429221	FE	On-Demand	Anodyne	EPHX2	24	44
CC(CCc1ccc(C)cc1)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872429224	DE	On-Demand	Reactive	PPO2	34	40
O=C(NC1CCCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872429237	EG	On-Demand	Anodyne	PRKD1	37	44
O=C(NC1CCCCC1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872429237	EG	On-Demand	Anodyne	EPHX2	31	50
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCCCC1	ZINC000872429240	DG	On-Demand	Anodyne	PKM	52	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCCCC1	ZINC000872429240	DG	On-Demand	Anodyne	NAMPT	15	40
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c(C#N)c1	ZINC000872429255	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c(C#N)c1	ZINC000872429256	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c(C#N)c1	ZINC000872429257	CD	On-Demand	Mild	TRPV4	43	35
CCCCCCCC(C)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872429260	CF	On-Demand	Reactive	PPO2	17	41
O=C(CNc1ccnc2ncccc12)N1CCN(c2ccccc2)CC1	ZINC000872429280	EE	On-Demand	Anodyne	HTR1A	15	40
O=C(CNc1ccnc2ncccc12)N1CCN(c2ccccc2)CC1	ZINC000872429280	EE	On-Demand	Anodyne	SCD	20	40
CCCCCCC(C)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872429285	CE	On-Demand	Reactive	PPO2	17	41
CN1CCN(c2cccc(Cl)c2C=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429291	GD	On-Demand	Reactive	DRD2	28	41
CN1CCN(c2cccc(Cl)c2C=NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000872429291	GD	On-Demand	Reactive	DRD3	53	39
O=C(NCCCN1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429306	GE	On-Demand	Anodyne	HTR1A	18	44
O=C(NCCCN1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429306	GE	On-Demand	Anodyne	DRD2	21	43
O=C(NCCCN1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429306	GE	On-Demand	Anodyne	DRD3	41	43
O=C(NCCCN1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429306	GE	On-Demand	Anodyne	HRP1_PLAFA	30	45
O=C(NCCCN1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429306	GE	On-Demand	Anodyne	TBK1	50	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCCC1	ZINC000872429328	CF	On-Demand	Anodyne	PKM	52	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCCC1	ZINC000872429328	CF	On-Demand	Anodyne	NAMPT	15	40
CCOCc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429330	ED	On-Demand	Reactive	GCGR	17	40
CCOCc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429330	ED	On-Demand	Reactive	ADCYAP1R1	68	40
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872429342	FF	On-Demand	Anodyne	FDFT1	18	44
CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872429352	DD	On-Demand	Anodyne	PKM	42	53
CCCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872429359	EG	On-Demand	Anodyne	PKM	30	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccccn3)cc2N1	ZINC000872429382	FE	On-Demand	Anodyne	PKM	37	44
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872429397	ED	On-Demand	Anodyne	PKM	51	41
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872429397	ED	On-Demand	Anodyne	TGM2	64	36
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872429397	ED	On-Demand	Anodyne	GCK	47	32
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872429397	ED	On-Demand	Anodyne	F13A1	67	37
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCc1cccnc1	ZINC000872429401	FG	On-Demand	Anodyne	TBXAS1	39	46
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cc(C)c(C)cc1C	ZINC000872429403	DE	On-Demand	Reactive	PYK	59	33
O=C(NCCc1cccs1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872429405	FH	On-Demand	Anodyne	TBK1	51	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccncc3)cc2N1	ZINC000872429420	FE	On-Demand	Anodyne	PKM	38	47
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOCC1	ZINC000872429430	CD	On-Demand	Anodyne	PKM	55	46
COCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872429433	ED	On-Demand	Anodyne	PKM	39	49
Cn1ncc2c(NCc3ccccc3N3CCOCC3)nc(Cl)nc21	ZINC000872429446	FE	On-Demand	Anodyne	ABL1	17	40
Cn1ncc2c(NCc3ccccc3N3CCOCC3)nc(Cl)nc21	ZINC000872429446	FE	On-Demand	Anodyne	PIK3CB	25	41
Cc1c(F)ncnc1N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000872429456	DF	On-Demand	Anodyne	EPHX2	26	45
Cc1c(F)ncnc1N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000872429456	DF	On-Demand	Anodyne	SIRT3	68	35
Cc1c(F)ncnc1N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000872429456	DF	On-Demand	Anodyne	SIRT2	52	34
Cc1c(F)ncnc1N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000872429456	DF	On-Demand	Anodyne	SIRT1	50	34
C[C@@H](CCN(C)C)Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872429470	CC	On-Demand	Anodyne	UTS2	40	30
Cc1c(F)ncnc1N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000872429484	DH	On-Demand	Anodyne	SLC9A1	15	40
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(N2CCOCC2)c1	ZINC000872429490	FD	On-Demand	Reactive	ABAT	19	41
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(OCCN(C)C)c1	ZINC000872429496	FD	On-Demand	Reactive	ESRRG	50	34
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cccc(OCCN(C)C)c1	ZINC000872429496	FD	On-Demand	Reactive	UTS2	42	33
Cc1c(F)ncnc1N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872429525	DF	On-Demand	Anodyne	EPHX2	29	49
Cc1c(F)ncnc1N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872429525	DF	On-Demand	Anodyne	SIRT3	66	35
Cc1c(F)ncnc1N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872429525	DF	On-Demand	Anodyne	SIRT2	52	34
Cc1c(F)ncnc1N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872429525	DF	On-Demand	Anodyne	SIRT1	50	33
Cc1cccc(C#N)c1S(=O)(=O)NC1CCCC1	ZINC000872429540	CE	On-Demand	Mild	CCR8	44	34
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1cc(C)sc1C	ZINC000872429544	DE	On-Demand	Reactive	PYK	43	33
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC(=O)C1CC1	ZINC000872429545	FD	On-Demand	Reactive	PDE10A	17	40
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC(=O)C1CC1	ZINC000872429545	FD	On-Demand	Reactive	ADCYAP1R1	44	39
COC(=O)c1ccc(OS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1	ZINC000872429553	ED	On-Demand	Anodyne	ACR	46	43
COC(=O)c1ccc(OS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1	ZINC000872429554	ED	On-Demand	Anodyne	ACR	46	43
CCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429559	ED	On-Demand	Reactive	GCGR	19	42
CCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429559	ED	On-Demand	Reactive	PDE10A	23	43
CCCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC	ZINC000872429559	ED	On-Demand	Reactive	ADCYAP1R1	69	41
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1ccc(O)c(CN2CCCCC2)c1	ZINC000872429572	GE	On-Demand	Reactive	PYK	40	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC1	ZINC000872429577	CF	On-Demand	Anodyne	PKM	53	44
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC(C)C	ZINC000872429588	ED	On-Demand	Reactive	PDE10A	23	45
COc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OC(C)C	ZINC000872429588	ED	On-Demand	Reactive	ADCYAP1R1	57	41
CCCOc1c(C=NNC(=O)c2ccc(=O)n(C)c2)cccc1OCC	ZINC000872429603	FE	On-Demand	Reactive	GCGR	35	42
CCCOc1c(C=NNC(=O)c2ccc(=O)n(C)c2)cccc1OCC	ZINC000872429603	FE	On-Demand	Reactive	ADCYAP1R1	55	36
CCOc1cccc([C@@H](C)Nc2cc(Cl)nnc2O)c1	ZINC000872429611	CG	On-Demand	Anodyne	PDS	45	42
CCOc1cccc([C@H](C)Nc2cc(Cl)nnc2O)c1	ZINC000872429612	CG	On-Demand	Anodyne	PDS	45	42
O=S(=O)(NCCN1CCOCC1)c1cccc(Br)n1	ZINC000872429623	FC	On-Demand	Anodyne	HTR7	26	41
O=S(=O)(CC1CC2(CCC2)C1)NCc1cccnc1	ZINC000872429630	CE	On-Demand	Anodyne	NAMPT	41	40
CCCOc1c(Cl)cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OC	ZINC000872429631	GF	On-Demand	Reactive	GCGR	33	56
CCCOc1c(Cl)cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OC	ZINC000872429631	GF	On-Demand	Reactive	PDE10A	22	42
CCCOc1c(Cl)cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OC	ZINC000872429631	GF	On-Demand	Reactive	ADCYAP1R1	84	50
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1ccc(C(C)C)cc1	ZINC000872429635	DF	On-Demand	Reactive	PPO2	29	51
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429637	ED	On-Demand	Mild	P2RY12	24	40
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429637	ED	On-Demand	Mild	EPHX2	36	48
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429637	ED	On-Demand	Mild	TRPV4	47	38
NC(=O)c1cc(N2CCC(CN3CCCCC3)CC2)nc(Cl)n1	ZINC000872429663	ED	On-Demand	Anodyne	SIRT3	16	47
Cc1ccc(S(=O)(=O)N2CCN(C)CC2)c(C#N)c1	ZINC000872429669	CC	On-Demand	Mild	TRPV4	46	38
C/C=C/COc1ccc(CCC(C)=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429671	FG	On-Demand	Reactive	PPO2	41	44
C/C=C\COc1ccc(CCC(C)=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429672	FG	On-Demand	Reactive	PPO2	41	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccco3)cc2N1	ZINC000872429674	FF	On-Demand	Anodyne	PKM	38	45
O=C(NC1CCN(c2nc(Cl)nc3sccc23)CC1)C1CCCCC1	ZINC000872429677	GI	On-Demand	Anodyne	PRKD1	26	41
O=C(NC1CCN(c2nc(Cl)nc3sccc23)CC1)C1CCCCC1	ZINC000872429677	GI	On-Demand	Anodyne	EPHX2	17	41
O=C(NC1CCN(c2cc(Cl)nnc2O)CC1)C1CCCCC1	ZINC000872429681	EF	On-Demand	Anodyne	EPHX2	21	43
O=C(NC1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429698	EF	On-Demand	Anodyne	EPHX2	25	48
O=C(NC1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429698	EF	On-Demand	Anodyne	SIRT3	42	33
O=C(NC1CCCCC1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872429698	EF	On-Demand	Anodyne	PTGES	31	40
CCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OCC(F)(F)F	ZINC000872429704	GE	On-Demand	Reactive	GCGR	16	41
CCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OCC(F)(F)F	ZINC000872429704	GE	On-Demand	Reactive	ADCYAP1R1	69	43
CC[C@H](C)NC(=O)[C@@H](C)Nc1cc(-c2ccccc2)ncn1	ZINC000872429708	CF	On-Demand	Anodyne	ACE2	47	33
CC[C@H](C)NC(=O)[C@H](C)Nc1cc(-c2ccccc2)ncn1	ZINC000872429709	CF	On-Demand	Anodyne	ACE2	47	33
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)C1CCCCC1	ZINC000872429712	FH	On-Demand	Anodyne	CNR1	18	45
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)C1CCCCC1	ZINC000872429712	FH	On-Demand	Anodyne	GSK3A	17	41
O=C(NC1CCN(c2cc(-c3ccccc3)ncn2)CC1)C1CCCCC1	ZINC000872429712	FH	On-Demand	Anodyne	EPHX2	28	49
COCCOc1ccc(C(C)=NNC(=O)c2ccc(=O)n(C)c2)cc1OC	ZINC000872429736	FD	On-Demand	Reactive	SLC9A1	43	31
Cc1c(F)ncnc1N1CCC(C(=O)NCCc2cccs2)CC1	ZINC000872429738	EF	On-Demand	Anodyne	SIRT3	54	38
Cc1c(F)ncnc1N1CCC(C(=O)NCCc2cccs2)CC1	ZINC000872429738	EF	On-Demand	Anodyne	SIRT2	53	38
Cc1c(F)ncnc1N1CCC(C(=O)NCCc2cccs2)CC1	ZINC000872429738	EF	On-Demand	Anodyne	SIRT1	53	38
Cc1c(F)ncnc1N1CCC(C(=O)NCCc2cccs2)CC1	ZINC000872429738	EF	On-Demand	Anodyne	LIMK2	26	44
Cc1ccc(S(=O)(=O)N2CCOCC2)c(C#N)c1	ZINC000872429742	CC	On-Demand	Mild	TRPV4	45	38
CCOC(=O)N1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872429743	ED	On-Demand	Mild	P2RY12	42	37
CCOC(=O)N1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872429743	ED	On-Demand	Mild	TGM2	41	46
CCOC(=O)N1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872429743	ED	On-Demand	Mild	F13A1	53	46
CCC(CC)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872429746	CG	On-Demand	Anodyne	LEF	38	47
NC(=O)c1cc(Nc2cccc(CN3CCOCC3)c2)nc(Cl)n1	ZINC000872429753	ED	On-Demand	Anodyne	CASR	40	38
NC(=O)c1cc(Nc2cccc(CN3CCOCC3)c2)nc(Cl)n1	ZINC000872429753	ED	On-Demand	Anodyne	STAT6	55	40
CCCCCOc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429783	EF	On-Demand	Reactive	PLA2G4B	90	40
CCCCCOc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429783	EF	On-Demand	Reactive	FAAH	26	48
CCCCCOc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429783	EF	On-Demand	Reactive	ADCYAP1R1	62	42
O=S(=O)(NCCCN1CCOCC1)c1cccc(Br)n1	ZINC000872429789	FC	On-Demand	Anodyne	HTR2A	21	40
O=S(=O)(NCCCN1CCOCC1)c1cccc(Br)n1	ZINC000872429789	FC	On-Demand	Anodyne	HTR7	43	43
O=S(=O)(NCCCN1CCOCC1)c1cccc(Br)n1	ZINC000872429789	FC	On-Demand	Anodyne	HTR6	19	40
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872429802	ED	On-Demand	Mild	SLC6A1	71	35
CCOc1ccc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OCC	ZINC000872429816	ED	On-Demand	Reactive	ADCYAP1R1	68	40
CCOC(=O)CCOc1ccc(C(C)=NNC(=O)c2ccc(=O)n(C)c2)cc1	ZINC000872429823	GD	On-Demand	Reactive	PPO2	44	42
Cc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c(C#N)c1	ZINC000872429824	EE	On-Demand	Mild	TRPV4	43	35
CCOC(=O)N1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872429826	GD	On-Demand	Anodyne	P2RY12	47	37
CCOC(=O)N1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872429826	GD	On-Demand	Anodyne	TGM2	47	47
CCOC(=O)N1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872429826	GD	On-Demand	Anodyne	F13A1	61	47
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872429846	ED	On-Demand	Mild	EPHX2	17	41
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872429846	ED	On-Demand	Mild	TRPV4	43	35
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429852	ED	On-Demand	Mild	P2RY12	44	38
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429852	ED	On-Demand	Mild	TRPV4	51	42
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429852	ED	On-Demand	Mild	TGM2	35	46
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872429852	ED	On-Demand	Mild	F13A1	48	46
CN1CCC(N(C)S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872429896	GE	On-Demand	Anodyne	PKM	31	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccn2)CC1	ZINC000872429954	FF	On-Demand	Anodyne	EBP	24	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccn2)CC1	ZINC000872429954	FF	On-Demand	Anodyne	PKM	48	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccn2)CC1	ZINC000872429954	FF	On-Demand	Anodyne	GCK	48	43
CCOCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872429995	FE	On-Demand	Anodyne	PKM	39	48
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1sc2nc(C)nc(C)c2c1C	ZINC000872430001	FE	On-Demand	Reactive	MKNK2	15	40
O=C1OCC[C@@H]1NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872430041	FD	On-Demand	Anodyne	LUXR	75	57
O=C1OCC[C@@H]1NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872430041	FD	On-Demand	Anodyne	TRAR	87	58
O=C1OCC[C@@H]1NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872430041	FD	On-Demand	Anodyne	LASR	43	40
CN1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430044	DE	On-Demand	Anodyne	PKM	51	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncccn2)CC1	ZINC000872430059	FE	On-Demand	Anodyne	PKM	50	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncccn2)CC1	ZINC000872430059	FE	On-Demand	Anodyne	GCK	47	41
O=S(=O)(NC1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430068	CF	On-Demand	Anodyne	ADRA1D	23	41
O=S(=O)(NC1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430068	CF	On-Demand	Anodyne	ADRA1A	16	41
O=S(=O)(NC1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430068	CF	On-Demand	Anodyne	ADRA1B	18	41
O=S(=O)(NC1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430068	CF	On-Demand	Anodyne	LEF	22	43
O=S(=O)(NC1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430068	CF	On-Demand	Anodyne	BRD4	23	44
CC(=NNC(=O)c1ccc(=O)n(C)c1)c1ccc(OCCN(C)C)cc1	ZINC000872430085	FD	On-Demand	Reactive	ESRRG	54	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCCC1	ZINC000872430086	CD	On-Demand	Mild	PKM	20	40
O=S(=O)(NCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430092	ED	On-Demand	Anodyne	HTR2A	17	42
O=S(=O)(NCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430092	ED	On-Demand	Anodyne	HTR7	35	43
O=S(=O)(NCCN1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872430092	ED	On-Demand	Anodyne	HTR6	16	42
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H](C)O1	ZINC000872430126	FE	On-Demand	Anodyne	PKM	28	42
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H](C)O1	ZINC000872430128	FE	On-Demand	Anodyne	PKM	28	42
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H](C)O1	ZINC000872430130	FE	On-Demand	Anodyne	PKM	28	42
COCCN(CCOC)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430135	GD	On-Demand	Anodyne	PKM	34	41
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCn1ccnc1	ZINC000872430146	GF	On-Demand	Anodyne	TBXAS1	43	54
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCn1ccnc1	ZINC000872430146	GF	On-Demand	Anodyne	HMOX2	44	32
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCn1ccnc1	ZINC000872430146	GF	On-Demand	Anodyne	QPCT	36	51
CCOC(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872430159	ED	On-Demand	Mild	EPHX2	29	41
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	HTR1A	86	46
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	DRD2	63	50
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	DRD1	15	42
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	ADRA1D	76	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	HTR2A	20	42
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	ADRA1A	65	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	ADRA1B	60	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	DRD3	62	50
COc1ccccc1N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872430169	GD	On-Demand	Anodyne	HTR7	53	46
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	HTR1A	86	46
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	DRD2	63	50
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	DRD1	15	42
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	ADRA1D	76	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	HTR2A	20	42
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	ADRA1A	65	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	ADRA1B	60	44
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	DRD3	62	50
COc1ccccc1N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872430170	GD	On-Demand	Anodyne	HTR7	53	46
COCCCOc1cccc(C=NNC(=O)c2ccc(=O)n(C)c2)c1	ZINC000872430175	ED	On-Demand	Reactive	ADCYAP1R1	73	43
CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430176	DD	On-Demand	Anodyne	PKM	39	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCOCC3)cc2N1	ZINC000872430178	ED	On-Demand	Anodyne	PKM	30	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3cccnc3)cc2N1	ZINC000872430191	FE	On-Demand	Anodyne	PKM	36	44
CCOc1cc(C=NNC(=O)c2ccc(=O)n(C)c2)ccc1OCC(C)C	ZINC000872430196	FF	On-Demand	Reactive	ADCYAP1R1	64	37
O=C(c1ccco1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430213	GF	On-Demand	Anodyne	PKM	47	38
O=C(c1ccco1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430213	GF	On-Demand	Anodyne	TGM2	52	35
O=C(c1ccco1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430213	GF	On-Demand	Anodyne	F13A1	58	35
CCCCCC(C)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872430215	CE	On-Demand	Reactive	PPO2	19	40
C#CCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872430219	CE	On-Demand	Mild	DRD4	33	44
CCOc1cccc([C@@H](C)Nc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872430224	DF	On-Demand	Anodyne	PDS	45	41
CCOc1cccc([C@H](C)Nc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872430226	DF	On-Demand	Anodyne	PDS	45	41
CCOc1cccc([C@@H](C)Nc2nc(N)nc(C(F)F)n2)c1	ZINC000872430228	DF	On-Demand	Anodyne	HTR7	15	48
CCOc1cccc([C@H](C)Nc2nc(N)nc(C(F)F)n2)c1	ZINC000872430230	DF	On-Demand	Anodyne	HTR7	15	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCC3)cc2N1	ZINC000872430235	EE	On-Demand	Anodyne	PKM	36	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCCC3)cc2N1	ZINC000872430242	EF	On-Demand	Anodyne	PKM	34	46
Cn1ncc2c(N3CCC(C(=O)NC4CCCCC4)CC3)nc(Cl)nc21	ZINC000872430243	GF	On-Demand	Anodyne	PRKD1	32	42
Cn1ncc2c(N3CCC(C(=O)NC4CCCCC4)CC3)nc(Cl)nc21	ZINC000872430243	GF	On-Demand	Anodyne	EPHX2	20	43
Cn1ncc2c(N3CCC(C(=O)NC4CCCCC4)CC3)nc(Cl)nc21	ZINC000872430243	GF	On-Demand	Anodyne	PTGES	27	40
O=C(NC1CCN(c2ccncc2C2CC2)CC1)C1CCCCC1	ZINC000872430266	EH	On-Demand	Anodyne	C3AR1	40	38
O=C(NC1CCN(c2ccncc2C2CC2)CC1)C1CCCCC1	ZINC000872430266	EH	On-Demand	Anodyne	PRKD1	24	41
O=C(NC1CCN(c2ccncc2C2CC2)CC1)C1CCCCC1	ZINC000872430266	EH	On-Demand	Anodyne	EPHX2	23	41
O=C(NC1CCCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872430275	EH	On-Demand	Anodyne	PRKD1	36	45
O=C(NC1CCCCC1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872430275	EH	On-Demand	Anodyne	EPHX2	29	46
Oc1nnc(Cl)cc1N1CCC(CN2CCCCC2)CC1	ZINC000872430276	DF	On-Demand	Anodyne	SIRT3	15	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCN3CCOCC3)cc2N1	ZINC000872430290	GD	On-Demand	Anodyne	PKM	35	47
CC(CCc1ccc(OC(F)F)cc1)=NNC(=O)c1ccc(=O)n(C)c1	ZINC000872430293	FF	On-Demand	Reactive	PPO2	39	47
Cn1ncc2c(NC3CCN(CC4CCCC4)CC3)nc(Cl)nc21	ZINC000872430295	EG	On-Demand	Anodyne	EHMT2	57	38
Cn1ncc2c(NC3CCN(CC4CCCC4)CC3)nc(Cl)nc21	ZINC000872430295	EG	On-Demand	Anodyne	Q4VQ11_PIG	41	35
C=CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430307	DE	On-Demand	Mild	PKM	38	47
CC[C@@H](Nc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872430308	CF	On-Demand	Anodyne	TPH1	26	41
CC[C@H](Nc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872430309	CF	On-Demand	Anodyne	TPH1	26	41
CN1CCC(N(C)S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872430311	GF	On-Demand	Anodyne	NMT1	18	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCn1ccnc1	ZINC000872430315	DD	On-Demand	Mild	TBXAS1	39	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCCC3)cc2N1	ZINC000872430328	EF	On-Demand	Anodyne	PKM	39	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCCC3)cc2N1	ZINC000872430328	EF	On-Demand	Anodyne	BRD4	21	45
CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872430343	DC	On-Demand	Mild	EPHX2	15	42
CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872430343	DC	On-Demand	Mild	TRPV4	47	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)cc2N1	ZINC000872430347	FE	On-Demand	Anodyne	PKM	37	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)cc2N1	ZINC000872430350	FE	On-Demand	Anodyne	PKM	37	45
O=C(NC1CCCCC1)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872430366	GI	On-Demand	Anodyne	PRKD1	36	44
O=C(NC1CCCCC1)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872430366	GI	On-Demand	Anodyne	EPHX2	21	46
CN(C)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430392	FD	On-Demand	Anodyne	PKM	39	49
NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872430395	CD	On-Demand	Anodyne	CRTM	15	44
O=S(=O)(NCCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872430401	EE	On-Demand	Anodyne	TBXAS1	56	54
O=S(=O)(NCCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872430401	EE	On-Demand	Anodyne	HMOX2	47	33
O=S(=O)(NCCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872430401	EE	On-Demand	Anodyne	QPCT	33	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccc2O)CC1	ZINC000872430409	GF	On-Demand	Anodyne	PKM	52	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccc2O)CC1	ZINC000872430409	GF	On-Demand	Anodyne	GCK	42	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccccc2O)CC1	ZINC000872430409	GF	On-Demand	Anodyne	NOD2	18	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3ccccn3)cc2N1	ZINC000872430438	GF	On-Demand	Anodyne	PKM	37	45
CCCOc1ccc([C@@H](C)Nc2nc(N)nc(C(F)F)n2)cc1	ZINC000872430443	DG	On-Demand	Anodyne	HTR7	17	59
CCCOc1ccc([C@H](C)Nc2nc(N)nc(C(F)F)n2)cc1	ZINC000872430444	DG	On-Demand	Anodyne	HTR7	17	59
CCCOc1c(Cl)cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OCC	ZINC000872430460	GF	On-Demand	Reactive	GCGR	31	48
CCCOc1c(Cl)cc(C=NNC(=O)c2ccc(=O)n(C)c2)cc1OCC	ZINC000872430460	GF	On-Demand	Reactive	ADCYAP1R1	76	42
CC(=O)Nc1ccc(OS(=O)(=O)CC2CC3(CCC3)C2)cc1	ZINC000872430491	DF	On-Demand	Anodyne	CA2	15	40
CC(=O)Nc1ccc(OS(=O)(=O)CC2CC3(CCC3)C2)cc1	ZINC000872430491	DF	On-Demand	Anodyne	CA1	46	37
CC(=O)Nc1ccc(OS(=O)(=O)CC2CC3(CCC3)C2)cc1	ZINC000872430491	DF	On-Demand	Anodyne	CA12	23	40
CC(=O)Nc1ccc(OS(=O)(=O)CC2CC3(CCC3)C2)cc1	ZINC000872430491	DF	On-Demand	Anodyne	CA9	24	40
CN(C)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430503	DD	On-Demand	Anodyne	LEF	27	41
CCC(=NNC(=O)c1ccc(=O)n(C)c1)c1ccc(OC)c(OC)c1	ZINC000872430511	ED	On-Demand	Reactive	ENPP1	51	32
CCC(=NNC(=O)c1ccc(=O)n(C)c1)c1ccc(OC)c(OC)c1	ZINC000872430511	ED	On-Demand	Reactive	KCNK3	43	37
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	APP	46	39
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	PKM	44	38
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	TGM2	71	54
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	F13A1	84	54
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	GPR119	28	41
CCOC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430534	FE	On-Demand	Anodyne	NOD2	17	40
CCCCCN1C(=O)C(=NNC(=O)c2ccc(=O)n(C)c2)c2ccccc21	ZINC000872430536	FE	On-Demand	Reactive	ALDH1A1	26	50
CCCCCN1C(=O)C(=NNC(=O)c2ccc(=O)n(C)c2)c2ccccc21	ZINC000872430536	FE	On-Demand	Reactive	ALDH3A1	19	50
Cc1ccc(S(=O)(=O)N2CCN(c3ccccc3O)CC2)c(C#N)c1	ZINC000872430537	FE	On-Demand	Mild	TRPV4	43	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCn3ccnc3)cc2N1	ZINC000872430544	GE	On-Demand	Anodyne	PKM	30	45
CCN(CC)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430546	EF	On-Demand	Anodyne	PKM	38	45
O=S(=O)(NCCCn1ccnc1)c1cccc(Br)n1	ZINC000872430549	ED	On-Demand	Anodyne	CYP19A1	15	53
O=S(=O)(NCCCn1ccnc1)c1cccc(Br)n1	ZINC000872430549	ED	On-Demand	Anodyne	TBXAS1	49	45
O=S(=O)(NCCCn1ccnc1)c1cccc(Br)n1	ZINC000872430549	ED	On-Demand	Anodyne	HMOX2	50	42
O=S(=O)(NCCCn1ccnc1)c1cccc(Br)n1	ZINC000872430549	ED	On-Demand	Anodyne	QPCT	37	42
NC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430579	ED	On-Demand	Anodyne	EPHX2	32	43
NC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430579	ED	On-Demand	Anodyne	PKM	42	38
NC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430579	ED	On-Demand	Anodyne	AKR1C3	15	42
NC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430579	ED	On-Demand	Anodyne	NAMPT	16	41
Cc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)c(C#N)c1	ZINC000872430617	ED	On-Demand	Mild	DRD4	26	40
Cc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)c(C#N)c1	ZINC000872430617	ED	On-Demand	Mild	TRPV4	42	35
COC(=O)CCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430624	FF	On-Demand	Anodyne	TBXA2R	45	35
COC(=O)CCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430624	FF	On-Demand	Anodyne	LEF	31	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430634	DD	On-Demand	Anodyne	F10	18	40
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430634	DD	On-Demand	Anodyne	LUXR	57	39
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430634	DD	On-Demand	Anodyne	TRAR	63	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)c2ccccc2)CC1	ZINC000872430651	FE	On-Demand	Mild	SMO	31	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872430661	ED	On-Demand	Mild	FKBP1A	48	46
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872430661	ED	On-Demand	Mild	EPHX2	15	40
O=S(=O)(CC1CC2(CCC2)C1)N1CCN(c2ccccn2)CC1	ZINC000872430663	EE	On-Demand	Anodyne	DRD4	22	40
CCCOc1ccc([C@H](C)Nc2cc(Cl)nnc2O)cc1	ZINC000872430664	DH	On-Demand	Anodyne	ACACA	15	43
CCCOc1ccc([C@H](C)Nc2cc(Cl)nnc2O)cc1	ZINC000872430664	DH	On-Demand	Anodyne	ACACB	18	43
CCCOc1ccc([C@@H](C)Nc2cc(Cl)nnc2O)cc1	ZINC000872430665	DH	On-Demand	Anodyne	ACACA	15	43
CCCOc1ccc([C@@H](C)Nc2cc(Cl)nnc2O)cc1	ZINC000872430665	DH	On-Demand	Anodyne	ACACB	18	43
COc1ccc(CN(C)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1OC	ZINC000872430678	GE	On-Demand	Anodyne	MT-ND1	18	41
COc1ccc(CN(C)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1OC	ZINC000872430679	GE	On-Demand	Anodyne	MT-ND1	18	41
CC(=O)N1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872430696	GE	On-Demand	Anodyne	EPHX2	15	47
CC[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872430697	EF	On-Demand	Anodyne	CASP7	46	34
CC[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872430698	EF	On-Demand	Anodyne	CASP7	46	34
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c(C#N)c1	ZINC000872430717	FD	On-Demand	Mild	TRPV4	40	33
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c(C#N)c1	ZINC000872430728	CF	On-Demand	Mild	TRPV4	44	37
Cc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c(C#N)c1	ZINC000872430729	CF	On-Demand	Mild	TRPV4	44	37
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c(C#N)c1	ZINC000872430730	CF	On-Demand	Mild	TRPV4	44	37
CC(=O)N1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872430761	GD	On-Demand	Anodyne	PKM	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)OCC(F)(F)F)cc2N1	ZINC000872430765	FF	On-Demand	Mild	PKM	25	40
CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430775	CE	On-Demand	Anodyne	PNMT	15	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(c2ccccn2)CC1	ZINC000872430793	ED	On-Demand	Mild	DRD4	26	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(c2ccccn2)CC1	ZINC000872430793	ED	On-Demand	Mild	EBP	25	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c(C#N)c1	ZINC000872430799	FE	On-Demand	Mild	EPHX2	18	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c(C#N)c1	ZINC000872430799	FE	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c(C#N)c1	ZINC000872430799	FE	On-Demand	Mild	SMO	31	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3cccs3)cc2N1	ZINC000872430813	FG	On-Demand	Anodyne	PKM	37	45
O=C1OCC[C@@H]1NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872430824	CC	On-Demand	Anodyne	TRAR	57	33
O=C1OCC[C@@H]1NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872430824	CC	On-Demand	Anodyne	LASR	42	31
CN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)c1cccc(Br)n1	ZINC000872430847	GE	On-Demand	Anodyne	BMP1	67	38
COC[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430867	CE	On-Demand	Anodyne	LEF	37	41
COC[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872430868	CE	On-Demand	Anodyne	LEF	37	41
CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872430889	DE	On-Demand	Anodyne	PKM	42	54
CCN(Cc1ccc(C(F)(F)F)cc1)c1cc(Cl)nnc1O	ZINC000872430918	EH	On-Demand	Anodyne	NR1H3	15	45
CCN(Cc1ccc(C(F)(F)F)cc1)c1cc(Cl)nnc1O	ZINC000872430918	EH	On-Demand	Anodyne	NR1H2	16	45
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430919	GF	On-Demand	Anodyne	PKM	48	43
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430919	GF	On-Demand	Anodyne	TGM2	54	34
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430919	GF	On-Demand	Anodyne	F13A1	64	36
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430919	GF	On-Demand	Anodyne	AKR1C3	65	43
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872430919	GF	On-Demand	Anodyne	L3MBTL3	34	44
O=C(CNS(=O)(=O)CC1CC2(CCC2)C1)OCc1ccccc1	ZINC000872430959	EE	On-Demand	Anodyne	SLC12A5	60	35
Cc1ccc(S(=O)(=O)N2CCN(CCO)CC2)c(C#N)c1	ZINC000872430978	DC	On-Demand	Mild	TRPV4	47	39
O=C(NCCNS(=O)(=O)c1cccc(Br)n1)C1CC1	ZINC000872430988	EC	On-Demand	Anodyne	MTNR1A	20	40
CC(C)c1nnc(N[C@H](C)Cn2cncn2)o1	ZINC000872430998	BD	On-Demand	Anodyne	HIS3	49	33
CC(C)c1nnc(N[C@@H](C)Cn2cncn2)o1	ZINC000872430999	BD	On-Demand	Anodyne	HIS3	49	33
O=S(=O)(NCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872431001	DD	On-Demand	Anodyne	TBXAS1	48	48
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCn1ccnc1	ZINC000872431005	FE	On-Demand	Anodyne	TBXAS1	39	51
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCn1ccnc1	ZINC000872431005	FE	On-Demand	Anodyne	QPCT	30	48
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C#N)c1	ZINC000872431006	GC	On-Demand	Mild	TRPV4	40	33
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C#N)c1	ZINC000872431007	GC	On-Demand	Mild	TRPV4	40	33
O=S(=O)(c1cccc(Br)n1)N1CCN(Cc2ccncc2)CC1	ZINC000872431030	GD	On-Demand	Anodyne	ADORA2B	40	33
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431044	GC	On-Demand	Anodyne	BDKRB1	38	42
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431045	GC	On-Demand	Anodyne	BDKRB1	38	42
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431057	ED	On-Demand	Anodyne	FKBP1A	24	40
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431057	ED	On-Demand	Anodyne	MMP7	19	41
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431058	ED	On-Demand	Anodyne	FKBP1A	24	40
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431058	ED	On-Demand	Anodyne	MMP7	19	41
COC(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431064	ED	On-Demand	Anodyne	TBXA2R	46	36
COC(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431064	ED	On-Demand	Anodyne	LEF	32	42
COc1ccc(OC)c2sc(N3CCCOCC3)nc12	ZINC000872431080	CF	On-Demand	Anodyne	PRKDC	20	40
COc1ccc(OC)c2sc(N3CCCOCC3)nc12	ZINC000872431080	CF	On-Demand	Anodyne	GAK	29	41
Oc1nnc(Cl)cc1NCc1ccc(CN2CCCCCC2)cc1	ZINC000872431130	EH	On-Demand	Anodyne	HRH3	21	43
COc1cc2c(cc1OC)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872431135	FF	On-Demand	Mild	ABCB1B	47	34
COc1cc2c(cc1OC)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872431135	FF	On-Demand	Mild	AKR1C3	61	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H]3CCCO3)CC2)c(C#N)c1	ZINC000872431150	FC	On-Demand	Mild	EPHX2	16	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H]3CCCO3)CC2)c(C#N)c1	ZINC000872431151	FC	On-Demand	Mild	EPHX2	16	40
CN1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872431154	FD	On-Demand	Anodyne	PKM	35	45
COc1cc2c(cc1OC)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872431157	FF	On-Demand	Mild	ABCB1B	49	35
COc1cc2c(cc1OC)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872431157	FF	On-Demand	Mild	TRPV4	45	36
COc1cc2c(cc1OC)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872431157	FF	On-Demand	Mild	AKR1C3	50	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000872431164	CC	On-Demand	Mild	LUXR	54	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000872431164	CC	On-Demand	Mild	TRAR	62	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N2CCOCC2)CC1	ZINC000872431177	GD	On-Demand	Mild	EPHX2	28	40
COc1ccc(OC)c2sc(NC3CCN(C(=O)c4ccncc4)CC3)nc12	ZINC000872431185	GG	On-Demand	Anodyne	ADORA2B	19	49
CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872431190	FD	On-Demand	Anodyne	BMP1	43	36
CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872431191	FD	On-Demand	Anodyne	BMP1	43	36
CCOC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872431192	FD	On-Demand	Mild	CCR8	108	52
CCOC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872431192	FD	On-Demand	Mild	SFRP1	100	35
CCOC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872431192	FD	On-Demand	Mild	WNT3	66	33
C[C@@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872431204	EF	On-Demand	Anodyne	GRIA4	21	47
C[C@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872431205	EF	On-Demand	Anodyne	GRIA4	21	47
C[C@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872431206	EF	On-Demand	Anodyne	GRIA4	21	47
C[C@@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872431207	EF	On-Demand	Anodyne	GRIA4	21	47
C#CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872431226	DD	On-Demand	Mild	PKM	40	50
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N3CCOCC3)CC2)c(C#N)c1	ZINC000872431227	GC	On-Demand	Mild	TRPV4	44	35
CCCN(C)c1cc(C)nc2c1cnn2C	ZINC000872431237	BE	On-Demand	Anodyne	CRHR1	21	41
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872431251	ED	On-Demand	Mild	FKBP1A	46	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)c(C#N)c1	ZINC000872431257	ED	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)c(C#N)c1	ZINC000872431257	ED	On-Demand	Mild	TRPV4	44	36
CS(=O)(=O)c1ccc(OS(=O)(=O)CC2CC3(CCC3)C2)cc1	ZINC000872431269	EE	On-Demand	Anodyne	PTGS2	15	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2ccncc2)CC1	ZINC000872431290	GF	On-Demand	Anodyne	ADORA2B	53	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2ccncc2)CC1	ZINC000872431290	GF	On-Demand	Anodyne	LSS	17	61
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2ccncc2)CC1	ZINC000872431290	GF	On-Demand	Anodyne	PKM	41	38
COC(=O)C1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872431302	GF	On-Demand	Anodyne	EPHX2	19	52
COC(=O)C1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872431302	GF	On-Demand	Anodyne	CACNA1G	32	42
CCC(CC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872431316	EG	On-Demand	Anodyne	PKM	41	50
Cc1ccc(S(=O)(=O)N2CCNC(=O)C2)c(C#N)c1	ZINC000872431353	CB	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)c(C#N)c1	ZINC000872431357	ED	On-Demand	Mild	TRPV4	44	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCN3CCCC3)cc2N1	ZINC000872431376	FD	On-Demand	Anodyne	PKM	39	50
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	F2	16	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	PLG	54	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	P2RY12	15	45
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	TRYP_PIG	46	31
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	EPHX2	46	68
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	TGM2	18	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000872431393	GF	On-Demand	Mild	TMPRSS11D	64	38
O=C(CNS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1)NC1CC1	ZINC000872431410	FD	On-Demand	Anodyne	CCR2	54	41
O=C(c1ccc(CNS(=O)(=O)CC2CC3(CCC3)C2)cc1)N1CCCCC1	ZINC000872431414	GG	On-Demand	Anodyne	L3MBTL3	66	38
COc1ccccc1C[C@H]1CCCN1c1cc(C(N)=O)nc(Cl)n1	ZINC000872431419	EE	On-Demand	Anodyne	ACKR3	52	34
COc1ccccc1C[C@@H]1CCCN1c1cc(C(N)=O)nc(Cl)n1	ZINC000872431420	EE	On-Demand	Anodyne	ACKR3	52	34
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N(C)C)CC2)c(C#N)c1	ZINC000872431425	FC	On-Demand	Mild	TRPV4	45	38
O=C(Nc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872431451	GG	On-Demand	Anodyne	EPHX2	36	48
CNC(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431461	CC	On-Demand	Anodyne	LEF	34	40
Cc1ccc(S(=O)(=O)N2CCN(CC(C)C)CC2)c(C#N)c1	ZINC000872431467	DD	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C#N)c1	ZINC000872431486	FC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c(C#N)c1	ZINC000872431501	FD	On-Demand	Mild	ADORA2B	44	38
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c(C#N)c1	ZINC000872431501	FD	On-Demand	Mild	TRPV4	44	36
CCCCNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872431528	GD	On-Demand	Mild	TRPV4	46	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N2CCCCC2)CC1	ZINC000872431536	GE	On-Demand	Mild	EPHX2	33	43
CCOC(=O)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872431538	EE	On-Demand	Anodyne	CCR8	47	43
CCOc1ccccc1OS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872431580	EF	On-Demand	Anodyne	HCN1	40	31
CCOc1ccccc1OS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872431581	EF	On-Demand	Anodyne	HCN1	40	31
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431594	DG	On-Demand	Anodyne	CASP3	53	37
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431594	DG	On-Demand	Anodyne	CASP7	68	37
C[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431595	DG	On-Demand	Anodyne	CASP3	53	37
C[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431595	DG	On-Demand	Anodyne	CASP7	68	37
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872431614	GD	On-Demand	Anodyne	FKBP1A	61	46
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872431614	GD	On-Demand	Anodyne	MMP13	19	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872431614	GD	On-Demand	Anodyne	MMP3	20	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872431614	GD	On-Demand	Anodyne	MMP7	23	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872431614	GD	On-Demand	Anodyne	MMP1	24	42
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872431647	DC	On-Demand	Anodyne	LUXR	64	39
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872431647	DC	On-Demand	Anodyne	TRAR	76	38
COC[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872431674	ED	On-Demand	Anodyne	PKM	39	47
COC[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872431676	ED	On-Demand	Anodyne	PKM	39	47
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	CHRM2	21	40
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	ADRA1D	31	41
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	ADRA1A	22	41
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	ADRA1B	25	41
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	APP	46	38
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	TGM2	17	42
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	ST14	60	36
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	F13A1	23	45
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	CCR8	97	47
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	GPR119	42	40
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	SFRP1	131	40
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431720	GF	On-Demand	Anodyne	WNT3	88	40
Cc1ccc(S(=O)(=O)N2CCN(S(C)(=O)=O)CC2)c(C#N)c1	ZINC000872431723	EC	On-Demand	Mild	TRPV4	46	38
O=C([C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431747	GD	On-Demand	Anodyne	CNR1	15	44
O=C([C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431747	GD	On-Demand	Anodyne	PKM	46	38
CCN(CC)C(=O)C1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872431751	ED	On-Demand	Anodyne	P2RY12	16	40
O=C([C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431752	GD	On-Demand	Anodyne	CNR1	15	44
O=C([C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431752	GD	On-Demand	Anodyne	PKM	46	38
CCN1CCC[C@@H]1CNS(=O)(=O)c1cccc(Br)n1	ZINC000872431760	ED	On-Demand	Anodyne	DRD2	28	40
COc1ccc(CN(C2CC2)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1	ZINC000872431768	FF	On-Demand	Anodyne	AVPR1B	18	40
COc1ccc(CN(C2CC2)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1	ZINC000872431769	FF	On-Demand	Anodyne	AVPR1B	18	40
CCC(CC)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872431787	CE	On-Demand	Mild	NR3C2	18	48
CC(=O)Nc1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872431789	DF	On-Demand	Anodyne	MTNR1B	15	41
CC(=O)Nc1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872431789	DF	On-Demand	Anodyne	EPHX2	20	42
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872431810	FE	On-Demand	Anodyne	HCRTR2	15	44
c1cnc2nccc(NC[C@@H]3CN4CCC[C@@H]4CO3)c2c1	ZINC000872431811	CD	On-Demand	Anodyne	HNMT	51	36
c1cnc2nccc(NC[C@H]3CN4CCC[C@@H]4CO3)c2c1	ZINC000872431813	CD	On-Demand	Anodyne	HNMT	51	36
c1cnc2nccc(NC[C@@H]3CN4CCC[C@H]4CO3)c2c1	ZINC000872431816	CD	On-Demand	Anodyne	HNMT	51	36
c1cnc2nccc(NC[C@H]3CN4CCC[C@H]4CO3)c2c1	ZINC000872431818	CD	On-Demand	Anodyne	HNMT	51	36
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C#N)c1	ZINC000872431824	FC	On-Demand	Mild	EPHX2	32	50
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C#N)c1	ZINC000872431824	FC	On-Demand	Mild	TRPV4	45	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCN(CCO)CC3)cc2N1	ZINC000872431846	GC	On-Demand	Anodyne	PKM	29	40
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C)CC1	ZINC000872431848	CD	On-Demand	Mild	CCR8	74	38
O=S(=O)(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872431855	GE	On-Demand	Anodyne	TGM2	45	41
O=S(=O)(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872431855	GE	On-Demand	Anodyne	F13A1	43	41
CS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872431864	FD	On-Demand	Anodyne	PKM	54	44
NC(=O)c1cc(N2CCC(CCN3CCOCC3)CC2)nc(Cl)n1	ZINC000872431867	FD	On-Demand	Anodyne	SIRT3	38	42
NC(=O)c1cc(N2CCC(CCN3CCOCC3)CC2)nc(Cl)n1	ZINC000872431867	FD	On-Demand	Anodyne	SIRT2	31	42
NC(=O)c1cc(N2CCC(CCN3CCOCC3)CC2)nc(Cl)n1	ZINC000872431867	FD	On-Demand	Anodyne	STAT6	47	32
CN(CC(=O)NC1CC1)S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872431900	GE	On-Demand	Anodyne	CCR2	31	41
Cc1c(F)ncnc1N[C@H](C)Cn1cncn1	ZINC000872431927	BD	On-Demand	Anodyne	HIS3	49	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCOCC3CC3)cc2N1	ZINC000872431929	GF	On-Demand	Anodyne	PKM	31	44
Cc1c(F)ncnc1N[C@@H](C)Cn1cncn1	ZINC000872431931	BD	On-Demand	Anodyne	HIS3	49	34
c1cnc2nccc(N3CCCOCC3)c2c1	ZINC000872431935	BD	On-Demand	Anodyne	METAP1	15	45
Nc1nc(C(F)F)nc(N2CCCOCC2)n1	ZINC000872431937	BC	On-Demand	Anodyne	PIK3CB	16	40
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872431938	GC	On-Demand	Mild	TRPV4	46	36
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CCCC1	ZINC000872431961	CF	On-Demand	Anodyne	CNR2	17	40
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CCCC1	ZINC000872431961	CF	On-Demand	Anodyne	ADK	21	46
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CCCC1	ZINC000872431961	CF	On-Demand	Anodyne	FAAH	33	43
O=C(CNc1cc(-c2ccccc2)ncn1)NC1CCCC1	ZINC000872431961	CF	On-Demand	Anodyne	VCP	62	39
CCN(CC)C(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872431963	EG	On-Demand	Anodyne	P2RY12	45	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCn3ccnc3)cc2N1	ZINC000872431999	FD	On-Demand	Anodyne	PKM	32	45
Cc1ccc(S(=O)(=O)N2CCN(c3ccncc3)CC2)c(C#N)c1	ZINC000872432005	ED	On-Demand	Mild	TRPV4	41	34
FC(F)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872432014	DF	On-Demand	Anodyne	DRD4	20	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)C2CC2)CC1	ZINC000872432021	ED	On-Demand	Mild	F13A1	23	42
CN1CCO[C@@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872432026	CD	On-Demand	Anodyne	TNK2	57	38
CN1CCO[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872432027	CD	On-Demand	Anodyne	TNK2	57	38
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)N1CCN(CCO)CC1	ZINC000872432034	GD	On-Demand	Anodyne	SLC6A5	16	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CCO)CC1	ZINC000872432039	ED	On-Demand	Anodyne	PKM	47	40
c1cnc2nccc(NCCCOC3CCCC3)c2c1	ZINC000872432066	CG	On-Demand	Anodyne	HNMT	61	40
Cc1cccc(C#N)c1S(=O)(=O)NCCCN1CCCCC1	ZINC000872432068	DE	On-Demand	Mild	HRH3	30	40
Cc1cccc(C#N)c1S(=O)(=O)NCCCN1CCCCC1	ZINC000872432068	DE	On-Demand	Mild	HNMT	65	35
CCN(CC)C(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872432073	CE	On-Demand	Anodyne	SIRT3	42	33
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)c(C#N)c1	ZINC000872432099	ED	On-Demand	Mild	EPHX2	28	47
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)c(C#N)c1	ZINC000872432099	ED	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)c(C#N)c1	ZINC000872432099	ED	On-Demand	Mild	TGM2	17	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)c(C#N)c1	ZINC000872432099	ED	On-Demand	Mild	F13A1	29	42
Cc1ccc(S(=O)(=O)N2CCN([C@@H](C#N)c3ccccc3)CC2)c(C#N)c1	ZINC000872432113	GE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CCN([C@H](C#N)c3ccccc3)CC2)c(C#N)c1	ZINC000872432114	GE	On-Demand	Mild	TRPV4	42	35
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCSCC2)cc1	ZINC000872432120	FG	On-Demand	Anodyne	SPHK2	52	32
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCSCC2)cc1	ZINC000872432120	FG	On-Demand	Anodyne	SPHK1	45	32
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	CNR1	16	53
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	LSS	15	48
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	PKM	47	38
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	TGM2	63	47
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	GCK	42	32
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	F13A1	63	52
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432135	FE	On-Demand	Anodyne	NOD2	19	41
c1ccc(-c2cc(N3CCCOCC3)ncn2)cc1	ZINC000872432145	CE	On-Demand	Anodyne	PRKDC	35	42
c1ccc(-c2cc(N3CCCOCC3)ncn2)cc1	ZINC000872432145	CE	On-Demand	Anodyne	ADK	48	40
c1ccc(-c2cc(N3CCCOCC3)ncn2)cc1	ZINC000872432145	CE	On-Demand	Anodyne	PIK3CA	23	44
c1ccc(-c2cc(N3CCCOCC3)ncn2)cc1	ZINC000872432145	CE	On-Demand	Anodyne	PIK3CB	20	44
c1ccc(-c2cc(NC[C@H]3CN4CCC[C@@H]4CO3)ncn2)cc1	ZINC000872432157	DE	On-Demand	Anodyne	TNK2	41	33
c1ccc(-c2cc(NC[C@H]3CN4CCC[C@H]4CO3)ncn2)cc1	ZINC000872432159	DE	On-Demand	Anodyne	TNK2	41	33
c1ccc(-c2cc(NC[C@@H]3CN4CCC[C@@H]4CO3)ncn2)cc1	ZINC000872432161	DE	On-Demand	Anodyne	TNK2	41	33
c1ccc(-c2cc(NC[C@@H]3CN4CCC[C@H]4CO3)ncn2)cc1	ZINC000872432163	DE	On-Demand	Anodyne	TNK2	41	33
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)o1	ZINC000872432176	EH	On-Demand	Anodyne	LEF	36	42
CN(C)C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432178	FE	On-Demand	Anodyne	CHRM5	15	43
CN(C)C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432178	FE	On-Demand	Anodyne	PKM	42	38
NC(=O)c1cc(N2CCCOCC2)nc(Cl)n1	ZINC000872432191	CC	On-Demand	Anodyne	PIK3CB	47	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000872432210	GE	On-Demand	Mild	ADORA2B	43	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N(C)C)CC1	ZINC000872432212	ED	On-Demand	Mild	EPHX2	29	40
COc1ccc(OC)c2sc(N[C@H](C)Cn3cncn3)nc12	ZINC000872432235	DE	On-Demand	Anodyne	HIS3	47	32
COc1ccc(OC)c2sc(N[C@@H](C)Cn3cncn3)nc12	ZINC000872432237	DE	On-Demand	Anodyne	HIS3	47	32
O=C(C1CC1)N1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432245	FD	On-Demand	Anodyne	TGM2	32	41
O=C(C1CC1)N1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432245	FD	On-Demand	Anodyne	F13A1	32	45
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872432265	GE	On-Demand	Anodyne	GPBAR1	23	49
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872432266	GE	On-Demand	Anodyne	GPBAR1	23	49
Cc1c(F)ncnc1N1CCN(c2ncccc2C(N)=O)CC1	ZINC000872432271	DC	On-Demand	Anodyne	ABCC1	26	40
Cc1c(F)ncnc1N1CCN(c2ncccc2C(N)=O)CC1	ZINC000872432271	DC	On-Demand	Anodyne	SIRT3	52	32
O=S(=O)(NCCCOC[C@H]1CCCO1)c1ccc(F)c(C(F)F)c1	ZINC000872432287	FF	On-Demand	Anodyne	HTR7	24	40
O=S(=O)(NCCCOC[C@@H]1CCCO1)c1ccc(F)c(C(F)F)c1	ZINC000872432288	FF	On-Demand	Anodyne	HTR7	24	40
CSCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872432305	EE	On-Demand	Anodyne	PKM	40	51
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432312	FD	On-Demand	Mild	P2RY12	55	40
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432312	FD	On-Demand	Mild	EPHX2	17	41
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432312	FD	On-Demand	Mild	CCR8	116	56
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432312	FD	On-Demand	Mild	SFRP1	125	38
CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432312	FD	On-Demand	Mild	WNT3	84	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccncc2)CC1	ZINC000872432347	FF	On-Demand	Anodyne	PKM	48	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccncc2)CC1	ZINC000872432347	FF	On-Demand	Anodyne	GCK	50	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccncc2)CC1	ZINC000872432347	FF	On-Demand	Anodyne	NOD2	18	40
CCOC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432404	GD	On-Demand	Anodyne	P2RY12	51	35
CCOC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432404	GD	On-Demand	Anodyne	F13A1	18	45
CCOC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432404	GD	On-Demand	Anodyne	CCR8	107	54
CCOC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432404	GD	On-Demand	Anodyne	SFRP1	105	36
CCOC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432404	GD	On-Demand	Anodyne	WNT3	71	34
CN(Cc1cnn(C)c1)S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872432411	GF	On-Demand	Anodyne	PLA2G7	27	40
FC(F)CN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872432429	DG	On-Demand	Anodyne	HPGDS	27	41
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(C#N)cc3)CC2)c(C#N)c1	ZINC000872432441	GE	On-Demand	Mild	ADORA2B	44	38
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(C#N)cc3)CC2)c(C#N)c1	ZINC000872432441	GE	On-Demand	Mild	TRPV4	49	41
CCC(=O)c1c(Cl)cccc1N[C@@H](C)Cn1cncn1	ZINC000872432443	CG	On-Demand	Anodyne	HIS3	80	37
CCC(=O)c1c(Cl)cccc1N[C@H](C)Cn1cncn1	ZINC000872432444	CG	On-Demand	Anodyne	HIS3	80	37
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432457	GF	On-Demand	Anodyne	PLG	40	31
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432457	GF	On-Demand	Anodyne	EPHX2	32	52
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432457	GF	On-Demand	Anodyne	CACNA1G	29	41
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432457	GF	On-Demand	Anodyne	NAMPT	37	41
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432457	GF	On-Demand	Anodyne	TMPRSS11D	57	34
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c(C#N)c1	ZINC000872432472	GD	On-Demand	Mild	EPHX2	17	40
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c(C#N)c1	ZINC000872432472	GD	On-Demand	Mild	TRPV4	45	36
NC(=O)c1cc(NCC2CCN(Cc3cccs3)CC2)nc(Cl)n1	ZINC000872432476	FF	On-Demand	Anodyne	CACNA1I	42	33
O=S(=O)(NCCN1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872432492	DE	On-Demand	Anodyne	HTR2A	16	41
O=S(=O)(NCCN1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872432492	DE	On-Demand	Anodyne	HTR7	37	44
O=S(=O)(NCCN1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872432492	DE	On-Demand	Anodyne	HTR6	17	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccc(O)c2)CC1	ZINC000872432495	GF	On-Demand	Anodyne	PKM	50	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccc(O)c2)CC1	ZINC000872432495	GF	On-Demand	Anodyne	GCK	41	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccc(O)c2)CC1	ZINC000872432495	GF	On-Demand	Anodyne	NOD2	18	40
O=C(CNc1ccnc2ncccc12)NC1CCCCC1	ZINC000872432525	CE	On-Demand	Anodyne	HNMT	42	34
Cc1c(F)ncnc1N(C)CCCOc1cccc(S(C)(=O)=O)c1	ZINC000872432533	FE	On-Demand	Anodyne	NR1H3	48	36
O=S(=O)(NCCN1CCCC1)c1cccc(Br)n1	ZINC000872432555	ED	On-Demand	Anodyne	HTR7	30	43
Cc1c(F)ncnc1N1CCC(CCN2CCOCC2)CC1	ZINC000872432557	DD	On-Demand	Anodyne	SIRT3	44	41
Cc1c(F)ncnc1N1CCC(CCN2CCOCC2)CC1	ZINC000872432557	DD	On-Demand	Anodyne	SIRT2	32	41
Cc1ccc(S(=O)(=O)N2CCN(c3cccc(O)c3)CC2)c(C#N)c1	ZINC000872432577	FE	On-Demand	Mild	TRPV4	42	35
O=C(CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)NC1CC1	ZINC000872432598	GD	On-Demand	Anodyne	TGM2	51	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(S(C)(=O)=O)CC1	ZINC000872432616	EC	On-Demand	Mild	PKM	21	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872432622	GF	On-Demand	Mild	LPL	51	38
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000872432622	GF	On-Demand	Mild	EPHX2	45	60
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432628	GD	On-Demand	Anodyne	SIRT3	34	43
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432628	GD	On-Demand	Anodyne	SIRT2	29	43
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432628	GD	On-Demand	Anodyne	SIRT1	29	43
Cc1c(F)ncnc1N1CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432628	GD	On-Demand	Anodyne	GPBAR1	22	45
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432629	GD	On-Demand	Anodyne	SIRT3	34	43
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432629	GD	On-Demand	Anodyne	SIRT2	29	43
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432629	GD	On-Demand	Anodyne	SIRT1	29	43
Cc1c(F)ncnc1N1CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C1	ZINC000872432629	GD	On-Demand	Anodyne	GPBAR1	22	45
FC(F)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872432643	CE	On-Demand	Anodyne	DRD4	23	42
CCOC(=O)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872432646	DE	On-Demand	Anodyne	P2RY12	43	36
c1ccc(-c2cc(N3CCC(OC4CCCC4)CC3)ncn2)cc1	ZINC000872432650	DI	On-Demand	Anodyne	DCK	38	41
COc1ccc(OC)c2sc(NCC3CCOCC3)nc12	ZINC000872432665	DG	On-Demand	Anodyne	ADORA2B	15	40
Cn1ncc2c(N3CCN(C(=O)CCCc4ccccc4)CC3)nc(Cl)nc21	ZINC000872432668	GF	On-Demand	Anodyne	PREP	50	42
C[C@@H]1CN(CCCNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C[C@@H](C)O1	ZINC000872432670	FD	On-Demand	Anodyne	ERG2	17	42
C[C@@H]1CN(CCCNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C[C@@H](C)O1	ZINC000872432670	FD	On-Demand	Anodyne	Q2TU57_MAIZE	19	42
C[C@@H]1CN(CCCNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C[C@@H](C)O1	ZINC000872432673	FD	On-Demand	Anodyne	ERG2	17	42
C[C@@H]1CN(CCCNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C[C@@H](C)O1	ZINC000872432673	FD	On-Demand	Anodyne	Q2TU57_MAIZE	19	42
O[C@@H](CNc1cc(-c2cccc(Cl)c2)ncn1)COCC1CC1	ZINC000872432689	EF	On-Demand	Anodyne	VCP	24	41
O[C@H](CNc1cc(-c2cccc(Cl)c2)ncn1)COCC1CC1	ZINC000872432690	EF	On-Demand	Anodyne	VCP	24	41
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	HTR1A	47	43
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	DRD2	36	43
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	DRD4	28	41
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	ADRA1D	20	45
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	HTR2A	32	43
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	ADRA1A	22	45
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	DRD3	29	41
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	HRP1_PLAFA	98	43
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	HTR7	54	41
c1cnc2nccc(NCCCN3CCN(c4ccncc4)CC3)c2c1	ZINC000872432691	EF	On-Demand	Anodyne	HNMT	105	52
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)N2CCCC2)CC1	ZINC000872432693	FD	On-Demand	Mild	TGM2	21	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)N2CCCC2)CC1	ZINC000872432693	FD	On-Demand	Mild	F13A1	21	40
Cn1ncc2c(NCCNC(=O)Cc3cccc(F)c3)nc(Cl)nc21	ZINC000872432705	FD	On-Demand	Anodyne	P2RX7	27	41
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872432707	DD	On-Demand	Mild	FKBP1A	19	40
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	ACACB	18	50
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	CACNA1I	53	34
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	SIRT3	60	45
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	SIRT2	58	44
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	SIRT1	57	45
CC(C)(C)OC(=O)NCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872432711	EG	On-Demand	Anodyne	GPR119	20	40
Cc1c(F)ncnc1NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000872432713	ED	On-Demand	Anodyne	DRD4	25	42
Nc1nc(NCCCN2CCN(c3ccncc3)CC2)nc(C(F)F)n1	ZINC000872432725	FD	On-Demand	Anodyne	HRP1_PLAFA	43	31
Nc1nc(NCCCN2CCN(c3ccncc3)CC2)nc(C(F)F)n1	ZINC000872432725	FD	On-Demand	Anodyne	HTR7	19	41
Nc1nc(NCCCN2CCN(c3ccncc3)CC2)nc(C(F)F)n1	ZINC000872432725	FD	On-Demand	Anodyne	HNMT	43	32
O=C(C1CC1)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432734	GD	On-Demand	Anodyne	CCR8	85	45
O=C(C1CC1)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432734	GD	On-Demand	Anodyne	SFRP1	132	42
O=C(C1CC1)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872432734	GD	On-Demand	Anodyne	WNT3	89	37
CC[C@H](C(=O)N1CCC(Nc2ncnc(F)c2C)CC1)c1ccccc1	ZINC000872432743	FH	On-Demand	Anodyne	C3AR1	23	40
CC[C@@H](C(=O)N1CCC(Nc2ncnc(F)c2C)CC1)c1ccccc1	ZINC000872432744	FH	On-Demand	Anodyne	C3AR1	23	40
O=C(CCNc1ccnc2ncccc12)N1CCCCCC1	ZINC000872432759	CF	On-Demand	Anodyne	HRP1_PLAFA	40	33
O=C(CCNc1ccnc2ncccc12)N1CCCCCC1	ZINC000872432759	CF	On-Demand	Anodyne	HNMT	73	45
Cc1c(F)ncnc1N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872432760	FE	On-Demand	Anodyne	DRD4	27	43
Cc1c(F)ncnc1N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872432760	FE	On-Demand	Anodyne	EBP	25	43
Cc1c(F)ncnc1N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872432761	FE	On-Demand	Anodyne	DRD4	27	43
Cc1c(F)ncnc1N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872432761	FE	On-Demand	Anodyne	EBP	25	43
O=C(C1CC1)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432767	GE	On-Demand	Anodyne	CCR8	70	41
O=C(C1CC1)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432767	GE	On-Demand	Anodyne	SFRP1	150	47
O=C(C1CC1)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432767	GE	On-Demand	Anodyne	WNT3	103	41
O[C@@H](CNc1cc(-c2ccccc2)ncn1)COCC1CC1	ZINC000872432782	CE	On-Demand	Anodyne	VCP	57	37
O[C@H](CNc1cc(-c2ccccc2)ncn1)COCC1CC1	ZINC000872432783	CE	On-Demand	Anodyne	VCP	57	37
O=S(=O)(NC(C1CC1)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872432786	DG	On-Demand	Anodyne	LEF	36	47
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	HTR1A	75	40
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	DRD2	53	40
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	ADRA1D	47	38
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	ADRA1A	42	39
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	DRD3	59	40
COc1ccc(OC)c2sc(N3CCN(CCCO)CC3)nc12	ZINC000872432793	ED	On-Demand	Anodyne	HTR7	49	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872432802	GD	On-Demand	Mild	DRD4	15	56
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000872432802	GD	On-Demand	Mild	F13A1	43	36
Cc1c(F)ncnc1NCCNC(=O)Cc1cccc(F)c1	ZINC000872432803	DD	On-Demand	Anodyne	EGFR	19	40
Cc1c(F)ncnc1N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872432804	DF	On-Demand	Anodyne	ACACB	15	46
Cc1c(F)ncnc1N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872432804	DF	On-Demand	Anodyne	CACNA1I	50	35
Cc1c(F)ncnc1N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872432804	DF	On-Demand	Anodyne	SIRT3	82	52
Cc1c(F)ncnc1N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872432804	DF	On-Demand	Anodyne	SIRT2	68	52
Cc1c(F)ncnc1N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872432804	DF	On-Demand	Anodyne	SIRT1	62	52
Cc1c(F)ncnc1N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000872432806	EF	On-Demand	Anodyne	PREP	44	41
Cc1c(F)ncnc1N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000872432806	EF	On-Demand	Anodyne	FAAH	41	35
Cc1c(F)ncnc1N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000872432806	EF	On-Demand	Anodyne	CES1	44	35
Cc1c(F)ncnc1N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000872432806	EF	On-Demand	Anodyne	AKT1	27	41
CC(C)(C)OC(=O)NCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432810	EF	On-Demand	Anodyne	ACACB	16	50
CC(C)(C)OC(=O)NCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432810	EF	On-Demand	Anodyne	CACNA1I	70	41
CC(C)(C)OC(=O)NCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432810	EF	On-Demand	Anodyne	SIRT3	74	48
CC(C)(C)OC(=O)NCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432810	EF	On-Demand	Anodyne	SIRT2	65	48
CC(C)(C)OC(=O)NCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432810	EF	On-Demand	Anodyne	SIRT1	60	48
CS(=O)(=O)NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872432862	GD	On-Demand	Anodyne	SFRP1	30	40
NC(=O)c1cc(N2CCC(OC3CCCCC3)CC2)nc(Cl)n1	ZINC000872432872	EF	On-Demand	Anodyne	SCD1	15	43
CCC(=O)c1c(Cl)cccc1N1CCN(S(=O)(=O)CC)CC1	ZINC000872432873	EE	On-Demand	Anodyne	HTR1A	22	40
CCC(=O)c1c(Cl)cccc1N1CCN(S(=O)(=O)CC)CC1	ZINC000872432873	EE	On-Demand	Anodyne	DRD2	30	42
CCC(=O)c1c(Cl)cccc1N1CCN(S(=O)(=O)CC)CC1	ZINC000872432873	EE	On-Demand	Anodyne	DRD3	49	42
CCC(=O)c1c(Cl)cccc1N1CCN(S(=O)(=O)CC)CC1	ZINC000872432873	EE	On-Demand	Anodyne	KCNQ2	54	35
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NC1CCN(C2CC2)CC1	ZINC000872432891	GG	On-Demand	Anodyne	SLC6A5	28	42
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccc1	ZINC000872432892	GF	On-Demand	Anodyne	DRD4	15	40
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccc1	ZINC000872432892	GF	On-Demand	Anodyne	SLC6A9	20	41
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccc1	ZINC000872432892	GF	On-Demand	Anodyne	TGM2	32	40
CCN(CC)C(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872432922	GD	On-Demand	Mild	TRPV4	44	37
O=S(=O)(NCC1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872432938	CE	On-Demand	Anodyne	NPY5R	25	46
O=S(=O)(NCC1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872432938	CE	On-Demand	Anodyne	LEF	25	41
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	HTR1A	64	41
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	DRD2	50	41
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	ADRA1D	51	36
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	ADRA1A	45	39
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	ADRA1B	42	36
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	DRD3	50	41
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	HTR7	44	40
COc1ccccc1N1CCC(Nc2nc(Cl)nc3c2cnn3C)CC1	ZINC000872432972	FG	On-Demand	Anodyne	EHMT2	88	45
c1ccc(N2CCN(C[C@@H]3CCCN(c4ccnc5ncccc45)C3)CC2)nc1	ZINC000872432973	GG	On-Demand	Anodyne	DRD4	31	45
c1ccc(N2CCN(C[C@@H]3CCCN(c4ccnc5ncccc45)C3)CC2)nc1	ZINC000872432973	GG	On-Demand	Anodyne	EBP	24	43
c1ccc(N2CCN(C[C@H]3CCCN(c4ccnc5ncccc45)C3)CC2)nc1	ZINC000872432977	GG	On-Demand	Anodyne	DRD4	31	45
c1ccc(N2CCN(C[C@H]3CCCN(c4ccnc5ncccc45)C3)CC2)nc1	ZINC000872432977	GG	On-Demand	Anodyne	EBP	24	43
O=C(c1ccco1)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872432978	FE	On-Demand	Anodyne	CCR8	43	30
Cc1c(F)ncnc1NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000872432980	EE	On-Demand	Anodyne	SSTR1	40	39
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000872432995	ED	On-Demand	Mild	CCR8	98	50
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000872432995	ED	On-Demand	Mild	SFRP1	126	39
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000872432995	ED	On-Demand	Mild	WNT3	86	36
O=C(CCCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432998	FF	On-Demand	Anodyne	MC4R	24	43
O=C(CCCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872432998	FF	On-Demand	Anodyne	PREP	48	40
COC(=O)C[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872432999	FD	On-Demand	Anodyne	LEF	40	45
COC(=O)C[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872433000	FD	On-Demand	Anodyne	LEF	40	45
Oc1nnc(Cl)cc1N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872433017	GE	On-Demand	Anodyne	DRD4	28	42
Oc1nnc(Cl)cc1N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872433017	GE	On-Demand	Anodyne	EBP	23	43
Oc1nnc(Cl)cc1N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872433018	GE	On-Demand	Anodyne	DRD4	28	42
Oc1nnc(Cl)cc1N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000872433018	GE	On-Demand	Anodyne	EBP	23	43
CC[C@H](C(=O)N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1)c1ccccc1	ZINC000872433026	GF	On-Demand	Anodyne	P2RY12	55	32
CC[C@H](C(=O)N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1)c1ccccc1	ZINC000872433026	GF	On-Demand	Anodyne	KCNQ2	46	38
CC[C@@H](C(=O)N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1)c1ccccc1	ZINC000872433027	GF	On-Demand	Anodyne	P2RY12	55	32
CC[C@@H](C(=O)N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1)c1ccccc1	ZINC000872433027	GF	On-Demand	Anodyne	KCNQ2	46	38
CCOC(=O)N1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872433032	EF	On-Demand	Anodyne	P2RY12	217	47
CCOC(=O)N1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872433032	EF	On-Demand	Anodyne	DGAT1	27	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872433033	FD	On-Demand	Mild	EPHX2	20	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872433033	FD	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872433033	FD	On-Demand	Mild	TGM2	17	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872433033	FD	On-Demand	Mild	F13A1	27	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C4CCC3CC4)cc2N1	ZINC000872433036	FF	On-Demand	Anodyne	PKM	30	43
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CC2)CC1	ZINC000872433048	DD	On-Demand	Mild	ADRA1D	34	49
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CC2)CC1	ZINC000872433048	DD	On-Demand	Mild	ADRA1A	24	49
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CC2)CC1	ZINC000872433048	DD	On-Demand	Mild	ADRA1B	27	49
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CC2)CC1	ZINC000872433048	DD	On-Demand	Mild	CCR8	64	33
CCCNC(=O)[C@@H]1CCCN(c2ncnc(F)c2C)C1	ZINC000872433056	CD	On-Demand	Anodyne	SIRT3	45	33
CCCNC(=O)[C@@H]1CCCN(c2ncnc(F)c2C)C1	ZINC000872433056	CD	On-Demand	Anodyne	GPBAR1	23	47
CCCNC(=O)[C@H]1CCCN(c2ncnc(F)c2C)C1	ZINC000872433057	CD	On-Demand	Anodyne	SIRT3	45	33
CCCNC(=O)[C@H]1CCCN(c2ncnc(F)c2C)C1	ZINC000872433057	CD	On-Demand	Anodyne	GPBAR1	23	47
C=CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872433061	FC	On-Demand	Mild	TRPV4	47	39
COc1cccc(C2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872433068	DG	On-Demand	Anodyne	PDE3A	41	36
COc1cccc(C2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872433068	DG	On-Demand	Anodyne	PDE3B	44	35
COc1cccc(C2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872433068	DG	On-Demand	Anodyne	LIMK2	16	43
CCCNC(=O)[C@@H]1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872433082	EG	On-Demand	Anodyne	GPBAR1	28	48
CCCNC(=O)[C@H]1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872433083	EG	On-Demand	Anodyne	GPBAR1	28	48
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCC(C)C)CC1	ZINC000872433087	FE	On-Demand	Mild	EPHX2	40	58
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	HTR1A	83	43
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	DRD2	69	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	DRD4	42	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	ADRA1D	82	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	HTR1B	15	43
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	HTR2A	21	40
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	ADRA1A	73	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	ADRA1B	67	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	DRD3	71	40
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	HTR7	55	40
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	SCD1	24	41
COc1ccccc1N1CCC(Nc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872433092	FE	On-Demand	Anodyne	EHMT2	50	37
COc1cccc(C2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872433093	EF	On-Demand	Anodyne	HTR1A	15	45
NC(=O)c1cc(N2CCC(OC3CCCC3)CC2)nc(Cl)n1	ZINC000872433107	DE	On-Demand	Anodyne	SCD1	16	43
Cc1c(F)ncnc1N1CCN(CCCO)CC1	ZINC000872433128	CC	On-Demand	Anodyne	ABCC1	58	34
Cc1c(F)ncnc1N1CCN(CCCO)CC1	ZINC000872433128	CC	On-Demand	Anodyne	RPS6KB1	41	31
CCCNC(=O)[C@@H]1CCCN(c2cc(C)nc3c2cnn3C)C1	ZINC000872433136	DE	On-Demand	Anodyne	GPBAR1	25	45
CCCNC(=O)[C@H]1CCCN(c2cc(C)nc3c2cnn3C)C1	ZINC000872433138	DE	On-Demand	Anodyne	GPBAR1	25	45
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	HTR1A	71	42
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	DRD2	62	43
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	DRD4	37	42
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	ADRA1D	64	39
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	ADRA1A	57	39
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	ADRA1B	52	39
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	DRD3	62	43
COc1ccccc1N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872433140	EF	On-Demand	Anodyne	HTR7	48	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1cccnc1	ZINC000872433171	FH	On-Demand	Anodyne	CASP3	54	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1cccnc1	ZINC000872433171	FH	On-Demand	Anodyne	CASP7	52	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1cccnc1	ZINC000872433172	FH	On-Demand	Anodyne	CASP3	54	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1cccnc1	ZINC000872433172	FH	On-Demand	Anodyne	CASP7	52	41
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872433174	GD	On-Demand	Anodyne	PKM	26	43
CCOC(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433179	EE	On-Demand	Anodyne	TBXA2R	48	34
CCOC(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433179	EE	On-Demand	Anodyne	LEF	33	42
CCCNC(=O)[C@@H]1CCCN(c2nc(N)nc(C(F)F)n2)C1	ZINC000872433182	DD	On-Demand	Anodyne	GPBAR1	23	46
CCCNC(=O)[C@H]1CCCN(c2nc(N)nc(C(F)F)n2)C1	ZINC000872433183	DD	On-Demand	Anodyne	GPBAR1	23	46
Nc1nc(C(F)F)nc(N2CCN(C(=O)CCCc3ccccc3)CC2)n1	ZINC000872433190	GE	On-Demand	Anodyne	PREP	42	39
NC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433199	FC	On-Demand	Anodyne	CCR8	69	32
NC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433199	FC	On-Demand	Anodyne	SFRP1	125	54
NC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433199	FC	On-Demand	Anodyne	WNT3	81	39
O=C1CCCN1CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433207	FE	On-Demand	Anodyne	HTR7	26	40
Cn1ncc2c(N3CCC(C(=O)Nc4cccc(C#N)c4)CC3)nc(Cl)nc21	ZINC000872433215	GF	On-Demand	Mild	ITGA4	46	31
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccccn3)CC2)c(C#N)c1	ZINC000872433225	FD	On-Demand	Mild	TRPV4	44	35
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)nc(Cl)n1	ZINC000872433230	GD	On-Demand	Anodyne	P2RX7	23	48
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)nc(Cl)n1	ZINC000872433230	GD	On-Demand	Anodyne	SCD1	20	44
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)nc(Cl)n1	ZINC000872433230	GD	On-Demand	Anodyne	SCD	18	44
C#CCNC(=O)C1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872433231	EF	On-Demand	Mild	DRD2	20	40
C#CCNC(=O)C1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872433231	EF	On-Demand	Mild	DRD3	42	40
C#CCNC(=O)C1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872433231	EF	On-Demand	Mild	KCNQ2	42	34
C#CCNC(=O)C1CCN(c2cccc(Cl)c2C(=O)CC)CC1	ZINC000872433231	EF	On-Demand	Mild	TYK2	41	35
Cc1ccc(S(=O)(=O)N2CCc3sccc3C2)c(C#N)c1	ZINC000872433251	DF	On-Demand	Mild	TRPV4	41	34
Cc1ccc(S(=O)(=O)N2CCc3sccc3C2)c(C#N)c1	ZINC000872433251	DF	On-Demand	Mild	AKR1C3	44	48
O=S(=O)(c1cccc(Br)n1)N1CCc2sccc2C1	ZINC000872433255	FF	On-Demand	Anodyne	AKR1C3	55	53
O=C(c1ccc(F)cc1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872433291	FF	On-Demand	Anodyne	P2RX7	29	51
CCCNC(=O)[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872433297	CD	On-Demand	Anodyne	GPBAR1	23	46
CCCNC(=O)[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872433298	CD	On-Demand	Anodyne	GPBAR1	23	46
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c(C#N)c1	ZINC000872433317	GC	On-Demand	Mild	TRPV4	44	35
c1ccc(-c2cc(N3CCC(c4ncc[nH]4)CC3)ncn2)cc1	ZINC000872433320	DG	On-Demand	Anodyne	HTR2B	17	54
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2sccc2C1	ZINC000872433324	DF	On-Demand	Mild	AKR1C3	53	51
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872433329	DD	On-Demand	Mild	FKBP1A	38	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872433329	DD	On-Demand	Mild	PREP	21	40
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872433329	DD	On-Demand	Mild	MMP7	15	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872433329	DD	On-Demand	Mild	MMP1	16	41
NC(=O)[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872433345	DD	On-Demand	Anodyne	ADK	23	44
NC(=O)[C@@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872433346	DD	On-Demand	Anodyne	ADK	23	44
CC(C)(C)OC(=O)NCC1CCN(c2ccncc2C2CC2)CC1	ZINC000872433354	EH	On-Demand	Anodyne	ACACB	16	44
CC(C)(C)OC(=O)NCC1CCN(c2ccncc2C2CC2)CC1	ZINC000872433354	EH	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)NCC1CCN(c2ccncc2C2CC2)CC1	ZINC000872433354	EH	On-Demand	Anodyne	GPR119	25	46
O=S(=O)(NCC1CC1)c1cccc(Br)n1	ZINC000872433356	CD	On-Demand	Anodyne	NPY5R	24	42
CN1CCCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872433361	CD	On-Demand	Anodyne	HRP1_PLAFA	88	39
CN1CCCN(CCCNc2cc(Cl)nnc2O)CC1	ZINC000872433361	CD	On-Demand	Anodyne	HNMT	71	42
O=C(N1CCCC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433373	GE	On-Demand	Anodyne	PKM	48	40
O=C(N1CCCC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433373	GE	On-Demand	Anodyne	TGM2	54	49
O=C(N1CCCC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433373	GE	On-Demand	Anodyne	F13A1	57	49
NC(=O)c1cc(NCC2CCOCC2)nc(Cl)n1	ZINC000872433376	CD	On-Demand	Anodyne	VCP	40	35
COC(=O)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872433388	FD	On-Demand	Anodyne	PKM	35	42
Cc1c(F)ncnc1NCCC(=O)NCc1ccccc1	ZINC000872433390	CE	On-Demand	Anodyne	PDS	41	33
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000872433400	EF	On-Demand	Mild	TYK2	45	38
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000872433400	EF	On-Demand	Mild	LIMK2	60	54
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000872433400	EF	On-Demand	Mild	LRRK2	18	40
Cc1nc(CCNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cs1	ZINC000872433406	GF	On-Demand	Anodyne	PKM	36	46
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	FKBP1A	31	42
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	CASP3	70	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	MMP13	43	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	UL80	15	41
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	ITGA4	30	40
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	CAPNS1	15	40
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	MMP3	49	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	CASP7	83	38
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	MMP7	54	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433417	EE	On-Demand	Anodyne	MMP1	49	48
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872433423	DD	On-Demand	Mild	MMP1	15	40
O=C(CCNc1ccnc2ncccc12)N1CCN(c2ccccn2)CC1	ZINC000872433435	FE	On-Demand	Anodyne	HNMT	45	37
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3cccnc3)cc2N1	ZINC000872433436	GF	On-Demand	Anodyne	TBXA2R	20	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3cccnc3)cc2N1	ZINC000872433436	GF	On-Demand	Anodyne	TBXAS1	38	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3cccnc3)cc2N1	ZINC000872433436	GF	On-Demand	Anodyne	PKM	34	45
CN1CCN(c2ccc(Nc3cc(Cl)nnc3O)cc2Cl)CC1	ZINC000872433439	FF	On-Demand	Anodyne	PAK1	47	40
Nc1nc(C(F)F)nc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)n1	ZINC000872433445	GE	On-Demand	Anodyne	P2RX7	24	49
Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(C)no3)CC2)c(C#N)c1	ZINC000872433446	FD	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)c(C#N)c1	ZINC000872433447	GC	On-Demand	Mild	EPHX2	30	50
Cc1ccc(S(=O)(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)c(C#N)c1	ZINC000872433448	GC	On-Demand	Mild	EPHX2	30	50
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccco3)CC2)c(C#N)c1	ZINC000872433463	ED	On-Demand	Mild	TRPV4	41	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2ccccn2)CC1	ZINC000872433478	GF	On-Demand	Anodyne	PKM	42	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2ccccn2)CC1	ZINC000872433478	GF	On-Demand	Anodyne	GCK	40	36
C=CCNC(=O)CN1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872433498	FC	On-Demand	Mild	F13A1	40	36
CN1CCC(N2CCC(Nc3cc(C(N)=O)nc(Cl)n3)CC2)CC1	ZINC000872433509	FD	On-Demand	Anodyne	HTR1F	80	38
CN1CCC(N2CCC(Nc3cc(C(N)=O)nc(Cl)n3)CC2)CC1	ZINC000872433509	FD	On-Demand	Anodyne	PRKD1	28	41
CCCNC(=O)[C@@H]1CCCN(c2nc(SC)nc(Cl)c2F)C1	ZINC000872433519	EF	On-Demand	Anodyne	GPBAR1	22	44
CCCNC(=O)[C@H]1CCCN(c2nc(SC)nc(Cl)c2F)C1	ZINC000872433520	EF	On-Demand	Anodyne	GPBAR1	22	44
C#CCNC(=O)C1CCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872433523	EE	On-Demand	Mild	EPHX2	24	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000872433524	FF	On-Demand	Anodyne	P2RX7	39	54
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000872433524	FF	On-Demand	Anodyne	AKT1	32	41
O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872433540	EF	On-Demand	Anodyne	ADRA1D	43	54
O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872433540	EF	On-Demand	Anodyne	ADRA1A	31	54
O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872433540	EF	On-Demand	Anodyne	ADRA1B	34	54
O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872433540	EF	On-Demand	Anodyne	SFRP1	107	35
O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872433540	EF	On-Demand	Anodyne	WNT3	68	33
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP13	32	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP3	37	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP8	15	40
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP9	27	41
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP7	42	45
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872433559	ED	On-Demand	Anodyne	MMP1	40	48
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c(C#N)c1	ZINC000872433560	GD	On-Demand	Mild	DRD4	15	57
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c(C#N)c1	ZINC000872433560	GD	On-Demand	Mild	LPL	46	38
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c(C#N)c1	ZINC000872433560	GD	On-Demand	Mild	EPHX2	18	50
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c(C#N)c1	ZINC000872433560	GD	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c(C#N)c1	ZINC000872433560	GD	On-Demand	Mild	F13A1	48	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3CC3)cc2N1	ZINC000872433566	EE	On-Demand	Anodyne	PKM	38	47
CC[C@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433581	FG	On-Demand	Anodyne	P2RY12	49	33
CC[C@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433581	FG	On-Demand	Anodyne	KCNQ2	47	39
CC[C@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433581	FG	On-Demand	Anodyne	CCR8	22	41
CC[C@@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433582	FG	On-Demand	Anodyne	P2RY12	49	33
CC[C@@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433582	FG	On-Demand	Anodyne	KCNQ2	47	39
CC[C@@H](C(=O)N1CCC(Nc2cc(Cl)nnc2O)CC1)c1ccccc1	ZINC000872433582	FG	On-Demand	Anodyne	CCR8	22	41
Cc1c(F)ncnc1N1CCN(C(=O)OCC(C)C)CC1	ZINC000872433588	CD	On-Demand	Anodyne	GPR119	45	43
O=C(c1ccc(CNS(=O)(=O)CC2CC3(CCC3)C2)cc1)N1CCCC1	ZINC000872433589	GF	On-Demand	Anodyne	L3MBTL3	68	38
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000872433596	FG	On-Demand	Mild	SLC18A3	30	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000872433596	FG	On-Demand	Mild	EPHX2	31	44
O=C(CCNc1cc(Cl)nnc1O)N1CCN(c2ccccc2)CC1	ZINC000872433608	FD	On-Demand	Anodyne	HTR7	21	41
c1ccc(-c2cc(NCC3CCOCC3)ncn2)cc1	ZINC000872433614	CF	On-Demand	Anodyne	TTK	20	41
c1ccc(-c2cc(NCC3CCOCC3)ncn2)cc1	ZINC000872433614	CF	On-Demand	Anodyne	VCP	65	41
CN(Cc1ccncc1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872433618	GF	On-Demand	Anodyne	PKM	30	41
Cn1ncc2c(N3CCC(CNC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872433620	GF	On-Demand	Anodyne	ACACB	16	45
Cn1ncc2c(N3CCC(CNC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872433620	GF	On-Demand	Anodyne	CACNA1I	56	38
Cn1ncc2c(N3CCC(CNC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872433620	GF	On-Demand	Anodyne	SIRT3	33	40
Cn1ncc2c(N3CCC(CNC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872433620	GF	On-Demand	Anodyne	SIRT2	28	40
Cn1ncc2c(N3CCC(CNC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872433620	GF	On-Demand	Anodyne	SIRT1	28	40
Cn1nccc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872433632	FD	On-Demand	Anodyne	PKM	37	45
O=C(CCN=c1cc[nH]cc1C1CC1)N1CCN(c2ccccn2)CC1	ZINC000872433641	FD	On-Demand	Anodyne	DRD4	24	42
O=C(CCN=c1cc[nH]cc1C1CC1)N1CCN(c2ccccn2)CC1	ZINC000872433641	FD	On-Demand	Anodyne	EBP	26	40
O=C(CCN=c1cc[nH]cc1C1CC1)N1CCN(c2ccccn2)CC1	ZINC000872433641	FD	On-Demand	Anodyne	SSTR1	45	37
Cn1ncc2c(NCCCN3CCN(c4ccncc4)CC3)nc(Cl)nc21	ZINC000872433644	GE	On-Demand	Anodyne	HTR1A	21	41
Cn1ncc2c(NCCCN3CCN(c4ccncc4)CC3)nc(Cl)nc21	ZINC000872433644	GE	On-Demand	Anodyne	HTR2A	22	40
Cn1ncc2c(NCCCN3CCN(c4ccncc4)CC3)nc(Cl)nc21	ZINC000872433644	GE	On-Demand	Anodyne	HRP1_PLAFA	45	33
Cn1ncc2c(NCCCN3CCN(c4ccncc4)CC3)nc(Cl)nc21	ZINC000872433644	GE	On-Demand	Anodyne	HTR7	23	41
O=S(=O)(CC1CC2(CCC2)C1)NCCc1cccnc1	ZINC000872433658	CE	On-Demand	Anodyne	TBXAS1	39	42
O=S(=O)(CC1CC2(CCC2)C1)NCCCN1CCN(c2ncccn2)CC1	ZINC000872433666	GD	On-Demand	Anodyne	HTR1A	25	52
O=S(=O)(CC1CC2(CCC2)C1)NCCCN1CCN(c2ncccn2)CC1	ZINC000872433666	GD	On-Demand	Anodyne	DRD2	17	50
O=S(=O)(CC1CC2(CCC2)C1)NCCCN1CCN(c2ncccn2)CC1	ZINC000872433666	GD	On-Demand	Anodyne	HTR2A	18	50
O=S(=O)(CC1CC2(CCC2)C1)NCCCN1CCN(c2ncccn2)CC1	ZINC000872433666	GD	On-Demand	Anodyne	HTR7	33	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)(C)C)CC2)c(C#N)c1	ZINC000872433667	ED	On-Demand	Mild	EPHX2	15	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)(C)C)CC2)c(C#N)c1	ZINC000872433667	ED	On-Demand	Mild	TRPV4	45	37
O=S(=O)(CC1CC2(CCC2)C1)NCc1ccccc1Cn1ccnc1	ZINC000872433672	FF	On-Demand	Anodyne	CYP19A1	21	42
O=S(=O)(CC1CC2(CCC2)C1)NCc1ccccc1Cn1ccnc1	ZINC000872433672	FF	On-Demand	Anodyne	CYP11B1	33	41
O=S(=O)(CC1CC2(CCC2)C1)NCc1ccccc1Cn1ccnc1	ZINC000872433672	FF	On-Demand	Anodyne	CYP11B2	20	41
COc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)cc1	ZINC000872433674	GE	On-Demand	Mild	TRPV4	48	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CC3(Cl)Cl)cc2N1	ZINC000872433684	GG	On-Demand	Anodyne	PKM	38	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CC3(Cl)Cl)cc2N1	ZINC000872433685	GG	On-Demand	Anodyne	PKM	38	47
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000872433714	GD	On-Demand	Mild	EPHX2	47	51
Cc1cccc(CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872433727	DE	On-Demand	Anodyne	FBP1	15	40
Cc1cccc(CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872433728	DE	On-Demand	Anodyne	FBP1	15	40
CCc1nc([C@H]2CCCN2c2cc(-c3ccccc3)ncn2)no1	ZINC000872433732	DG	On-Demand	Anodyne	CPT1A	48	36
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	HTR1A	56	45
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	DRD4	32	45
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	DRD3	46	45
COc1ccccc1N1CC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433740	EF	On-Demand	Anodyne	HTR7	39	45
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	HTR1A	56	45
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	DRD4	32	45
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	DRD3	46	45
COc1ccccc1N1CC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872433741	EF	On-Demand	Anodyne	HTR7	39	45
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	HTR1A	75	50
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	DRD2	55	50
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	DRD4	32	50
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	ADRA1D	61	40
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	ADRA1A	54	42
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	ADRA1B	47	39
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	DRD3	55	50
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	PDE3A	40	39
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	HTR7	52	50
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	PDE3B	45	39
COc1ccccc1N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872433752	EH	On-Demand	Anodyne	EHMT2	43	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC(F)(F)F)CC1	ZINC000872433756	GF	On-Demand	Anodyne	PKM	47	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC(F)(F)F)CC1	ZINC000872433756	GF	On-Demand	Anodyne	GCK	47	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872433757	GE	On-Demand	Mild	DRD4	17	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872433757	GE	On-Demand	Mild	EPHX2	39	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872433757	GE	On-Demand	Mild	TGM2	34	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000872433757	GE	On-Demand	Mild	CCR8	60	35
N#Cc1cccnc1N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433759	GF	On-Demand	Mild	PKM	46	40
N#Cc1cccnc1N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433759	GF	On-Demand	Mild	GCK	47	40
CCCNC(=O)[C@H]1CCCN(c2nc(Cl)nc3c2cnn3C)C1	ZINC000872433764	ED	On-Demand	Anodyne	GPBAR1	26	42
CCCNC(=O)[C@@H]1CCCN(c2nc(Cl)nc3c2cnn3C)C1	ZINC000872433765	ED	On-Demand	Anodyne	GPBAR1	26	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2cccnc2)CC1	ZINC000872433769	GF	On-Demand	Anodyne	ADORA2B	46	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2cccnc2)CC1	ZINC000872433769	GF	On-Demand	Anodyne	NAMPT	45	42
CCCNC(=O)[C@H]1CCCN(c2nc(Cl)nc3sccc23)C1	ZINC000872433776	EG	On-Demand	Anodyne	GPBAR1	27	45
CCCNC(=O)[C@@H]1CCCN(c2nc(Cl)nc3sccc23)C1	ZINC000872433777	EG	On-Demand	Anodyne	GPBAR1	27	45
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)CC2)c(C#N)c1	ZINC000872433798	ED	On-Demand	Mild	TRPV4	46	38
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	HTR1A	64	46
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	DRD2	49	46
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	DRD4	27	40
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	ADRA1D	62	39
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	ADRA1A	53	39
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	ADRA1B	51	39
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	DRD3	48	46
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	HTR7	44	40
COc1ccccc1N1CCC(Nc2nc(N)nc(C(F)F)n2)CC1	ZINC000872433799	FE	On-Demand	Anodyne	HRH4	25	41
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	ADRA1D	16	40
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	ADRA1A	18	44
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	HRP1_PLAFA	52	32
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	FGFR1	28	47
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	HRH3	19	42
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	SIGMAR1	18	48
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	HRH4	18	49
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	BCHE	21	42
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	CHRNA7	15	43
CN1CCCN(CCCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872433812	EF	On-Demand	Anodyne	HNMT	84	42
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872433819	DD	On-Demand	Mild	FKBP1A	33	43
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872433819	DD	On-Demand	Mild	EPHX2	21	41
N#Cc1ccnc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)c1	ZINC000872433823	GF	On-Demand	Mild	GCK	41	35
CCCNC(=O)[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872433832	CE	On-Demand	Anodyne	GPBAR1	24	51
CCCNC(=O)[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872433833	CE	On-Demand	Anodyne	GPBAR1	24	51
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433839	ED	On-Demand	Anodyne	HTR1A	33	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433839	ED	On-Demand	Anodyne	HRP1_PLAFA	91	40
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433839	ED	On-Demand	Anodyne	HTR7	35	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433839	ED	On-Demand	Anodyne	HNMT	57	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@H]3CCCO3)cc2N1	ZINC000872433847	FE	On-Demand	Anodyne	PKM	35	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@@H]3CCCO3)cc2N1	ZINC000872433848	FE	On-Demand	Anodyne	PKM	35	46
COCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872433861	ED	On-Demand	Anodyne	PKM	40	51
NC(=O)c1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)nc(Cl)n1	ZINC000872433877	GD	On-Demand	Anodyne	P2RY12	40	32
NC(=O)c1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)nc(Cl)n1	ZINC000872433877	GD	On-Demand	Anodyne	PREP	43	38
NC(=O)c1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)nc(Cl)n1	ZINC000872433877	GD	On-Demand	Anodyne	FAAH	30	40
Cc1c(F)ncnc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433878	ED	On-Demand	Anodyne	DRD2	15	41
Cc1c(F)ncnc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433878	ED	On-Demand	Anodyne	ADRA1D	20	45
Cc1c(F)ncnc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433878	ED	On-Demand	Anodyne	ADRA1A	24	45
Cc1c(F)ncnc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433878	ED	On-Demand	Anodyne	DRD3	19	41
Cc1c(F)ncnc1NCCCN1CCN(c2ccncc2)CC1	ZINC000872433878	ED	On-Demand	Anodyne	HTR7	30	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ccncc1	ZINC000872433899	FH	On-Demand	Anodyne	CASP3	51	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ccncc1	ZINC000872433899	FH	On-Demand	Anodyne	CASP7	63	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ccncc1	ZINC000872433900	FH	On-Demand	Anodyne	CASP3	51	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ccncc1	ZINC000872433900	FH	On-Demand	Anodyne	CASP7	63	34
N#Cc1cccc(NC(=O)C2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872433901	EH	On-Demand	Mild	CCR3	16	41
Cc1c(F)ncnc1NCCCNC(=O)c1cccs1	ZINC000872433919	CE	On-Demand	Anodyne	TBK1	16	51
CCOC(=O)CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872433920	FE	On-Demand	Mild	EPHX2	26	45
CCOC(=O)CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872433920	FE	On-Demand	Mild	TRPV4	48	39
CC(=O)NCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433948	DD	On-Demand	Anodyne	TBXA2R	43	34
CC(=O)NCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433948	DD	On-Demand	Anodyne	LEF	33	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CC1)OCCO2	ZINC000872433964	FE	On-Demand	Anodyne	PKM	50	40
CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433965	GF	On-Demand	Anodyne	CNR1	15	40
CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433965	GF	On-Demand	Anodyne	PKM	47	39
CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433965	GF	On-Demand	Anodyne	TGM2	43	34
CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433965	GF	On-Demand	Anodyne	GCK	56	32
CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872433965	GF	On-Demand	Anodyne	F13A1	53	37
CCOC(=O)[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433967	GE	On-Demand	Anodyne	MMP13	23	45
CCOC(=O)[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433967	GE	On-Demand	Anodyne	MMP3	21	45
CCOC(=O)[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433967	GE	On-Demand	Anodyne	MMP1	25	45
CCOC(=O)[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433968	GE	On-Demand	Anodyne	MMP13	23	45
CCOC(=O)[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433968	GE	On-Demand	Anodyne	MMP3	21	45
CCOC(=O)[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872433968	GE	On-Demand	Anodyne	MMP1	25	45
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1C(=O)NC1CC1	ZINC000872433969	ED	On-Demand	Mild	ITGA4	27	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1C(=O)NC1CC1	ZINC000872433969	ED	On-Demand	Mild	EPHX2	19	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1C(=O)NC1CC1	ZINC000872433970	ED	On-Demand	Mild	ITGA4	27	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1C(=O)NC1CC1	ZINC000872433970	ED	On-Demand	Mild	EPHX2	19	41
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000872433977	GH	On-Demand	Anodyne	PDGFRB	26	42
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000872433977	GH	On-Demand	Anodyne	TRPV1	16	48
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000872433977	GH	On-Demand	Anodyne	EPHX2	16	47
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000872433977	GH	On-Demand	Anodyne	SIRT3	41	31
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000872433977	GH	On-Demand	Anodyne	LIMK2	33	54
Cc1cccc(C(=O)N2CCCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)c1	ZINC000872433985	GF	On-Demand	Mild	EPHX2	15	41
Cc1cccc(C(=O)N2CCCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)c1	ZINC000872433985	GF	On-Demand	Mild	TRPV4	40	33
Cc1cccc(C#N)c1S(=O)(=O)NCc1ccnc(N2CCOCC2)c1	ZINC000872434002	FD	On-Demand	Mild	SMG1	27	40
Cc1ccc(S(=O)(=O)N2CCN(C(C)C)CC2)c(C#N)c1	ZINC000872434018	DD	On-Demand	Mild	TRPV4	44	36
CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434019	GD	On-Demand	Anodyne	ADORA2B	50	33
C#CCNC(=O)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872434020	CD	On-Demand	Mild	TBK1	48	33
O=C(C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)N1CCCC1	ZINC000872434021	GF	On-Demand	Anodyne	EPHX2	33	40
O=C(C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)N1CCCC1	ZINC000872434021	GF	On-Demand	Anodyne	TGM2	37	44
O=C(C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)N1CCCC1	ZINC000872434021	GF	On-Demand	Anodyne	F13A1	39	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2nccs2)CC1	ZINC000872434028	GF	On-Demand	Anodyne	PKM	40	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2nccs2)CC1	ZINC000872434028	GF	On-Demand	Anodyne	GCK	41	35
COCCN(c1cc(C(N)=O)nc(Cl)n1)C1CCCC1	ZINC000872434032	CD	On-Demand	Anodyne	PYGL	16	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCN(C4CC4)CC3)cc2N1	ZINC000872434044	GF	On-Demand	Anodyne	PKM	33	45
Cc1ccc(S(=O)(=O)N2CCN(c3nccs3)CC2)c(C#N)c1	ZINC000872434058	ED	On-Demand	Mild	TRPV4	42	34
C#CCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872434060	CC	On-Demand	Mild	SIRT3	61	35
C#CCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872434060	CC	On-Demand	Mild	SIRT2	51	33
C#CCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872434060	CC	On-Demand	Mild	SIRT1	50	30
C#CCNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872434060	CC	On-Demand	Mild	LIMK2	20	44
C=CCc1cc(CNc2nc(N)nc(C(F)F)n2)cc(OC)c1OC	ZINC000872434061	FF	On-Demand	Mild	DHFR	19	50
C=CCc1cc(CNc2nc(N)nc(C(F)F)n2)cc(OC)c1OC	ZINC000872434061	FF	On-Demand	Mild	FOLA	20	50
C=CCc1cc(CNc2nc(N)nc(C(F)F)n2)cc(OC)c1OC	ZINC000872434061	FF	On-Demand	Mild	DRTS_TOXGO	31	44
C=CCc1cc(CNc2nc(N)nc(C(F)F)n2)cc(OC)c1OC	ZINC000872434061	FF	On-Demand	Mild	DYR_PNECA	15	43
C=CCc1cc(CNc2nc(N)nc(C(F)F)n2)cc(OC)c1OC	ZINC000872434061	FF	On-Demand	Mild	DRTS_TRYCR	47	37
NS(=O)(=O)c1ccc2c(c1)CCN2S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872434062	FD	On-Demand	Anodyne	CA7	24	41
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872434077	FE	On-Demand	Anodyne	PKM	22	41
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872434078	FE	On-Demand	Anodyne	PKM	22	41
CN1CCCN(CCCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434080	EC	On-Demand	Anodyne	HRP1_PLAFA	48	34
CN1CCCN(CCCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434080	EC	On-Demand	Anodyne	FGFR1	28	43
CN1CCCN(CCCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434080	EC	On-Demand	Anodyne	HNMT	42	33
CCCNC(=O)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872434087	CF	On-Demand	Anodyne	TBK1	57	37
CCCNC(=O)[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872434087	CF	On-Demand	Anodyne	GPBAR1	24	47
CCCNC(=O)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872434088	CF	On-Demand	Anodyne	TBK1	57	37
CCCNC(=O)[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872434088	CF	On-Demand	Anodyne	GPBAR1	24	47
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872434091	DE	On-Demand	Anodyne	PKM	45	36
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872434092	DE	On-Demand	Anodyne	PKM	45	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N2CCCC2)CC1	ZINC000872434096	FD	On-Demand	Mild	EPHX2	32	42
O=S(=O)(CCNc1ccnc2ncccc12)N1CCOCC1	ZINC000872434097	DC	On-Demand	Anodyne	HRP1_PLAFA	41	32
Cc1ccc(S(=O)(=O)N2CCN(Cc3cccnc3)CC2)c(C#N)c1	ZINC000872434108	FD	On-Demand	Mild	ADORA2B	43	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCN3CCCC3=O)cc2N1	ZINC000872434109	GD	On-Demand	Anodyne	PKM	38	48
CC(C)(C)OC(=O)N1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872434110	GD	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872434111	GD	On-Demand	Anodyne	GPR119	29	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2sccc2C1	ZINC000872434112	EH	On-Demand	Anodyne	AKR1C3	60	56
C=CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434118	GD	On-Demand	Mild	TGM2	73	41
C=CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434118	GD	On-Demand	Mild	F13A1	80	41
CCC(CC)C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872434125	FE	On-Demand	Mild	TRPV4	47	38
COc1ccc([C@@H]2CCN(c3ccnc4ncccc34)C2)cc1	ZINC000872434136	DH	On-Demand	Anodyne	EBP	16	44
CC[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872434143	FE	On-Demand	Anodyne	PKM	25	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCn3cccn3)cc2N1	ZINC000872434178	GE	On-Demand	Anodyne	PKM	33	43
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000872434179	ED	On-Demand	Mild	CCR8	98	39
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000872434179	ED	On-Demand	Mild	SFRP1	90	38
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000872434179	ED	On-Demand	Mild	WNT3	58	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)c(C#N)c1	ZINC000872434188	GE	On-Demand	Mild	TRPV4	43	37
O=C1NC(=O)C2(CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)N1	ZINC000872434189	GD	On-Demand	Anodyne	PKM	40	38
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	HTR1A	60	43
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	DRD2	40	47
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	DRD4	31	47
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	ADRA1D	44	40
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	ADRA1A	40	42
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	ADRA1B	34	43
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	DRD3	40	47
COc1ccccc1N1CC[C@@H](CNc2ccnc3ncccc23)C1	ZINC000872434203	EH	On-Demand	Anodyne	HTR7	38	47
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	HTR1A	60	43
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	DRD2	40	47
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	DRD4	31	47
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	ADRA1D	44	40
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	ADRA1A	40	42
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	ADRA1B	34	43
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	DRD3	40	47
COc1ccccc1N1CC[C@H](CNc2ccnc3ncccc23)C1	ZINC000872434204	EH	On-Demand	Anodyne	HTR7	38	47
CC(C)(C)OC(=O)N1CCC(=NNc2cc(Br)ncn2)CC1	ZINC000872434225	FG	On-Demand	Mild	GPR119	40	38
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	ADRA1D	27	40
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	ADRA1A	20	40
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	ADRA1B	21	40
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	CCR8	61	34
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	SFRP1	123	43
CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872434232	GD	On-Demand	Anodyne	WNT3	82	38
C#CCNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872434265	DE	On-Demand	Mild	GSK3A	20	40
O=S(=O)(NC1CCN(C2CC2)CC1)c1cccc(Br)n1	ZINC000872434266	FD	On-Demand	Anodyne	ADRA1D	36	42
O=S(=O)(NC1CCN(C2CC2)CC1)c1cccc(Br)n1	ZINC000872434266	FD	On-Demand	Anodyne	ADRA1A	25	42
O=S(=O)(NC1CCN(C2CC2)CC1)c1cccc(Br)n1	ZINC000872434266	FD	On-Demand	Anodyne	ADRA1B	28	42
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	HTR1A	75	46
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	DRD2	60	46
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	DRD4	33	40
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	ADRA1D	68	39
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	ADRA1A	59	39
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	ADRA1B	53	39
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	DRD3	59	46
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	PDE3A	41	39
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	HTR7	49	42
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	PDE3B	45	39
COc1ccccc1N1CCC(Nc2ncnc(F)c2C)CC1	ZINC000872434297	DG	On-Demand	Anodyne	EHMT2	72	38
C#CCNC(=O)C1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872434301	FF	On-Demand	Mild	GRM5	15	41
NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872434304	ED	On-Demand	Anodyne	MMP3	16	44
NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872434304	ED	On-Demand	Anodyne	MMP8	24	44
NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872434304	ED	On-Demand	Anodyne	ADAM9	40	31
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	FKBP1A	41	45
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	CASP3	46	45
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	MMP13	42	49
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	ADAM17	25	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	CAPNS1	15	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	MMP3	48	49
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	MMP9	25	40
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	CASP7	60	36
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	MMP7	54	49
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434341	FE	On-Demand	Anodyne	MMP1	49	49
Cc1ccccc1CC(=O)N1CCN(c2ncnc(F)c2C)CC1	ZINC000872434376	EE	On-Demand	Anodyne	AKT1	31	40
O=C(NCc1cccnc1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872434405	GE	On-Demand	Anodyne	NAMPT	103	51
COc1ncccc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872434462	GE	On-Demand	Anodyne	PKM	36	43
CC[C@H](C)NC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872434478	GD	On-Demand	Mild	TRPV4	44	36
C[C@H](CCNc1ccnc2ncccc12)NC(=O)OC(C)(C)C	ZINC000872434482	DG	On-Demand	Anodyne	FPR1	44	36
COc1ccccc1N1CC[C@H](CNc2nc(Cl)nc3c2cnn3C)C1	ZINC000872434484	FF	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@@H](CNc2nc(Cl)nc3c2cnn3C)C1	ZINC000872434485	FF	On-Demand	Anodyne	HTR1A	45	38
C[C@@H](CCNc1ccnc2ncccc12)NC(=O)OC(C)(C)C	ZINC000872434494	DG	On-Demand	Anodyne	FPR1	44	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccn3)CC2)c(C#N)c1	ZINC000872434556	FD	On-Demand	Mild	EPHX2	16	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccn3)CC2)c(C#N)c1	ZINC000872434556	FD	On-Demand	Mild	TRPV4	42	35
CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872434559	FC	On-Demand	Mild	TRPV4	48	39
CN(C1CC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872434569	EE	On-Demand	Anodyne	PKM	35	44
O=S(=O)(NCC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872434583	CF	On-Demand	Anodyne	NPY5R	15	42
NC(=O)c1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872434585	DE	On-Demand	Anodyne	KCNH2	40	36
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434628	FD	On-Demand	Anodyne	FKBP1A	17	41
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434628	FD	On-Demand	Anodyne	MMP13	27	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434628	FD	On-Demand	Anodyne	MMP3	30	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434628	FD	On-Demand	Anodyne	MMP7	37	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434628	FD	On-Demand	Anodyne	MMP1	34	49
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	HTR1A	63	42
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	DRD2	49	42
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	DRD4	35	42
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	ADRA1D	48	40
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	ADRA1A	45	40
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	DRD3	56	42
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	HTR7	42	42
COc1ccccc1N1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434669	FE	On-Demand	Anodyne	VCP	50	33
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	HTR1A	63	42
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	DRD2	49	42
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	DRD4	35	42
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	ADRA1D	48	40
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	ADRA1A	45	40
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	DRD3	56	42
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	HTR7	42	42
COc1ccccc1N1CC[C@@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872434670	FE	On-Demand	Anodyne	VCP	50	33
CCC(=O)c1c(Cl)cccc1NCc1c(C)nn(C)c1C	ZINC000872434677	DH	On-Demand	Anodyne	P2RX7	24	42
CNC(=O)CN1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872434688	GC	On-Demand	Anodyne	CCR8	90	37
CNC(=O)CN1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872434688	GC	On-Demand	Anodyne	SFRP1	40	38
CC(=NNc1cc(Br)ncn1)c1ccc(OCCN(C)C)cc1	ZINC000872434689	GG	On-Demand	Mild	ESRRG	47	35
COc1ccc([C@@H]2CCN(c3ncnc(F)c3C)C2)cc1	ZINC000872434701	CF	On-Demand	Anodyne	PDE3A	43	42
COc1ccc([C@@H]2CCN(c3ncnc(F)c3C)C2)cc1	ZINC000872434701	CF	On-Demand	Anodyne	DCK	47	42
COc1ccc([C@@H]2CCN(c3ncnc(F)c3C)C2)cc1	ZINC000872434701	CF	On-Demand	Anodyne	PDE3B	47	41
CS(=O)(=O)NCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434703	FC	On-Demand	Anodyne	LEF	27	40
COCCN(CC(C)C)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872434712	EG	On-Demand	Anodyne	RORC	25	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000872434743	GE	On-Demand	Mild	SMO	18	40
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434744	FD	On-Demand	Anodyne	MMP13	17	41
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434744	FD	On-Demand	Anodyne	MMP3	15	41
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434744	FD	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434744	FD	On-Demand	Anodyne	MMP7	23	41
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434744	FD	On-Demand	Anodyne	MMP1	19	45
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434745	FD	On-Demand	Anodyne	MMP13	17	41
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434745	FD	On-Demand	Anodyne	MMP3	15	41
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434745	FD	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434745	FD	On-Demand	Anodyne	MMP7	23	41
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872434745	FD	On-Demand	Anodyne	MMP1	19	45
Cc1ccc(S(=O)(=O)N2CCN(c3ncnc4sccc34)CC2)c(C#N)c1	ZINC000872434746	GE	On-Demand	Mild	TRPV4	41	33
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)c(C#N)c1	ZINC000872434803	GE	On-Demand	Mild	EPHX2	17	45
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)c(C#N)c1	ZINC000872434803	GE	On-Demand	Mild	TRPV4	45	39
CN1CCC(CCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434822	CD	On-Demand	Anodyne	SIRT3	63	37
CN1CCC(CCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434822	CD	On-Demand	Anodyne	SIRT2	58	37
CN1CCC(CCNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872434822	CD	On-Demand	Anodyne	SIRT1	53	37
CC(=O)NCCCNS(=O)(=O)c1cccc(Br)n1	ZINC000872434825	EC	On-Demand	Anodyne	MTNR1A	46	39
CC(=O)NCCCNS(=O)(=O)c1cccc(Br)n1	ZINC000872434825	EC	On-Demand	Anodyne	MTNR1B	43	39
Cc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)c(C#N)c1	ZINC000872434833	EE	On-Demand	Mild	EPHX2	18	42
Cc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)c(C#N)c1	ZINC000872434833	EE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CC(C)(C)C)CC2)c(C#N)c1	ZINC000872434838	FE	On-Demand	Mild	TRPV4	46	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3CCC3)cc2N1	ZINC000872434846	EF	On-Demand	Anodyne	PKM	38	47
CN(Cc1ccc(Cl)nc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872434849	FE	On-Demand	Anodyne	Q8WSF8_APLCA	26	44
CN(Cc1ccc(Cl)nc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872434849	FE	On-Demand	Anodyne	NACHRBETA2	32	44
O=C(CNc1cc(Cl)nnc1O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000872434850	GE	On-Demand	Anodyne	CCR1	18	41
c1ccc(-c2cc(N3CCc4ncnc(N5CCOCC5)c4C3)ncn2)cc1	ZINC000872434858	FE	On-Demand	Anodyne	PIK3CA	21	40
CN(Cc1ccc(Cl)nc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872434868	FE	On-Demand	Anodyne	Q8WSF8_APLCA	26	44
CN(Cc1ccc(Cl)nc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872434868	FE	On-Demand	Anodyne	NACHRBETA2	32	44
CCC(=O)c1c(Cl)cccc1N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000872434928	FH	On-Demand	Anodyne	ETHR	42	33
CCC(=O)c1c(Cl)cccc1N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000872434929	FH	On-Demand	Anodyne	ETHR	42	33
CN(C1CC1)S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872434932	DG	On-Demand	Anodyne	ERG7	19	41
CN(C1CC1)S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872434932	DG	On-Demand	Anodyne	CAS1	23	44
CC(=NNc1cc(Br)ncn1)c1cccc(OCCN(C)C)c1	ZINC000872434983	GG	On-Demand	Mild	ESRRG	43	32
COc1ccc(C(=O)N2CCN(S(=O)(=O)c3c(C)cccc3C#N)CC2)cc1	ZINC000872435027	GE	On-Demand	Mild	MMP3	15	40
COc1ccc(C(=O)N2CCN(S(=O)(=O)c3c(C)cccc3C#N)CC2)cc1	ZINC000872435027	GE	On-Demand	Mild	MMP9	15	40
COc1ccc(C(=O)N2CCN(S(=O)(=O)c3c(C)cccc3C#N)CC2)cc1	ZINC000872435027	GE	On-Demand	Mild	PKM	18	44
COc1ccc(C(=O)N2CCN(S(=O)(=O)c3c(C)cccc3C#N)CC2)cc1	ZINC000872435027	GE	On-Demand	Mild	MMP1	15	40
Cc1c(F)ncnc1NCCCNC(=O)c1ccccc1	ZINC000872435040	CE	On-Demand	Anodyne	ACHE	15	41
Cc1c(F)ncnc1NCCCNC(=O)c1ccccc1	ZINC000872435040	CE	On-Demand	Anodyne	BCHE	25	41
CCN(CC)C(=O)CN1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872435044	GD	On-Demand	Mild	TRPV4	42	35
Cc1cccc(C#N)c1S(=O)(=O)N(C)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000872435049	GF	On-Demand	Mild	MAPK14	28	44
COc1ccccc1N1CC[C@@H](CNc2nc(N)nc(C(F)F)n2)C1	ZINC000872435053	FE	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@@H](CNc2nc(N)nc(C(F)F)n2)C1	ZINC000872435053	FE	On-Demand	Anodyne	DRD2	29	41
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872435055	DD	On-Demand	Mild	ITGA4	24	40
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872435055	DD	On-Demand	Mild	CAPNS1	15	40
COc1ccccc1N1CC[C@H](CNc2nc(N)nc(C(F)F)n2)C1	ZINC000872435056	FE	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](CNc2nc(N)nc(C(F)F)n2)C1	ZINC000872435056	FE	On-Demand	Anodyne	DRD2	29	41
COc1ccccc1N1CC[C@H](CNc2ncnc(F)c2C)C1	ZINC000872435105	DF	On-Demand	Anodyne	HTR1A	55	44
COc1ccccc1N1CC[C@H](CNc2ncnc(F)c2C)C1	ZINC000872435105	DF	On-Demand	Anodyne	DRD2	38	44
COc1ccccc1N1CC[C@H](CNc2ncnc(F)c2C)C1	ZINC000872435105	DF	On-Demand	Anodyne	ADRA1D	41	36
COc1ccccc1N1CC[C@H](CNc2ncnc(F)c2C)C1	ZINC000872435105	DF	On-Demand	Anodyne	PDE3A	42	39
COc1ccccc1N1CC[C@H](CNc2ncnc(F)c2C)C1	ZINC000872435105	DF	On-Demand	Anodyne	PDE3B	45	39
COc1ccccc1N1CC[C@@H](CNc2ncnc(F)c2C)C1	ZINC000872435106	DF	On-Demand	Anodyne	HTR1A	55	44
COc1ccccc1N1CC[C@@H](CNc2ncnc(F)c2C)C1	ZINC000872435106	DF	On-Demand	Anodyne	DRD2	38	44
COc1ccccc1N1CC[C@@H](CNc2ncnc(F)c2C)C1	ZINC000872435106	DF	On-Demand	Anodyne	ADRA1D	41	36
COc1ccccc1N1CC[C@@H](CNc2ncnc(F)c2C)C1	ZINC000872435106	DF	On-Demand	Anodyne	PDE3A	42	39
COc1ccccc1N1CC[C@@H](CNc2ncnc(F)c2C)C1	ZINC000872435106	DF	On-Demand	Anodyne	PDE3B	45	39
CCN1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872435139	ED	On-Demand	Anodyne	CCR8	57	34
c1ccc(-c2cc(N3CCC(c4cn[nH]c4)CC3)ncn2)cc1	ZINC000872435150	DG	On-Demand	Anodyne	DCK	36	40
CC(=NNc1cc(Br)ncn1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000872435160	GG	On-Demand	Mild	EPHX2	43	38
CC(C)(C)C(=O)NCCNc1cc(-c2ccccc2)ncn1	ZINC000872435202	CF	On-Demand	Anodyne	VCP	42	33
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	MMP13	24	42
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	ITGA4	32	42
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	MMP3	25	45
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	MMP7	28	42
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	MMP1	27	45
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	SFRP1	54	31
O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435236	FE	On-Demand	Anodyne	WNT3	53	31
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	MMP13	24	42
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	ITGA4	32	42
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	MMP3	25	45
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	MMP7	28	42
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	MMP1	27	45
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	SFRP1	54	31
O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435238	FE	On-Demand	Anodyne	WNT3	53	31
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	GRM4	25	42
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	PKM	38	40
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	TGM2	53	37
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	GCK	43	39
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	F13A1	45	37
O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872435290	GE	On-Demand	Anodyne	SFRP1	17	42
Cc1ccc(S(=O)(=O)N2CCN(c3cnccn3)CC2)c(C#N)c1	ZINC000872435294	ED	On-Demand	Mild	TRPV4	42	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cnccn2)CC1	ZINC000872435300	FE	On-Demand	Anodyne	PKM	41	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cnccn2)CC1	ZINC000872435300	FE	On-Demand	Anodyne	GCK	43	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)N(C)C)CC2)c(C#N)c1	ZINC000872435335	EC	On-Demand	Mild	TRPV4	44	36
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872435410	GD	On-Demand	Anodyne	PKM	22	42
C[C@H](CCNc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872435486	CF	On-Demand	Anodyne	HTR7	18	49
C[C@@H](CCNc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872435487	CF	On-Demand	Anodyne	HTR7	18	49
O=C(C1CC1)N1CCN(c2ccc(Nc3cc(Cl)nnc3O)cn2)CC1	ZINC000872435516	FE	On-Demand	Anodyne	DGAT1	35	42
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	FKBP1A	22	42
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	CASP3	19	42
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	MMP13	38	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	ITGA4	33	40
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	CAPNS1	16	43
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	MMP3	41	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	MMP7	47	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	MMP1	44	49
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872435611	FE	On-Demand	Anodyne	WNT3	45	31
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872435615	DD	On-Demand	Mild	ITGA4	23	40
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872435615	DD	On-Demand	Mild	CAPNS1	15	40
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872435615	DD	On-Demand	Mild	EPHX2	29	44
O=C(NCCNS(=O)(=O)CC1CC2(CCC2)C1)c1ccccc1Cl	ZINC000872435745	FF	On-Demand	Anodyne	NR2E3	60	33
Cc1c(F)ncnc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435806	CE	On-Demand	Anodyne	SIRT3	49	30
Cc1c(F)ncnc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435806	CE	On-Demand	Anodyne	SIRT2	50	31
Cc1c(F)ncnc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435806	CE	On-Demand	Anodyne	SIRT1	49	30
Cc1c(F)ncnc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435807	CE	On-Demand	Anodyne	SIRT3	49	30
Cc1c(F)ncnc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435807	CE	On-Demand	Anodyne	SIRT2	50	31
Cc1c(F)ncnc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435807	CE	On-Demand	Anodyne	SIRT1	49	30
NC(=O)c1cc(N2CC[C@@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435813	ED	On-Demand	Anodyne	GRIN2B	18	47
NC(=O)c1cc(N2CC[C@@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435813	ED	On-Demand	Anodyne	SIRT3	61	34
NC(=O)c1cc(N2CC[C@@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435813	ED	On-Demand	Anodyne	SIRT2	52	32
NC(=O)c1cc(N2CC[C@@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435813	ED	On-Demand	Anodyne	SIRT1	51	31
NC(=O)c1cc(N2CC[C@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435814	ED	On-Demand	Anodyne	GRIN2B	18	47
NC(=O)c1cc(N2CC[C@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435814	ED	On-Demand	Anodyne	SIRT3	61	34
NC(=O)c1cc(N2CC[C@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435814	ED	On-Demand	Anodyne	SIRT2	52	32
NC(=O)c1cc(N2CC[C@H](CNc3ccccn3)C2)nc(Cl)n1	ZINC000872435814	ED	On-Demand	Anodyne	SIRT1	51	31
c1ccc(NC[C@@H]2CCN(c3ccnc4ncccc34)C2)nc1	ZINC000872435851	DF	On-Demand	Anodyne	GRIN2B	18	47
c1ccc(NC[C@H]2CCN(c3ccnc4ncccc34)C2)nc1	ZINC000872435852	DF	On-Demand	Anodyne	GRIN2B	18	47
CCOCCCNC(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872435875	GD	On-Demand	Mild	EPHX2	35	48
Oc1nnc(Cl)cc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435914	DE	On-Demand	Anodyne	GRIN2B	17	46
Oc1nnc(Cl)cc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435914	DE	On-Demand	Anodyne	SIRT3	55	33
Oc1nnc(Cl)cc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435914	DE	On-Demand	Anodyne	SIRT2	50	31
Oc1nnc(Cl)cc1N1CC[C@@H](CNc2ccccn2)C1	ZINC000872435914	DE	On-Demand	Anodyne	SIRT1	49	33
Oc1nnc(Cl)cc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435915	DE	On-Demand	Anodyne	GRIN2B	17	46
Oc1nnc(Cl)cc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435915	DE	On-Demand	Anodyne	SIRT3	55	33
Oc1nnc(Cl)cc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435915	DE	On-Demand	Anodyne	SIRT2	50	31
Oc1nnc(Cl)cc1N1CC[C@H](CNc2ccccn2)C1	ZINC000872435915	DE	On-Demand	Anodyne	SIRT1	49	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCN(C4CC4)C3)cc2N1	ZINC000872436001	GE	On-Demand	Anodyne	PKM	19	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCN(C4CC4)C3)cc2N1	ZINC000872436002	GE	On-Demand	Anodyne	PKM	19	42
Nc1nc(C(F)F)nc(N2CC[C@H](CNc3ccccn3)C2)n1	ZINC000872436004	DD	On-Demand	Anodyne	GRIN2B	17	47
Nc1nc(C(F)F)nc(N2CC[C@@H](CNc3ccccn3)C2)n1	ZINC000872436005	DD	On-Demand	Anodyne	GRIN2B	17	47
CCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436099	FE	On-Demand	Mild	EPHX2	44	55
CCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436099	FE	On-Demand	Mild	TRPV4	44	37
C[C@@H](Cn1cccn1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436101	GE	On-Demand	Anodyne	PKM	34	42
Cc1ccc(S(=O)(=O)N2CCOC(C)(C)C2)c(C#N)c1	ZINC000872436152	CD	On-Demand	Mild	TRPV4	44	35
Cc1cccc(C#N)c1S(=O)(=O)NCCCCN1CCN(C)CC1	ZINC000872436163	FD	On-Demand	Mild	HTR1A	20	45
Cc1cccc(C#N)c1S(=O)(=O)NCCCCN1CCN(C)CC1	ZINC000872436163	FD	On-Demand	Mild	DRD2	21	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCCN1CCN(C)CC1	ZINC000872436163	FD	On-Demand	Mild	HTR2A	32	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCCN1CCN(C)CC1	ZINC000872436163	FD	On-Demand	Mild	DRD3	25	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCCN1CCN(C)CC1	ZINC000872436163	FD	On-Demand	Mild	HTR7	42	41
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)N1CCCC1	ZINC000872436168	GE	On-Demand	Anodyne	PKM	41	50
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)N1CCCC1	ZINC000872436169	GE	On-Demand	Anodyne	PKM	41	50
Cc1noc(C)c1CN1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872436186	FE	On-Demand	Anodyne	ADAMTS4	30	43
CCOCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436191	GD	On-Demand	Mild	EPHX2	40	52
CCOCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436191	GD	On-Demand	Mild	TRPV4	44	37
CC(C)(C)OC(=O)N1CCC(C=NNc2cc(Br)ncn2)CC1	ZINC000872436205	GG	On-Demand	Mild	GPR119	43	42
CCCCNC(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872436256	FE	On-Demand	Mild	EPHX2	40	51
c1ccc(NC[C@@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872436293	CG	On-Demand	Anodyne	GRIN2B	15	45
c1ccc(NC[C@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872436294	CG	On-Demand	Anodyne	GRIN2B	15	45
CCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872436316	GG	On-Demand	Anodyne	EPHX2	43	47
O=C(NN=C1CC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872436369	CF	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872436369	CF	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872436369	CF	On-Demand	Reactive	TMPRSS6	63	33
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP13	41	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP2	18	41
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP3	41	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP8	23	43
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP9	29	41
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP7	40	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	MMP1	46	50
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436374	GF	On-Demand	Mild	PFKFB3	62	33
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP13	41	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP2	18	41
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP3	41	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP8	23	43
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP9	29	41
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP7	40	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	MMP1	46	50
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2C#N)cc1	ZINC000872436375	GF	On-Demand	Mild	PFKFB3	62	33
CC(=O)N1CCN(CCNS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872436429	GC	On-Demand	Anodyne	DRD4	40	30
CCCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436437	GF	On-Demand	Mild	EPHX2	43	54
CCCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872436437	GF	On-Demand	Mild	TRPV4	43	37
CCCN(CC(=O)OC)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872436450	EE	On-Demand	Anodyne	MMP8	17	40
Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)cc1	ZINC000872436496	GE	On-Demand	Mild	EPHX2	17	41
Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)cc1	ZINC000872436496	GE	On-Demand	Mild	TRPV4	45	37
O=C(NN=C1CCC[C@H]1F)c1nc2ccccc2s1	ZINC000872436508	CF	On-Demand	Reactive	TRY1_BOVIN	43	36
O=C(NN=C1CCC[C@H]1F)c1nc2ccccc2s1	ZINC000872436508	CF	On-Demand	Reactive	TPSAB1	16	41
O=C(NN=C1CCC[C@H]1F)c1nc2ccccc2s1	ZINC000872436508	CF	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCC[C@H]1F)c1nc2ccccc2s1	ZINC000872436508	CF	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=C1CCC[C@@H]1F)c1nc2ccccc2s1	ZINC000872436509	CF	On-Demand	Reactive	TRY1_BOVIN	43	36
O=C(NN=C1CCC[C@@H]1F)c1nc2ccccc2s1	ZINC000872436509	CF	On-Demand	Reactive	TPSAB1	16	41
O=C(NN=C1CCC[C@@H]1F)c1nc2ccccc2s1	ZINC000872436509	CF	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCC[C@@H]1F)c1nc2ccccc2s1	ZINC000872436509	CF	On-Demand	Reactive	TMPRSS6	49	32
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(c2ncccn2)CC1	ZINC000872436526	FD	On-Demand	Mild	CCR8	56	32
CCCCCNC(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872436545	GF	On-Demand	Mild	EPHX2	39	51
COC(=O)CN(C(C)C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436557	GE	On-Demand	Anodyne	PKM	33	41
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP13	39	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP2	18	41
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP3	39	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP8	25	43
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP9	28	42
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	EPHX2	18	55
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP7	39	47
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	MMP1	41	50
COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436573	GF	On-Demand	Mild	PFKFB3	64	35
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP13	39	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP2	18	41
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP3	39	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP8	25	43
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP9	28	42
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	EPHX2	18	55
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP7	39	47
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	MMP1	41	50
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2C#N)cc1	ZINC000872436574	GF	On-Demand	Mild	PFKFB3	64	35
CC(=O)N1CCN(CCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872436582	GD	On-Demand	Anodyne	HTR2A	15	41
CC(=O)N1CCN(CCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872436582	GD	On-Demand	Anodyne	HTR7	38	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)C(C)C)CC1	ZINC000872436583	ED	On-Demand	Mild	EPHX2	39	43
O=C(c1ccccc1F)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872436587	GF	On-Demand	Anodyne	CCR8	82	41
O=C(c1ccccc1F)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872436587	GF	On-Demand	Anodyne	SFRP1	75	37
O=C(c1ccccc1F)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872436587	GF	On-Demand	Anodyne	WNT3	53	32
CN1CCC(C=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872436606	DE	On-Demand	Reactive	TRY1_BOVIN	45	38
CN1CCC(C=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872436606	DE	On-Demand	Reactive	TPSAB1	17	41
CN1CCC(C=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872436606	DE	On-Demand	Reactive	ST14	41	31
CN1CCC(C=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872436606	DE	On-Demand	Reactive	TMPRSS6	58	31
CCC(CCC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872436611	EI	On-Demand	Reactive	TMPRSS6	50	33
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)C1CC1	ZINC000872436644	ED	On-Demand	Anodyne	EPHX2	21	49
O=C(NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)C1CC1	ZINC000872436704	GE	On-Demand	Anodyne	EPHX2	51	54
O=C(NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)C1CC1	ZINC000872436704	GE	On-Demand	Anodyne	TGM2	44	38
O=C(NC1CCN(S(=O)(=O)c2cccc(Br)n2)CC1)C1CC1	ZINC000872436716	GD	On-Demand	Anodyne	EPHX2	45	53
Cc1ccc(S(=O)(=O)N2CCN3CCCC[C@H]3C2)c(C#N)c1	ZINC000872436717	DD	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2CCN3CCCC[C@@H]3C2)c(C#N)c1	ZINC000872436718	DD	On-Demand	Mild	EPHX2	15	40
C[C@@H]1C[C@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436725	EF	On-Demand	Anodyne	PKM	38	47
C[C@@H]1C[C@@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436726	EF	On-Demand	Anodyne	PKM	38	47
C[C@H]1C[C@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436727	EF	On-Demand	Anodyne	PKM	38	47
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N2CCN(C)CC2)CC1	ZINC000872436745	GD	On-Demand	Mild	EPHX2	28	40
O=C(NN=C(C1CCC1)[C@H]1CCCO1)c1nc2ccccc2s1	ZINC000872436751	EG	On-Demand	Reactive	TPSAB1	15	40
O=C(NN=C(C1CCC1)[C@@H]1CCCO1)c1nc2ccccc2s1	ZINC000872436752	EG	On-Demand	Reactive	TPSAB1	15	40
COC(=O)CCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872436757	FD	On-Demand	Anodyne	PKM	32	40
O=C(c1ccc(C=NNc2cc(Br)ncn2)cc1)N1CCCC1	ZINC000872436821	FF	On-Demand	Mild	L3MBTL3	50	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC(=O)N3CCCCC3)cc2N1	ZINC000872436888	GD	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccsc3)cc2N1	ZINC000872436901	FG	On-Demand	Anodyne	PKM	37	45
O=S(=O)(NC1CCN(c2ncccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872436938	GF	On-Demand	Anodyne	ADRA1D	32	41
O=S(=O)(NC1CCN(c2ncccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872436938	GF	On-Demand	Anodyne	ADRA1A	23	41
O=S(=O)(NC1CCN(c2ncccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872436938	GF	On-Demand	Anodyne	ADRA1B	25	41
O=S(=O)(NC1CCN(c2ncccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872436938	GF	On-Demand	Anodyne	SFRP1	102	37
O=S(=O)(NC1CCN(c2ncccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872436938	GF	On-Demand	Anodyne	WNT3	55	32
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCCOC1	ZINC000872436959	DG	On-Demand	Reactive	TPSAB1	16	40
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCCOC1	ZINC000872436959	DG	On-Demand	Reactive	ST14	47	34
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCCOC1	ZINC000872436959	DG	On-Demand	Reactive	TMPRSS6	60	33
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCCOC1	ZINC000872436960	DG	On-Demand	Reactive	TPSAB1	16	40
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCCOC1	ZINC000872436960	DG	On-Demand	Reactive	ST14	47	34
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCCOC1	ZINC000872436960	DG	On-Demand	Reactive	TMPRSS6	60	33
CC(CCc1ccc(OCC(=O)O)cc1)=NNc1cc(Br)ncn1	ZINC000872436970	GG	On-Demand	Mild	FFAR1	46	39
CC(CCc1ccc(OCC(=O)O)cc1)=NNc1cc(Br)ncn1	ZINC000872436970	GG	On-Demand	Mild	PPO2	37	56
CC(CCc1ccc(OCC(=O)O)cc1)=NNc1cc(Br)ncn1	ZINC000872436970	GG	On-Demand	Mild	FFAR4	46	38
CC(=O)N1CCN(CCNS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872436994	FC	On-Demand	Mild	DRD4	42	33
COCC[C@@H](C=NNc1cc(Br)ncn1)NC(=O)OC(C)(C)C	ZINC000872437066	GF	On-Demand	Mild	CTSK	18	49
COCC[C@H](C=NNc1cc(Br)ncn1)NC(=O)OC(C)(C)C	ZINC000872437067	GF	On-Demand	Mild	CTSK	18	49
CCNC(=O)CN1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872437071	FC	On-Demand	Mild	TRPV4	46	37
COC(C)(C)CC=NNC(=O)c1nc2ccccc2s1	ZINC000872437072	CF	On-Demand	Reactive	TMPRSS6	44	33
CC(COC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437076	CF	On-Demand	Reactive	TPSAB1	17	43
CC(COC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437076	CF	On-Demand	Reactive	ST14	42	38
CC(COC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437076	CF	On-Demand	Reactive	TMPRSS6	64	38
CCC[C@H](C=NNC(=O)c1nc2ccccc2s1)OC	ZINC000872437078	CF	On-Demand	Reactive	ST14	40	36
CCC[C@H](C=NNC(=O)c1nc2ccccc2s1)OC	ZINC000872437078	CF	On-Demand	Reactive	TMPRSS6	61	36
C[C@@H]1SCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437084	CF	On-Demand	Reactive	ST14	47	34
C[C@@H]1SCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437084	CF	On-Demand	Reactive	TMPRSS6	64	33
CC(C)(C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872437085	CG	On-Demand	Reactive	TMPRSS6	55	34
O=C(NN=C1CCS(=O)(=O)CC1)c1nc2ccccc2s1	ZINC000872437086	DD	On-Demand	Reactive	ST14	45	33
O=C(NN=C1CCS(=O)(=O)CC1)c1nc2ccccc2s1	ZINC000872437086	DD	On-Demand	Reactive	TMPRSS6	58	33
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1C[C@H]1C	ZINC000872437087	CG	On-Demand	Reactive	ST14	47	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1C[C@H]1C	ZINC000872437087	CG	On-Demand	Reactive	TMPRSS6	65	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1C[C@@H]1C	ZINC000872437088	CG	On-Demand	Reactive	ST14	47	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1C[C@@H]1C	ZINC000872437088	CG	On-Demand	Reactive	TMPRSS6	65	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1C[C@@H]1C	ZINC000872437089	CG	On-Demand	Reactive	ST14	47	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1C[C@@H]1C	ZINC000872437089	CG	On-Demand	Reactive	TMPRSS6	65	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1C[C@H]1C	ZINC000872437090	CG	On-Demand	Reactive	ST14	47	35
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1C[C@H]1C	ZINC000872437090	CG	On-Demand	Reactive	TMPRSS6	65	35
CC(CC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872437092	DG	On-Demand	Reactive	TPSAB1	16	40
CC(CC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872437092	DG	On-Demand	Reactive	TMPRSS6	55	34
CC(CCC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437096	CH	On-Demand	Reactive	TRY1_BOVIN	41	38
CC(CCC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437096	CH	On-Demand	Reactive	TPSAB1	17	41
CC(CCC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437096	CH	On-Demand	Reactive	ST14	47	34
CC(CCC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437096	CH	On-Demand	Reactive	TMPRSS6	59	33
CC(CC(C)(C)C#N)=NNC(=O)c1nc2ccccc2s1	ZINC000872437097	DG	On-Demand	Reactive	TMPRSS6	44	32
O=C(NN=C1CCC(C(F)F)CC1)c1nc2ccccc2s1	ZINC000872437099	DH	On-Demand	Reactive	TRY1_BOVIN	43	37
O=C(NN=C1CCC(C(F)F)CC1)c1nc2ccccc2s1	ZINC000872437099	DH	On-Demand	Reactive	TPSAB1	17	40
O=C(NN=C1CCC(C(F)F)CC1)c1nc2ccccc2s1	ZINC000872437099	DH	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CCC(C(F)F)CC1)c1nc2ccccc2s1	ZINC000872437099	DH	On-Demand	Reactive	TMPRSS6	64	33
CC(CC1(C(=O)O)CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437101	EG	On-Demand	Reactive	ST14	46	33
CC(CC1(C(=O)O)CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437101	EG	On-Demand	Reactive	TMPRSS6	63	33
NC(=O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437105	CC	On-Demand	Anodyne	TBXA2R	46	38
O=C(NN=CCCOCC(F)F)c1nc2ccccc2s1	ZINC000872437118	DF	On-Demand	Reactive	TMPRSS6	44	32
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(CN2CCOCC2)CC1	ZINC000872437124	GE	On-Demand	Anodyne	PKM	47	40
O=C(NN=C1CC(C(F)F)C1)c1nc2ccccc2s1	ZINC000872437125	CG	On-Demand	Reactive	ST14	46	34
O=C(NN=C1CC(C(F)F)C1)c1nc2ccccc2s1	ZINC000872437125	CG	On-Demand	Reactive	TMPRSS6	68	34
COC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437128	EF	On-Demand	Reactive	TRY1_BOVIN	43	38
COC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437128	EF	On-Demand	Reactive	ST14	42	32
COC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437128	EF	On-Demand	Reactive	TMPRSS6	54	32
O=C(CCCNS(=O)(=O)c1cccc(Br)n1)NC1CC1	ZINC000872437131	FD	On-Demand	Anodyne	TNKS	51	32
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@H]1C(=O)O	ZINC000872437136	EF	On-Demand	Reactive	TRY1_BOVIN	41	37
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@H]1C(=O)O	ZINC000872437136	EF	On-Demand	Reactive	ST14	41	32
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@H]1C(=O)O	ZINC000872437136	EF	On-Demand	Reactive	TMPRSS6	48	32
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@@H]1C(=O)O	ZINC000872437139	EF	On-Demand	Reactive	TRY1_BOVIN	41	37
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@@H]1C(=O)O	ZINC000872437139	EF	On-Demand	Reactive	ST14	41	32
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CC[C@@H]1C(=O)O	ZINC000872437139	EF	On-Demand	Reactive	TMPRSS6	48	32
CC(=NNC(=O)c1nc2ccccc2s1)C1CC(F)(F)C1	ZINC000872437145	DG	On-Demand	Reactive	TPSAB1	16	40
CC(=NNC(=O)c1nc2ccccc2s1)C1CC(F)(F)C1	ZINC000872437145	DG	On-Demand	Reactive	ST14	43	35
CC(=NNC(=O)c1nc2ccccc2s1)C1CC(F)(F)C1	ZINC000872437145	DG	On-Demand	Reactive	TMPRSS6	60	35
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1C[C@H](CC(=O)O)C1(C)C	ZINC000872437153	FH	On-Demand	Reactive	TMPRSS6	52	32
C[C@@H](Cn1ccnc1)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872437163	GF	On-Demand	Anodyne	TBXAS1	19	44
C[C@@H](Cn1ccnc1)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872437163	GF	On-Demand	Anodyne	QPCT	22	42
O=C(NN=C1CC(=O)N2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437168	EE	On-Demand	Reactive	TRY1_BOVIN	45	39
O=C(NN=C1CC(=O)N2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437168	EE	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CC(=O)N2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437168	EE	On-Demand	Reactive	TMPRSS6	48	35
O=C(NN=C1CC(=O)N2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437169	EE	On-Demand	Reactive	TRY1_BOVIN	45	39
O=C(NN=C1CC(=O)N2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437169	EE	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CC(=O)N2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437169	EE	On-Demand	Reactive	TMPRSS6	48	35
CC(CCCCCCC(=O)O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437171	EH	On-Demand	Reactive	TPSAB1	16	41
CC(CCCCCCC(=O)O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437171	EH	On-Demand	Reactive	ST14	42	36
CC(CCCCCCC(=O)O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437171	EH	On-Demand	Reactive	TMPRSS6	65	36
CC(=NNC(=O)c1nc2ccccc2s1)C1CCC(F)(F)CC1	ZINC000872437174	EI	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=CC1CCOCC1)c1nc2ccccc2s1	ZINC000872437178	CE	On-Demand	Reactive	TMPRSS6	45	30
CC(=NNC(=O)c1nc2ccccc2s1)c1cc2n(n1)CCC2	ZINC000872437183	EF	On-Demand	Reactive	TRY1_BOVIN	40	37
O=C(NN=C1CCN(c2nccs2)CC1)c1nc2ccccc2s1	ZINC000872437194	FG	On-Demand	Reactive	TMPRSS6	44	31
C#CCCCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437198	CG	On-Demand	Reactive	TMPRSS6	50	33
O=C(NN=C1CCN2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437200	DE	On-Demand	Reactive	TRY1_BOVIN	46	40
O=C(NN=C1CCN2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437200	DE	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCN2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437200	DE	On-Demand	Reactive	TMPRSS6	40	35
O=C(NN=C1CCN2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437201	DE	On-Demand	Reactive	TRY1_BOVIN	46	40
O=C(NN=C1CCN2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437201	DE	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCN2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437201	DE	On-Demand	Reactive	TMPRSS6	40	35
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872437203	CH	On-Demand	Reactive	TRY1_BOVIN	44	38
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872437203	CH	On-Demand	Reactive	TPSAB1	17	44
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872437203	CH	On-Demand	Reactive	ST14	48	35
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872437203	CH	On-Demand	Reactive	TMPRSS6	66	35
CC(CSCCF)=NNC(=O)c1nc2ccccc2s1	ZINC000872437208	DG	On-Demand	Reactive	ST14	47	33
CC(CSCCF)=NNC(=O)c1nc2ccccc2s1	ZINC000872437208	DG	On-Demand	Reactive	TMPRSS6	60	33
CCSCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437210	CF	On-Demand	Reactive	ST14	46	34
CCSCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437210	CF	On-Demand	Reactive	TMPRSS6	64	34
C[C@@H](C=NNC(=O)c1nc2ccccc2s1)NC(=O)OC(C)(C)C	ZINC000872437214	EF	On-Demand	Reactive	TMPRSS6	55	35
O=C(NN=C1CC(CF)(CF)C1)c1nc2ccccc2s1	ZINC000872437215	DG	On-Demand	Reactive	ST14	46	34
O=C(NN=C1CC(CF)(CF)C1)c1nc2ccccc2s1	ZINC000872437215	DG	On-Demand	Reactive	TMPRSS6	68	34
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H]1OC	ZINC000872437218	DE	On-Demand	Reactive	TMPRSS6	53	32
CC(C)(C)OC(=O)NCCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437219	EF	On-Demand	Reactive	ST14	47	35
CC(C)(C)OC(=O)NCCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437219	EF	On-Demand	Reactive	TMPRSS6	69	35
CC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437234	CH	On-Demand	Reactive	TRY1_BOVIN	48	40
CC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437234	CH	On-Demand	Reactive	TPSAB1	18	43
CC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437234	CH	On-Demand	Reactive	ST14	47	34
CC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437234	CH	On-Demand	Reactive	TMPRSS6	64	34
CC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437235	CH	On-Demand	Reactive	TRY1_BOVIN	48	40
CC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437235	CH	On-Demand	Reactive	TPSAB1	18	43
CC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437235	CH	On-Demand	Reactive	ST14	47	34
CC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437235	CH	On-Demand	Reactive	TMPRSS6	64	34
CC(=NNC(=O)c1nc2ccccc2s1)[C@H](C)CCCCC(=O)O	ZINC000872437237	EH	On-Demand	Reactive	TRY1_BOVIN	44	42
CC(=NNC(=O)c1nc2ccccc2s1)[C@H](C)CCCCC(=O)O	ZINC000872437237	EH	On-Demand	Reactive	TPSAB1	18	49
CC(=NNC(=O)c1nc2ccccc2s1)[C@H](C)CCCCC(=O)O	ZINC000872437237	EH	On-Demand	Reactive	ST14	58	42
CC(=NNC(=O)c1nc2ccccc2s1)[C@H](C)CCCCC(=O)O	ZINC000872437237	EH	On-Demand	Reactive	TMPRSS6	90	42
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H](C)CCCCC(=O)O	ZINC000872437238	EH	On-Demand	Reactive	TRY1_BOVIN	44	42
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H](C)CCCCC(=O)O	ZINC000872437238	EH	On-Demand	Reactive	TPSAB1	18	49
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H](C)CCCCC(=O)O	ZINC000872437238	EH	On-Demand	Reactive	ST14	58	42
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H](C)CCCCC(=O)O	ZINC000872437238	EH	On-Demand	Reactive	TMPRSS6	90	42
COC(=O)C1CCN(CCCNS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872437240	GD	On-Demand	Mild	DRD4	40	31
COCC(=O)NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437241	GD	On-Demand	Anodyne	EPHX2	33	44
COCC(=O)NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437241	GD	On-Demand	Anodyne	TGM2	46	38
O=C(NN=C1CCC2(CC1)CC2)c1nc2ccccc2s1	ZINC000872437245	CH	On-Demand	Reactive	ST14	45	33
O=C(NN=C1CCC2(CC1)CC2)c1nc2ccccc2s1	ZINC000872437245	CH	On-Demand	Reactive	TMPRSS6	58	33
CCOP(=O)(CCC=NNC(=O)c1nc2ccccc2s1)OCC	ZINC000872437252	FH	On-Demand	Reactive	TMPRSS6	48	32
O=C(NN=CC1CC1)c1nc2ccccc2s1	ZINC000872437253	BE	On-Demand	Reactive	TRY1_BOVIN	41	36
O=C(NN=CC1CC1)c1nc2ccccc2s1	ZINC000872437253	BE	On-Demand	Reactive	ST14	45	32
O=C(NN=CC1CC1)c1nc2ccccc2s1	ZINC000872437253	BE	On-Demand	Reactive	TMPRSS6	67	32
CC(CCN(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437257	CE	On-Demand	Reactive	ST14	44	35
CC(CCN(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437257	CE	On-Demand	Reactive	TMPRSS6	65	34
CC(CCCCC#N)=NNC(=O)c1nc2ccccc2s1	ZINC000872437258	DG	On-Demand	Reactive	ST14	44	35
CC(CCCCC#N)=NNC(=O)c1nc2ccccc2s1	ZINC000872437258	DG	On-Demand	Reactive	TMPRSS6	65	35
CC[C@@H]1COCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437267	CE	On-Demand	Reactive	ST14	46	33
CC[C@@H]1COCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437267	CE	On-Demand	Reactive	TMPRSS6	63	33
Nc1nc(N[C@@H]2CCCCc3ccccc32)nc(C(F)F)n1	ZINC000872437273	DG	On-Demand	Anodyne	KCNN3	30	49
Nc1nc(N[C@H]2CCCCc3ccccc32)nc(C(F)F)n1	ZINC000872437274	DG	On-Demand	Anodyne	KCNN3	30	49
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccn3C)CC2)c(C#N)c1	ZINC000872437275	FD	On-Demand	Mild	TRPV4	40	33
CN(C)CCOc1cccc(CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872437283	GD	On-Demand	Anodyne	SQLE	42	35
CN(C)CCOc1cccc(CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872437284	GD	On-Demand	Anodyne	SQLE	42	35
O=S(=O)(N[C@@H]1CCCN(c2ncccn2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437285	GF	On-Demand	Anodyne	SFRP1	52	34
O=S(=O)(N[C@H]1CCCN(c2ncccn2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437286	GF	On-Demand	Anodyne	SFRP1	52	34
Cc1c(F)ncnc1N1CCN(C(=O)CC2CCCCC2)CC1	ZINC000872437293	DF	On-Demand	Anodyne	AKT3	47	35
Cc1c(F)ncnc1N1CCN(C(=O)CC2CCCCC2)CC1	ZINC000872437293	DF	On-Demand	Anodyne	SIRT3	42	33
O=C(NN=C1CCN(C2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437296	EG	On-Demand	Reactive	TRY1_BOVIN	46	39
O=C(NN=C1CCN(C2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437296	EG	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CCN(C2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437296	EG	On-Demand	Reactive	ST14	47	36
O=C(NN=C1CCN(C2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437296	EG	On-Demand	Reactive	TMPRSS6	65	36
CC(C)(C)OC(=O)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872437307	EF	On-Demand	Anodyne	GRIN2B	20	41
CC(C)(C)OC(=O)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872437307	EF	On-Demand	Anodyne	CACNA1I	53	36
CC(C)(C)OC(=O)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872437307	EF	On-Demand	Anodyne	GPR119	51	43
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCOC1	ZINC000872437314	DF	On-Demand	Reactive	ST14	43	34
CCC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCOC1	ZINC000872437314	DF	On-Demand	Reactive	TMPRSS6	59	34
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCOC1	ZINC000872437315	DF	On-Demand	Reactive	ST14	43	34
CCC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCOC1	ZINC000872437315	DF	On-Demand	Reactive	TMPRSS6	59	34
CCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437322	BF	On-Demand	Reactive	TPSAB1	17	42
CCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437322	BF	On-Demand	Reactive	ST14	41	36
CCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437322	BF	On-Demand	Reactive	PYK	16	52
CCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437322	BF	On-Demand	Reactive	TMPRSS6	62	36
CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1c(C)cccc1C#N	ZINC000872437331	EG	On-Demand	Mild	CYP19A1	17	40
CCCNC(=O)c1cccc(CNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872437342	FF	On-Demand	Anodyne	DRD4	41	31
CC(=NNC(=O)c1nc2ccccc2s1)C1CCOCC1	ZINC000872437352	DF	On-Demand	Reactive	TMPRSS6	43	31
CN1CCC(CNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872437353	CC	On-Demand	Anodyne	CACNA1I	56	36
CN1CCC(CNc2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872437353	CC	On-Demand	Anodyne	VCP	40	34
O=S(=O)(N[C@@H]1CCC[C@H](O)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437369	DE	On-Demand	Anodyne	LEF	20	41
O=S(=O)(N[C@H]1CCC[C@@H](O)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437370	DE	On-Demand	Anodyne	LEF	20	41
O=C(NN=C1COCCOC1)c1nc2ccccc2s1	ZINC000872437372	CD	On-Demand	Reactive	ST14	46	34
O=C(NN=C1COCCOC1)c1nc2ccccc2s1	ZINC000872437372	CD	On-Demand	Reactive	TMPRSS6	68	34
CO[C@@H](C=NNC(=O)c1nc2ccccc2s1)C1CCOCC1	ZINC000872437378	EE	On-Demand	Reactive	TMPRSS6	44	32
O=C(NN=C1CCC[C@H]2C[C@@H]12)c1nc2ccccc2s1	ZINC000872437382	CG	On-Demand	Reactive	TRY1_BOVIN	42	39
O=C(NN=C1CCC[C@H]2C[C@@H]12)c1nc2ccccc2s1	ZINC000872437382	CG	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CCC[C@H]2C[C@@H]12)c1nc2ccccc2s1	ZINC000872437382	CG	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CCC[C@H]2C[C@@H]12)c1nc2ccccc2s1	ZINC000872437382	CG	On-Demand	Reactive	TMPRSS6	58	33
O=C(NN=C1CCC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872437383	CG	On-Demand	Reactive	TRY1_BOVIN	42	39
O=C(NN=C1CCC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872437383	CG	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CCC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872437383	CG	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CCC[C@@H]2C[C@H]12)c1nc2ccccc2s1	ZINC000872437383	CG	On-Demand	Reactive	TMPRSS6	58	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C	ZINC000872437409	CE	On-Demand	Reactive	TRY1_BOVIN	40	36
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C	ZINC000872437409	CE	On-Demand	Reactive	TPSAB1	17	41
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C	ZINC000872437409	CE	On-Demand	Reactive	ST14	46	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C	ZINC000872437409	CE	On-Demand	Reactive	TMPRSS6	59	33
COCC(=O)NC1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872437415	FC	On-Demand	Mild	EPHX2	33	40
C[C@@H]1CSCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437420	CF	On-Demand	Reactive	ST14	45	33
C[C@@H]1CSCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437420	CF	On-Demand	Reactive	TMPRSS6	62	33
CC(CN1C(=O)CCC1=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437425	ED	On-Demand	Reactive	TPSAB1	17	41
CC(CN1C(=O)CCC1=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437425	ED	On-Demand	Reactive	ST14	45	32
CC(CN1C(=O)CCC1=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872437425	ED	On-Demand	Reactive	TMPRSS6	58	32
CCO[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437429	DF	On-Demand	Reactive	TRY1_BOVIN	43	37
CCO[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437429	DF	On-Demand	Reactive	ST14	42	33
CCO[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437429	DF	On-Demand	Reactive	TMPRSS6	58	33
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	ADRA1D	30	42
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	ADRA1A	21	42
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	ADRA1B	23	42
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	CCR8	84	36
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	SFRP1	148	44
CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872437430	GG	On-Demand	Anodyne	WNT3	100	44
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@]12CCCO2	ZINC000872437433	EF	On-Demand	Reactive	ST14	45	33
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@]12CCCO2	ZINC000872437433	EF	On-Demand	Reactive	TMPRSS6	63	33
O=C(NN=C1CCC(OC2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437455	FI	On-Demand	Reactive	TRY1_BOVIN	44	38
O=C(NN=C1CCC(OC2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437455	FI	On-Demand	Reactive	TPSAB1	17	43
O=C(NN=C1CCC(OC2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437455	FI	On-Demand	Reactive	ST14	46	34
O=C(NN=C1CCC(OC2CCCC2)CC1)c1nc2ccccc2s1	ZINC000872437455	FI	On-Demand	Reactive	TMPRSS6	68	34
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@H]1C	ZINC000872437461	FG	On-Demand	Reactive	TRY1_BOVIN	40	36
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@H]1C	ZINC000872437461	FG	On-Demand	Reactive	ST14	46	34
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@H]1C	ZINC000872437461	FG	On-Demand	Reactive	TMPRSS6	60	34
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@@H]1C	ZINC000872437462	FG	On-Demand	Reactive	TRY1_BOVIN	40	36
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@@H]1C	ZINC000872437462	FG	On-Demand	Reactive	ST14	46	34
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C[C@@H]1C	ZINC000872437462	FG	On-Demand	Reactive	TMPRSS6	60	34
CC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCCCO1	ZINC000872437464	DF	On-Demand	Reactive	TMPRSS6	49	32
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCCCO1	ZINC000872437465	DF	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=Cc1cn(C2CCC2)nn1)c1nc2ccccc2s1	ZINC000872437466	EE	On-Demand	Reactive	TMPRSS6	49	32
O=S(=O)(N[C@H]1CCC[C@H](O)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437471	DE	On-Demand	Anodyne	LEF	20	41
O=S(=O)(N[C@@H]1CCC[C@@H](O)C1)c1ccc(F)c(C(F)F)c1	ZINC000872437472	DE	On-Demand	Anodyne	LEF	20	41
Cc1cccc(C#N)c1S(=O)(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000872437473	GF	On-Demand	Mild	GPR119	49	43
Oc1nnc(Cl)cc1N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000872437475	EH	On-Demand	Anodyne	RBP4	61	34
Oc1nnc(Cl)cc1N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000872437476	EH	On-Demand	Anodyne	RBP4	61	34
Oc1nnc(Cl)cc1N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000872437477	EH	On-Demand	Anodyne	RBP4	61	34
Oc1nnc(Cl)cc1N[C@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000872437478	EH	On-Demand	Anodyne	RBP4	61	34
O=C(NN=C1CCCOC1)c1nc2ccccc2s1	ZINC000872437479	CE	On-Demand	Reactive	ST14	42	33
O=C(NN=C1CCCOC1)c1nc2ccccc2s1	ZINC000872437479	CE	On-Demand	Reactive	TMPRSS6	58	32
O=C(NN=C1CCCC1)c1nc2ccccc2s1	ZINC000872437502	CF	On-Demand	Reactive	TRY1_BOVIN	41	36
O=C(NN=C1CCCC1)c1nc2ccccc2s1	ZINC000872437502	CF	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CCCC1)c1nc2ccccc2s1	ZINC000872437502	CF	On-Demand	Reactive	ST14	48	35
O=C(NN=C1CCCC1)c1nc2ccccc2s1	ZINC000872437502	CF	On-Demand	Reactive	TMPRSS6	75	35
CCOCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872437503	ED	On-Demand	Anodyne	PKM	40	50
O=C(NN=C1CCCC12CC2)c1nc2ccccc2s1	ZINC000872437539	CG	On-Demand	Reactive	ST14	42	34
O=C(NN=C1CCCC12CC2)c1nc2ccccc2s1	ZINC000872437539	CG	On-Demand	Reactive	TMPRSS6	55	34
O=C(NN=C1CCS(=O)CC1)c1nc2ccccc2s1	ZINC000872437541	DD	On-Demand	Reactive	ST14	45	33
O=C(NN=C1CCS(=O)CC1)c1nc2ccccc2s1	ZINC000872437541	DD	On-Demand	Reactive	TMPRSS6	57	33
CC[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CO1	ZINC000872437544	CF	On-Demand	Reactive	TRY1_BOVIN	41	36
CC[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CO1	ZINC000872437544	CF	On-Demand	Reactive	ST14	46	33
CC[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CO1	ZINC000872437544	CF	On-Demand	Reactive	TMPRSS6	63	33
CC[C@@](C)(C=NNC(=O)c1nc2ccccc2s1)OC	ZINC000872437551	CF	On-Demand	Reactive	TMPRSS6	44	33
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000872437552	GH	On-Demand	Anodyne	EGFR	52	38
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000872437552	GH	On-Demand	Anodyne	TYK2	51	35
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000872437552	GH	On-Demand	Anodyne	LIMK2	73	70
CC[C@](C)(C=NNC(=O)c1nc2ccccc2s1)OC	ZINC000872437553	CF	On-Demand	Reactive	TMPRSS6	44	33
COCC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872437566	FC	On-Demand	Mild	EPHX2	39	49
COCC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872437566	FC	On-Demand	Mild	TRPV4	46	38
O=C(NN=C1CCCSCC1)c1nc2ccccc2s1	ZINC000872437573	DG	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCCSCC1)c1nc2ccccc2s1	ZINC000872437573	DG	On-Demand	Reactive	TMPRSS6	48	32
O=C(Nc1cccc(F)c1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872437583	FH	On-Demand	Anodyne	HTR1D	18	41
O=C(Nc1cccc(F)c1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872437583	FH	On-Demand	Anodyne	HTR1B	16	41
O=C(Nc1cccc(F)c1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872437583	FH	On-Demand	Anodyne	TYK2	51	38
O=C(Nc1cccc(F)c1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872437583	FH	On-Demand	Anodyne	TAAR1	22	41
O=C(Nc1cccc(F)c1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872437583	FH	On-Demand	Anodyne	LIMK2	15	44
O=C(CCCNS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1)NC1CC1	ZINC000872437586	GF	On-Demand	Anodyne	TRAR	19	45
CC(CCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437588	CE	On-Demand	Reactive	TPSAB1	16	40
CC(CCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437588	CE	On-Demand	Reactive	ST14	45	36
CC(CCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437588	CE	On-Demand	Reactive	TMPRSS6	66	35
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872437589	EF	On-Demand	Anodyne	EPHX2	22	40
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872437589	EF	On-Demand	Anodyne	TYK2	48	36
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872437589	EF	On-Demand	Anodyne	SIRT3	40	31
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872437589	EF	On-Demand	Anodyne	LIMK2	63	59
Cc1c(F)ncnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000872437589	EF	On-Demand	Anodyne	KCNK3	20	40
CCc1noc(C2CCC(=NNC(=O)c3nc4ccccc4s3)CC2)n1	ZINC000872437591	FH	On-Demand	Reactive	TMPRSS6	43	31
O=C(NN=C1CCCOCC1)c1nc2ccccc2s1	ZINC000872437593	CF	On-Demand	Reactive	ST14	42	32
O=C(NN=C1CCCOCC1)c1nc2ccccc2s1	ZINC000872437593	CF	On-Demand	Reactive	TMPRSS6	53	32
CC(=NNC(=O)c1nc2ccccc2s1)c1coc(C(C)C)n1	ZINC000872437600	EH	On-Demand	Reactive	TMPRSS6	46	33
COCCCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437601	CF	On-Demand	Reactive	ST14	40	35
COCCCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437601	CF	On-Demand	Reactive	TMPRSS6	60	34
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@@H](C)C1	ZINC000872437604	FG	On-Demand	Reactive	TRY1_BOVIN	40	35
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@@H](C)C1	ZINC000872437604	FG	On-Demand	Reactive	ST14	41	32
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@@H](C)C1	ZINC000872437604	FG	On-Demand	Reactive	TMPRSS6	53	32
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@H](C)C1	ZINC000872437606	FG	On-Demand	Reactive	TRY1_BOVIN	40	35
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@H](C)C1	ZINC000872437606	FG	On-Demand	Reactive	ST14	41	32
CCOC(=O)[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)[C@H](C)C1	ZINC000872437606	FG	On-Demand	Reactive	TMPRSS6	53	32
O=C(NN=C1CC(=O)N2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437607	DD	On-Demand	Reactive	TRY1_BOVIN	46	39
O=C(NN=C1CC(=O)N2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437607	DD	On-Demand	Reactive	TPSAB1	17	43
O=C(NN=C1CC(=O)N2CCC[C@H]12)c1nc2ccccc2s1	ZINC000872437607	DD	On-Demand	Reactive	TMPRSS6	42	36
O=C(NN=C1CC(=O)N2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437608	DD	On-Demand	Reactive	TRY1_BOVIN	46	39
O=C(NN=C1CC(=O)N2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437608	DD	On-Demand	Reactive	TPSAB1	17	43
O=C(NN=C1CC(=O)N2CCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437608	DD	On-Demand	Reactive	TMPRSS6	42	36
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CO1	ZINC000872437612	CE	On-Demand	Reactive	ST14	41	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CO1	ZINC000872437612	CE	On-Demand	Reactive	TMPRSS6	53	33
O=C(NN=C1CC[C@@H]1C1CCC1)c1nc2ccccc2s1	ZINC000872437613	CH	On-Demand	Reactive	TRY1_BOVIN	41	38
O=C(NN=C1CC[C@@H]1C1CCC1)c1nc2ccccc2s1	ZINC000872437613	CH	On-Demand	Reactive	TPSAB1	17	40
O=C(NN=C1CC[C@H]1C1CCC1)c1nc2ccccc2s1	ZINC000872437614	CH	On-Demand	Reactive	TRY1_BOVIN	41	38
O=C(NN=C1CC[C@H]1C1CCC1)c1nc2ccccc2s1	ZINC000872437614	CH	On-Demand	Reactive	TPSAB1	17	40
CC(=NNC(=O)c1nc2ccccc2s1)[C@@H]1CCCOC1	ZINC000872437622	DF	On-Demand	Reactive	TPSAB1	16	40
CC(=NNC(=O)c1nc2ccccc2s1)[C@H]1CCCOC1	ZINC000872437623	DF	On-Demand	Reactive	TPSAB1	16	40
CCSCCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437636	CG	On-Demand	Reactive	ST14	48	35
CCSCCC=NNC(=O)c1nc2ccccc2s1	ZINC000872437636	CG	On-Demand	Reactive	TMPRSS6	65	35
Cc1ccc(S(=O)(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C#N)c1	ZINC000872437640	GD	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C#N)c1	ZINC000872437640	GD	On-Demand	Mild	TRPV4	43	36
O=C(NN=C1CCC(O)CC1)c1nc2ccccc2s1	ZINC000872437650	CE	On-Demand	Reactive	TRY1_BOVIN	41	37
O=C(NN=C1CCC(O)CC1)c1nc2ccccc2s1	ZINC000872437650	CE	On-Demand	Reactive	TPSAB1	17	43
O=C(NN=C1CCC(O)CC1)c1nc2ccccc2s1	ZINC000872437650	CE	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CCC(O)CC1)c1nc2ccccc2s1	ZINC000872437650	CE	On-Demand	Reactive	TMPRSS6	67	33
O=C(NN=C1CCCC12CCC2)c1nc2ccccc2s1	ZINC000872437657	CH	On-Demand	Reactive	ST14	42	34
O=C(NN=C1CCCC12CCC2)c1nc2ccccc2s1	ZINC000872437657	CH	On-Demand	Reactive	TMPRSS6	55	34
COCC(CC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437670	DG	On-Demand	Reactive	TPSAB1	16	42
COCC(CC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437670	DG	On-Demand	Reactive	ST14	45	36
COCC(CC(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437670	DG	On-Demand	Reactive	TMPRSS6	63	36
O=C(NN=C1CCC12CCCC2)c1nc2ccccc2s1	ZINC000872437673	CH	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCC12CCCC2)c1nc2ccccc2s1	ZINC000872437673	CH	On-Demand	Reactive	TMPRSS6	53	32
O=C(NN=C1CCCC[C@@H]1CCCO)c1nc2ccccc2s1	ZINC000872437677	EG	On-Demand	Reactive	TRY1_BOVIN	41	35
O=C(NN=C1CCCC[C@@H]1CCCO)c1nc2ccccc2s1	ZINC000872437677	EG	On-Demand	Reactive	TPSAB1	16	43
O=C(NN=C1CCCC[C@@H]1CCCO)c1nc2ccccc2s1	ZINC000872437677	EG	On-Demand	Reactive	ST14	49	34
O=C(NN=C1CCCC[C@@H]1CCCO)c1nc2ccccc2s1	ZINC000872437677	EG	On-Demand	Reactive	TMPRSS6	76	34
O=C(NN=C1CCCC[C@H]1CCCO)c1nc2ccccc2s1	ZINC000872437678	EG	On-Demand	Reactive	TRY1_BOVIN	41	35
O=C(NN=C1CCCC[C@H]1CCCO)c1nc2ccccc2s1	ZINC000872437678	EG	On-Demand	Reactive	TPSAB1	16	43
O=C(NN=C1CCCC[C@H]1CCCO)c1nc2ccccc2s1	ZINC000872437678	EG	On-Demand	Reactive	ST14	49	34
O=C(NN=C1CCCC[C@H]1CCCO)c1nc2ccccc2s1	ZINC000872437678	EG	On-Demand	Reactive	TMPRSS6	76	34
CS(=O)(=O)CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437680	FF	On-Demand	Reactive	TRY1_BOVIN	42	37
CS(=O)(=O)CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437680	FF	On-Demand	Reactive	ST14	46	33
CS(=O)(=O)CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437680	FF	On-Demand	Reactive	TMPRSS6	63	33
O=C(NN=CC1(F)CC1)c1nc2ccccc2s1	ZINC000872437695	CF	On-Demand	Reactive	TMPRSS6	43	31
CO[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437701	CE	On-Demand	Reactive	TPSAB1	16	45
CO[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437701	CE	On-Demand	Reactive	ST14	41	37
CO[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437701	CE	On-Demand	Reactive	TMPRSS6	58	37
CO[C@@H](C=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872437703	CE	On-Demand	Reactive	TRY1_BOVIN	43	38
CO[C@@H](C=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872437703	CE	On-Demand	Reactive	TPSAB1	17	41
CO[C@@H](C=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872437703	CE	On-Demand	Reactive	ST14	46	34
CO[C@@H](C=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872437703	CE	On-Demand	Reactive	TMPRSS6	64	34
CON(C)C(=O)CCC(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437705	EE	On-Demand	Reactive	TMPRSS6	49	32
CC(=NNC(=O)c1nc2ccccc2s1)C1CCN(C)CC1	ZINC000872437714	DF	On-Demand	Reactive	TRY1_BOVIN	44	39
CC(=NNC(=O)c1nc2ccccc2s1)C1CCN(C)CC1	ZINC000872437714	DF	On-Demand	Reactive	TPSAB1	17	42
CC(=NNC(=O)c1nc2ccccc2s1)C1CCN(C)CC1	ZINC000872437714	DF	On-Demand	Reactive	TMPRSS6	44	31
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437715	FE	On-Demand	Reactive	TRY1_BOVIN	40	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN(C)C)CC2)c(C#N)c1	ZINC000872437717	FC	On-Demand	Mild	TRPV4	45	37
CCN(CC)C(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437721	FF	On-Demand	Anodyne	TBXA2R	43	34
CCN(CC)C(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437721	FF	On-Demand	Anodyne	LEF	29	40
O=C(NN=C1CCCN2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437723	EG	On-Demand	Reactive	TRY1_BOVIN	45	38
O=C(NN=C1CCCN2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437723	EG	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCCN2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437723	EG	On-Demand	Reactive	ST14	42	34
O=C(NN=C1CCCN2CCCC[C@@H]12)c1nc2ccccc2s1	ZINC000872437723	EG	On-Demand	Reactive	TMPRSS6	50	34
O=C(NN=C1CCCN2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437724	EG	On-Demand	Reactive	TRY1_BOVIN	45	38
O=C(NN=C1CCCN2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437724	EG	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCCN2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437724	EG	On-Demand	Reactive	ST14	42	34
O=C(NN=C1CCCN2CCCC[C@H]12)c1nc2ccccc2s1	ZINC000872437724	EG	On-Demand	Reactive	TMPRSS6	50	34
CCOC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872437741	GF	On-Demand	Anodyne	GCKR	74	32
CCOC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872437742	GF	On-Demand	Anodyne	GCKR	74	32
CO[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437748	DF	On-Demand	Reactive	TRY1_BOVIN	41	36
CO[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437748	DF	On-Demand	Reactive	TPSAB1	17	40
CO[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437748	DF	On-Demand	Reactive	TMPRSS6	44	32
O=C(NN=C1CCC(C(F)(F)F)CC1)c1nc2ccccc2s1	ZINC000872437752	EI	On-Demand	Reactive	ST14	41	31
O=C(NN=C1CCC(C(F)(F)F)CC1)c1nc2ccccc2s1	ZINC000872437752	EI	On-Demand	Reactive	TMPRSS6	48	31
CC(CCCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437757	CF	On-Demand	Reactive	TPSAB1	16	40
CC(CCCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437757	CF	On-Demand	Reactive	ST14	44	35
CC(CCCCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437757	CF	On-Demand	Reactive	TMPRSS6	65	35
C[C@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437771	CH	On-Demand	Reactive	TRY1_BOVIN	45	39
C[C@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437771	CH	On-Demand	Reactive	TPSAB1	18	41
C[C@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437771	CH	On-Demand	Reactive	ST14	47	34
C[C@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872437771	CH	On-Demand	Reactive	TMPRSS6	65	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCSCC3)cc2N1	ZINC000872437782	FF	On-Demand	Anodyne	PKM	21	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H](O)C3)cc2N1	ZINC000872437792	FE	On-Demand	Anodyne	PKM	38	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@@H](O)C3)cc2N1	ZINC000872437793	FE	On-Demand	Anodyne	PKM	38	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@H](O)C3)cc2N1	ZINC000872437794	FE	On-Demand	Anodyne	PKM	38	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@@H](O)C3)cc2N1	ZINC000872437795	FE	On-Demand	Anodyne	PKM	38	46
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437800	GG	On-Demand	Reactive	TRY1_BOVIN	40	35
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437800	GG	On-Demand	Reactive	ST14	41	31
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437800	GG	On-Demand	Reactive	TMPRSS6	48	31
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437801	GG	On-Demand	Reactive	TRY1_BOVIN	40	35
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437801	GG	On-Demand	Reactive	ST14	41	31
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437801	GG	On-Demand	Reactive	TMPRSS6	48	31
Cn1ncc2c(N3CCN(C(=O)c4cc5ccccc5[nH]4)CC3)nc(Cl)nc21	ZINC000872437831	GE	On-Demand	Anodyne	HRH4	37	55
Cn1ncc2c(N3CCN(C(=O)c4cc5ccccc5[nH]4)CC3)nc(Cl)nc21	ZINC000872437831	GE	On-Demand	Anodyne	AKR1C3	19	45
COCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872437833	EC	On-Demand	Mild	TRPV4	47	39
C=CC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437834	CH	On-Demand	Reactive	TPSAB1	17	43
C=CC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437834	CH	On-Demand	Reactive	ST14	50	38
C=CC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437834	CH	On-Demand	Reactive	TMPRSS6	73	38
C=CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437835	CH	On-Demand	Reactive	TPSAB1	17	43
C=CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437835	CH	On-Demand	Reactive	ST14	50	38
C=CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872437835	CH	On-Demand	Reactive	TMPRSS6	73	38
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	CASP3	41	39
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	MMP13	38	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	ITGA4	36	43
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	CAPNS1	16	42
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	MMP3	43	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	CASP7	56	36
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	MMP7	47	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	MMP1	44	48
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	SFRP1	44	31
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437844	ED	On-Demand	Anodyne	WNT3	48	32
Nc1nc(C(F)F)nc(N2CCC(Cc3ccc(F)cc3)CC2)n1	ZINC000872437848	EF	On-Demand	Anodyne	GRIN2B	49	42
Nc1nc(C(F)F)nc(N2CCC(Cc3ccc(F)cc3)CC2)n1	ZINC000872437848	EF	On-Demand	Anodyne	GRIN2C	15	41
CC(CCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437852	CD	On-Demand	Reactive	TPSAB1	17	41
CC(CCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437852	CD	On-Demand	Reactive	ST14	45	36
CC(CCO)=NNC(=O)c1nc2ccccc2s1	ZINC000872437852	CD	On-Demand	Reactive	TMPRSS6	67	36
CCOC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437857	EG	On-Demand	Reactive	TRY1_BOVIN	45	38
CCOC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437857	EG	On-Demand	Reactive	TPSAB1	17	41
CCOC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437857	EG	On-Demand	Reactive	ST14	47	34
CCOC(=O)C1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437857	EG	On-Demand	Reactive	TMPRSS6	65	34
CN1CCC(CN=c2cc[nH]cc2C2CC2)CC1	ZINC000872437866	BE	On-Demand	Anodyne	HTR1F	50	34
O=C(NN=C1CCOC1)c1nc2ccccc2s1	ZINC000872437870	CD	On-Demand	Reactive	ST14	45	33
O=C(NN=C1CCOC1)c1nc2ccccc2s1	ZINC000872437870	CD	On-Demand	Reactive	TMPRSS6	62	33
O=C(NN=C1CCN(CCO)CC1)c1nc2ccccc2s1	ZINC000872437874	DD	On-Demand	Reactive	HTR7	15	48
O=C(NN=C1CCN(CCO)CC1)c1nc2ccccc2s1	ZINC000872437874	DD	On-Demand	Reactive	TRY1_BOVIN	44	37
O=C(NN=C1CCN(CCO)CC1)c1nc2ccccc2s1	ZINC000872437874	DD	On-Demand	Reactive	ST14	47	33
O=C(NN=C1CCN(CCO)CC1)c1nc2ccccc2s1	ZINC000872437874	DD	On-Demand	Reactive	TMPRSS6	64	34
COCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872437877	FE	On-Demand	Anodyne	PKM	39	48
C[C@@H]1C[C@H]1C=NNC(=O)c1nc2ccccc2s1	ZINC000872437885	CF	On-Demand	Reactive	TMPRSS6	48	32
C[C@H]1C[C@H]1C=NNC(=O)c1nc2ccccc2s1	ZINC000872437887	CF	On-Demand	Reactive	TMPRSS6	48	32
C[C@@H]1C[C@@H]1C=NNC(=O)c1nc2ccccc2s1	ZINC000872437888	CF	On-Demand	Reactive	TMPRSS6	48	32
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)(C)C)CC1	ZINC000872437893	FE	On-Demand	Mild	CCR8	103	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)(C)C)CC1	ZINC000872437893	FE	On-Demand	Mild	SFRP1	124	38
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)C(C)(C)C)CC1	ZINC000872437893	FE	On-Demand	Mild	WNT3	82	38
CC(CCCC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872437894	EI	On-Demand	Reactive	ST14	43	34
CC(CCCC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872437894	EI	On-Demand	Reactive	TMPRSS6	59	33
O=C(NN=C1CC2(CCC2)C1)c1nc2ccccc2s1	ZINC000872437895	CG	On-Demand	Reactive	TRY1_BOVIN	40	36
O=C(NN=C1CC2(CCC2)C1)c1nc2ccccc2s1	ZINC000872437895	CG	On-Demand	Reactive	TPSAB1	17	40
O=C(NN=C1CC2(CCC2)C1)c1nc2ccccc2s1	ZINC000872437895	CG	On-Demand	Reactive	ST14	47	34
O=C(NN=C1CC2(CCC2)C1)c1nc2ccccc2s1	ZINC000872437895	CG	On-Demand	Reactive	TMPRSS6	69	34
COCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872437897	DE	On-Demand	Anodyne	LEF	25	41
CN1CCC(=NNC(=O)c2nc3ccccc3s2)CC1(C)C	ZINC000872437901	DF	On-Demand	Reactive	TRY1_BOVIN	43	38
CN1CCC(=NNC(=O)c2nc3ccccc3s2)CC1(C)C	ZINC000872437901	DF	On-Demand	Reactive	ST14	49	35
CN1CCC(=NNC(=O)c2nc3ccccc3s2)CC1(C)C	ZINC000872437901	DF	On-Demand	Reactive	TMPRSS6	72	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCN4CCCC[C@H]34)cc2N1	ZINC000872437913	GF	On-Demand	Anodyne	PKM	29	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCN4CCCC[C@H]34)cc2N1	ZINC000872437914	GF	On-Demand	Anodyne	PKM	29	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCN4CCCC[C@@H]34)cc2N1	ZINC000872437915	GF	On-Demand	Anodyne	PKM	29	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCN4CCCC[C@@H]34)cc2N1	ZINC000872437916	GF	On-Demand	Anodyne	PKM	29	44
CCO[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H]1SC	ZINC000872437919	EF	On-Demand	Reactive	ST14	41	33
CCO[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H]1SC	ZINC000872437919	EF	On-Demand	Reactive	TMPRSS6	62	33
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H]1SC	ZINC000872437920	EF	On-Demand	Reactive	ST14	41	33
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H]1SC	ZINC000872437920	EF	On-Demand	Reactive	TMPRSS6	62	33
CCO[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H]1SC	ZINC000872437921	EF	On-Demand	Reactive	ST14	41	33
CCO[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H]1SC	ZINC000872437921	EF	On-Demand	Reactive	TMPRSS6	62	33
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H]1SC	ZINC000872437922	EF	On-Demand	Reactive	ST14	41	33
CCO[C@@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H]1SC	ZINC000872437922	EF	On-Demand	Reactive	TMPRSS6	62	33
O=C(NN=C1CCCS(=O)(=O)CC1)c1nc2ccccc2s1	ZINC000872437924	ED	On-Demand	Reactive	TMPRSS6	43	31
O=C(NN=CC1CCSCC1)c1nc2ccccc2s1	ZINC000872437925	DG	On-Demand	Reactive	TMPRSS6	46	29
CC(CC1CCOCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872437927	DG	On-Demand	Reactive	TMPRSS6	52	32
O=C(NN=C1C[C@H]2C=C[C@@H]1CC2)c1nc2ccccc2s1	ZINC000872437928	CG	On-Demand	Reactive	TRY1_BOVIN	40	35
O=C(NN=C1C[C@H]2C=C[C@@H]1CC2)c1nc2ccccc2s1	ZINC000872437928	CG	On-Demand	Reactive	TMPRSS6	48	31
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)C[C@@H](C)O1	ZINC000872437929	DF	On-Demand	Reactive	ST14	46	34
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)C[C@@H](C)O1	ZINC000872437929	DF	On-Demand	Reactive	TMPRSS6	64	34
O=C(NN=C1CCC(C(=O)O)CC1)c1nc2ccccc2s1	ZINC000872437930	DF	On-Demand	Reactive	TRY1_BOVIN	42	38
O=C(NN=C1CCC(C(=O)O)CC1)c1nc2ccccc2s1	ZINC000872437930	DF	On-Demand	Reactive	TPSAB1	17	41
O=C(NN=C1CCC(C(=O)O)CC1)c1nc2ccccc2s1	ZINC000872437930	DF	On-Demand	Reactive	ST14	45	32
O=C(NN=C1CCC(C(=O)O)CC1)c1nc2ccccc2s1	ZINC000872437930	DF	On-Demand	Reactive	TMPRSS6	58	32
CCOC(=O)NC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437931	FG	On-Demand	Reactive	TRY1_BOVIN	41	38
CCOC(=O)NC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437931	FG	On-Demand	Reactive	ST14	49	35
CCOC(=O)NC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872437931	FG	On-Demand	Reactive	TMPRSS6	71	35
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)Cn1cccn1	ZINC000872437933	GE	On-Demand	Anodyne	PKM	36	43
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)Cn1cccn1	ZINC000872437934	GE	On-Demand	Anodyne	PKM	36	43
C[C@@H](Cn1ccnc1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872437936	GE	On-Demand	Anodyne	PKM	36	45
O=C(NN=C1CCC[C@H]1CCF)c1nc2ccccc2s1	ZINC000872437939	DH	On-Demand	Reactive	TRY1_BOVIN	43	37
O=C(NN=C1CCC[C@H]1CCF)c1nc2ccccc2s1	ZINC000872437939	DH	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCC[C@H]1CCF)c1nc2ccccc2s1	ZINC000872437939	DH	On-Demand	Reactive	ST14	45	32
O=C(NN=C1CCC[C@H]1CCF)c1nc2ccccc2s1	ZINC000872437939	DH	On-Demand	Reactive	TMPRSS6	53	32
O=C(NN=C1CCC[C@@H]1CCF)c1nc2ccccc2s1	ZINC000872437940	DH	On-Demand	Reactive	TRY1_BOVIN	43	37
O=C(NN=C1CCC[C@@H]1CCF)c1nc2ccccc2s1	ZINC000872437940	DH	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CCC[C@@H]1CCF)c1nc2ccccc2s1	ZINC000872437940	DH	On-Demand	Reactive	ST14	45	32
O=C(NN=C1CCC[C@@H]1CCF)c1nc2ccccc2s1	ZINC000872437940	DH	On-Demand	Reactive	TMPRSS6	53	32
O=C(NN=C1CCCC12CCOCC2)c1nc2ccccc2s1	ZINC000872437945	EG	On-Demand	Reactive	TMPRSS6	43	32
CC(=NNC(=O)c1nc2ccccc2s1)c1cnn(C(C)C)c1	ZINC000872437971	EG	On-Demand	Reactive	TMPRSS6	55	33
C[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437975	CG	On-Demand	Reactive	TRY1_BOVIN	46	40
C[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437975	CG	On-Demand	Reactive	TPSAB1	18	43
C[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437975	CG	On-Demand	Reactive	ST14	48	35
C[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437975	CG	On-Demand	Reactive	BCL2L1	17	40
C[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872437975	CG	On-Demand	Reactive	TMPRSS6	71	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCSCC3)cc2N1	ZINC000872437976	FE	On-Demand	Anodyne	PKM	26	44
Oc1nnc(Cl)cc1N[C@@H]1CCCCc2ccccc21	ZINC000872437980	CH	On-Demand	Anodyne	KCNN3	23	45
Oc1nnc(Cl)cc1N[C@H]1CCCCc2ccccc21	ZINC000872437981	CH	On-Demand	Anodyne	KCNN3	23	45
O=S(=O)(c1cccc(Br)n1)N1CCC(N2CCCCC2)CC1	ZINC000872437983	GE	On-Demand	Anodyne	L3MBTL3	94	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCSCC1	ZINC000872437984	DF	On-Demand	Anodyne	PKM	49	41
CC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872437991	DD	On-Demand	Mild	EPHX2	27	47
CC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872437991	DD	On-Demand	Mild	TRPV4	42	34
CC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872437992	DD	On-Demand	Mild	EPHX2	27	47
CC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872437992	DD	On-Demand	Mild	TRPV4	42	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCSCC1	ZINC000872437997	EF	On-Demand	Anodyne	PKM	43	39
Cn1ncc2c(N3CCN(c4ccc(C#N)cc4F)CC3)nc(Cl)nc21	ZINC000872437998	FE	On-Demand	Mild	Q9M629_MAIZE	40	35
C[C@@H]1CN(C2CC2)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438000	DE	On-Demand	Reactive	TRY1_BOVIN	44	38
C[C@@H]1CN(C2CC2)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438000	DE	On-Demand	Reactive	TPSAB1	17	41
C[C@@H]1CN(C2CC2)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438000	DE	On-Demand	Reactive	ST14	46	33
C[C@@H]1CN(C2CC2)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438000	DE	On-Demand	Reactive	TMPRSS6	59	33
CC(=O)N[C@@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872438001	GD	On-Demand	Anodyne	PKM	24	41
CC(=O)N[C@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872438002	GD	On-Demand	Anodyne	PKM	24	41
O=C(NN=C1CCCCCC1)c1nc2ccccc2s1	ZINC000872438014	CH	On-Demand	Reactive	TPSAB1	17	40
O=C(NN=C1CCCCCC1)c1nc2ccccc2s1	ZINC000872438014	CH	On-Demand	Reactive	ST14	48	34
O=C(NN=C1CCCCCC1)c1nc2ccccc2s1	ZINC000872438014	CH	On-Demand	Reactive	TMPRSS6	70	34
CNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872438016	EB	On-Demand	Mild	EPHX2	15	40
CNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872438016	EB	On-Demand	Mild	TRPV4	47	39
C=CCCC(CC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438023	CH	On-Demand	Reactive	TMPRSS6	50	33
CC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872438024	CG	On-Demand	Reactive	TRY1_BOVIN	43	39
CC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872438024	CG	On-Demand	Reactive	TPSAB1	18	44
CC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872438024	CG	On-Demand	Reactive	ST14	41	32
CC(=NNC(=O)c1nc2ccccc2s1)C1CCC1	ZINC000872438024	CG	On-Demand	Reactive	TMPRSS6	53	32
COC[C@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438053	CE	On-Demand	Reactive	TPSAB1	16	40
COC[C@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438053	CE	On-Demand	Reactive	ST14	41	36
COC[C@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438053	CE	On-Demand	Reactive	TMPRSS6	58	36
COC[C@@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438054	CE	On-Demand	Reactive	TPSAB1	16	40
COC[C@@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438054	CE	On-Demand	Reactive	ST14	41	36
COC[C@@H](C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438054	CE	On-Demand	Reactive	TMPRSS6	58	36
CS(=O)(=O)[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438060	ED	On-Demand	Reactive	TRY1_BOVIN	43	37
CS(=O)(=O)[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438060	ED	On-Demand	Reactive	TMPRSS6	44	32
CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872438069	EG	On-Demand	Mild	CYP19A1	17	41
CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872438069	EG	On-Demand	Mild	BMP1	33	40
C#CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438076	CG	On-Demand	Reactive	TRY1_BOVIN	41	38
C#CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438076	CG	On-Demand	Reactive	TPSAB1	17	42
C#CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438076	CG	On-Demand	Reactive	ST14	46	33
C#CC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438076	CG	On-Demand	Reactive	TMPRSS6	59	33
COC(=O)[C@H]1C[C@H]2CC(=NNC(=O)c3nc4ccccc4s3)[C@H]1C2	ZINC000872438084	EF	On-Demand	Reactive	ST14	41	33
COC(=O)[C@H]1C[C@H]2CC(=NNC(=O)c3nc4ccccc4s3)[C@H]1C2	ZINC000872438084	EF	On-Demand	Reactive	TMPRSS6	53	33
O=S(=O)(NCCN1CCCCC1)c1cccc(Br)n1	ZINC000872438091	ED	On-Demand	Anodyne	HTR7	28	43
CC(CC(C)(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438092	CH	On-Demand	Reactive	TPSAB1	16	40
CC(CC(C)(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438092	CH	On-Demand	Reactive	ST14	40	35
CC(CC(C)(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438092	CH	On-Demand	Reactive	TMPRSS6	56	35
CC(CCC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872438097	DH	On-Demand	Reactive	ST14	40	35
CC(CCC(F)(F)F)=NNC(=O)c1nc2ccccc2s1	ZINC000872438097	DH	On-Demand	Reactive	TMPRSS6	60	34
O=C(NN=C1CCC12CCC2)c1nc2ccccc2s1	ZINC000872438100	CG	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCC12CCC2)c1nc2ccccc2s1	ZINC000872438100	CG	On-Demand	Reactive	TMPRSS6	53	32
O=C(NN=CCCCCCO)c1nc2ccccc2s1	ZINC000872438102	CF	On-Demand	Reactive	ST14	41	32
O=C(NN=CCCCCCO)c1nc2ccccc2s1	ZINC000872438102	CF	On-Demand	Reactive	TMPRSS6	62	32
O=C(NN=C1CN2CCC1CC2)c1nc2ccccc2s1	ZINC000872438106	DE	On-Demand	Reactive	TRY1_BOVIN	45	38
O=C(NN=C1CN2CCC1CC2)c1nc2ccccc2s1	ZINC000872438106	DE	On-Demand	Reactive	TPSAB1	17	42
O=C(NN=C1CN2CCC1CC2)c1nc2ccccc2s1	ZINC000872438106	DE	On-Demand	Reactive	ST14	46	33
O=C(NN=C1CN2CCC1CC2)c1nc2ccccc2s1	ZINC000872438106	DE	On-Demand	Reactive	TMPRSS6	68	33
O=C(NN=C1CC[C@H]1C1CC1)c1nc2ccccc2s1	ZINC000872438109	CG	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CC[C@H]1C1CC1)c1nc2ccccc2s1	ZINC000872438109	CG	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=C1CC[C@@H]1C1CC1)c1nc2ccccc2s1	ZINC000872438110	CG	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CC[C@@H]1C1CC1)c1nc2ccccc2s1	ZINC000872438110	CG	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=C1CCN(CCC(F)(F)F)CC1)c1nc2ccccc2s1	ZINC000872438113	FG	On-Demand	Reactive	TMPRSS6	44	31
C[C@@H]1C[C@@H](C(=O)O)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438118	EF	On-Demand	Reactive	TRY1_BOVIN	40	36
C[C@@H]1C[C@@H](C(=O)O)CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438118	EF	On-Demand	Reactive	TMPRSS6	44	32
O=C(NN=C1CCC[C@@H]1CCCF)c1nc2ccccc2s1	ZINC000872438128	DH	On-Demand	Reactive	TRY1_BOVIN	42	36
O=C(NN=C1CCC[C@@H]1CCCF)c1nc2ccccc2s1	ZINC000872438128	DH	On-Demand	Reactive	TPSAB1	16	41
O=C(NN=C1CCC[C@@H]1CCCF)c1nc2ccccc2s1	ZINC000872438128	DH	On-Demand	Reactive	ST14	40	31
O=C(NN=C1CCC[C@@H]1CCCF)c1nc2ccccc2s1	ZINC000872438128	DH	On-Demand	Reactive	TMPRSS6	48	31
O=C(NN=C1CCC[C@H]1CCCF)c1nc2ccccc2s1	ZINC000872438129	DH	On-Demand	Reactive	TRY1_BOVIN	42	36
O=C(NN=C1CCC[C@H]1CCCF)c1nc2ccccc2s1	ZINC000872438129	DH	On-Demand	Reactive	TPSAB1	16	41
O=C(NN=C1CCC[C@H]1CCCF)c1nc2ccccc2s1	ZINC000872438129	DH	On-Demand	Reactive	ST14	40	31
O=C(NN=C1CCC[C@H]1CCCF)c1nc2ccccc2s1	ZINC000872438129	DH	On-Demand	Reactive	TMPRSS6	48	31
COC(=O)[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438132	EF	On-Demand	Reactive	TRY1_BOVIN	43	36
COC(=O)[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438132	EF	On-Demand	Reactive	TPSAB1	16	41
CN1CCN(c2ncc(C=NNC(=O)c3nc4ccccc4s3)cn2)CC1	ZINC000872438135	GD	On-Demand	Reactive	HTR3A	20	41
CN1CCN(c2ncc(C=NNC(=O)c3nc4ccccc4s3)cn2)CC1	ZINC000872438135	GD	On-Demand	Reactive	ST14	41	32
CN1CCN(c2ncc(C=NNC(=O)c3nc4ccccc4s3)cn2)CC1	ZINC000872438135	GD	On-Demand	Reactive	TMPRSS6	49	32
O=C(NN=C1CCC(F)(F)CC1)c1nc2ccccc2s1	ZINC000872438143	DH	On-Demand	Reactive	ST14	46	34
O=C(NN=C1CCC(F)(F)CC1)c1nc2ccccc2s1	ZINC000872438143	DH	On-Demand	Reactive	TMPRSS6	63	34
CC(CCCCN(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438155	DG	On-Demand	Reactive	ST14	42	34
CC(CCCCN(C)C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438155	DG	On-Demand	Reactive	TMPRSS6	63	33
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)CS1	ZINC000872438157	DG	On-Demand	Reactive	TRY1_BOVIN	40	37
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)CS1	ZINC000872438157	DG	On-Demand	Reactive	ST14	42	33
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)CS1	ZINC000872438157	DG	On-Demand	Reactive	TMPRSS6	54	33
COCC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438161	DG	On-Demand	Reactive	TRY1_BOVIN	43	37
COCC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438161	DG	On-Demand	Reactive	TPSAB1	17	41
COCC[C@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438161	DG	On-Demand	Reactive	TMPRSS6	49	32
COCC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438162	DG	On-Demand	Reactive	TRY1_BOVIN	43	37
COCC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438162	DG	On-Demand	Reactive	TPSAB1	17	41
COCC[C@@H]1CCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438162	DG	On-Demand	Reactive	TMPRSS6	49	32
C[C@@H](C=NNC(=O)c1nc2ccccc2s1)CCC#N	ZINC000872438168	CF	On-Demand	Reactive	TPSAB1	16	40
C[C@@H](C=NNC(=O)c1nc2ccccc2s1)CCC#N	ZINC000872438168	CF	On-Demand	Reactive	ST14	42	37
C[C@@H](C=NNC(=O)c1nc2ccccc2s1)CCC#N	ZINC000872438168	CF	On-Demand	Reactive	TMPRSS6	59	37
O=C(NN=C1CC2(CC2)C1)c1nc2ccccc2s1	ZINC000872438169	CF	On-Demand	Reactive	ST14	48	35
O=C(NN=C1CC2(CC2)C1)c1nc2ccccc2s1	ZINC000872438169	CF	On-Demand	Reactive	TMPRSS6	70	35
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438171	CG	On-Demand	Reactive	TRY1_BOVIN	41	37
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438171	CG	On-Demand	Reactive	TPSAB1	17	40
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438171	CG	On-Demand	Reactive	ST14	46	33
C[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438171	CG	On-Demand	Reactive	TMPRSS6	63	33
COCC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438174	DG	On-Demand	Reactive	TRY1_BOVIN	41	37
COCC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438174	DG	On-Demand	Reactive	TPSAB1	17	40
COCC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438174	DG	On-Demand	Reactive	ST14	46	33
COCC1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438174	DG	On-Demand	Reactive	TMPRSS6	63	33
O=S(=O)(NCCN1CCCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872438179	EF	On-Demand	Anodyne	HTR2A	15	41
O=S(=O)(NCCN1CCCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872438179	EF	On-Demand	Anodyne	HTR7	35	44
O=S(=O)(NCCN1CCCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872438179	EF	On-Demand	Anodyne	HTR6	16	41
COCC(C)(C)C=NNC(=O)c1nc2ccccc2s1	ZINC000872438185	CF	On-Demand	Reactive	TMPRSS6	44	33
CC[C@H]1CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438187	CG	On-Demand	Reactive	TRY1_BOVIN	46	40
CC[C@H]1CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438187	CG	On-Demand	Reactive	TPSAB1	18	44
CC[C@H]1CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438187	CG	On-Demand	Reactive	ST14	48	35
CC[C@H]1CCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438187	CG	On-Demand	Reactive	TMPRSS6	66	35
O=C(NN=C1CCCSC1)c1nc2ccccc2s1	ZINC000872438195	CF	On-Demand	Reactive	ST14	41	32
O=C(NN=C1CCCSC1)c1nc2ccccc2s1	ZINC000872438195	CF	On-Demand	Reactive	TMPRSS6	48	32
C[C@@H](Cn1ccnc1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872438199	EE	On-Demand	Anodyne	TBXAS1	15	40
COC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438200	CF	On-Demand	Reactive	TACR3	33	41
COC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438200	CF	On-Demand	Reactive	TPSAB1	17	46
COC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438200	CF	On-Demand	Reactive	ST14	54	40
COC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438200	CF	On-Demand	Reactive	TMPRSS6	83	40
COC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438201	CF	On-Demand	Reactive	TACR3	33	41
COC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438201	CF	On-Demand	Reactive	TPSAB1	17	46
COC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438201	CF	On-Demand	Reactive	ST14	54	40
COC[C@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438201	CF	On-Demand	Reactive	TMPRSS6	83	40
CCOC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438202	FD	On-Demand	Mild	EPHX2	23	43
CCOC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438202	FD	On-Demand	Mild	TRPV4	45	36
CCOC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438203	FD	On-Demand	Mild	EPHX2	23	43
CCOC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438203	FD	On-Demand	Mild	TRPV4	45	36
CC(=NNC(=O)c1nc2ccccc2s1)C1CCSCC1	ZINC000872438209	DH	On-Demand	Reactive	TPSAB1	17	40
CC(=NNC(=O)c1nc2ccccc2s1)C1CCSCC1	ZINC000872438209	DH	On-Demand	Reactive	TMPRSS6	48	32
C[C@@H]1O[C@H](C)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438214	CF	On-Demand	Reactive	ST14	41	33
C[C@@H]1O[C@H](C)CC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438214	CF	On-Demand	Reactive	TMPRSS6	53	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H](C)O1	ZINC000872438215	CF	On-Demand	Reactive	ST14	41	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@@H](C)O1	ZINC000872438215	CF	On-Demand	Reactive	TMPRSS6	53	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H](C)O1	ZINC000872438216	CF	On-Demand	Reactive	ST14	41	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)[C@H](C)O1	ZINC000872438216	CF	On-Demand	Reactive	TMPRSS6	53	33
O=C(NN=C1CN2CCC[C@H]1C2)c1nc2ccccc2s1	ZINC000872438218	DE	On-Demand	Reactive	TRY1_BOVIN	49	41
O=C(NN=C1CN2CCC[C@H]1C2)c1nc2ccccc2s1	ZINC000872438218	DE	On-Demand	Reactive	TPSAB1	18	43
O=C(NN=C1CN2CCC[C@H]1C2)c1nc2ccccc2s1	ZINC000872438218	DE	On-Demand	Reactive	ST14	47	36
O=C(NN=C1CN2CCC[C@H]1C2)c1nc2ccccc2s1	ZINC000872438218	DE	On-Demand	Reactive	TMPRSS6	64	36
C=CC[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438221	CH	On-Demand	Reactive	ST14	40	31
C=CC[C@@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438221	CH	On-Demand	Reactive	TMPRSS6	47	31
C=CC[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438222	CH	On-Demand	Reactive	ST14	40	31
C=CC[C@H]1CCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438222	CH	On-Demand	Reactive	TMPRSS6	47	31
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3nccs3)cc2N1	ZINC000872438228	FF	On-Demand	Anodyne	PKM	32	43
CC(CC1CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438233	CH	On-Demand	Reactive	TRY1_BOVIN	44	39
CC(CC1CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438233	CH	On-Demand	Reactive	TPSAB1	18	42
CC(CC1CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438233	CH	On-Demand	Reactive	ST14	42	33
CC(CC1CCC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438233	CH	On-Demand	Reactive	TMPRSS6	54	33
CN(C)[C@@H]1CCCC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438235	DF	On-Demand	Reactive	TRY1_BOVIN	42	36
O=C(NN=C1CCN(CCN2CCOCC2)CC1)c1nc2ccccc2s1	ZINC000872438251	GD	On-Demand	Reactive	CASR	46	46
O=C(NN=C1CCN(CCN2CCOCC2)CC1)c1nc2ccccc2s1	ZINC000872438251	GD	On-Demand	Reactive	ST14	48	33
O=C(NN=C1CCN(CCN2CCOCC2)CC1)c1nc2ccccc2s1	ZINC000872438251	GD	On-Demand	Reactive	TMPRSS6	70	33
O=C(Nc1cccc(F)c1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872438252	EH	On-Demand	Anodyne	TAAR1	23	42
O=C(Nc1cccc(F)c1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872438252	EH	On-Demand	Anodyne	TBK1	18	42
CNC(=O)[C@@H]1CCCN1S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872438253	GE	On-Demand	Anodyne	FKBP1A	40	44
CNC(=O)[C@@H]1CCCN1S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872438253	GE	On-Demand	Anodyne	LGMN	30	40
CNC(=O)[C@@H]1CCCN1S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872438253	GE	On-Demand	Anodyne	WNT3	43	31
COCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438255	FD	On-Demand	Anodyne	PKM	42	39
COCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438255	FD	On-Demand	Anodyne	TGM2	50	36
COCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438255	FD	On-Demand	Anodyne	F13A1	53	37
O=C(NC1CC1)c1cccc(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)c1	ZINC000872438259	GG	On-Demand	Anodyne	TRY2_BOVIN	51	37
O=C(NC1CC1)c1cccc(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)c1	ZINC000872438259	GG	On-Demand	Anodyne	ST14	86	39
O=C(CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCCCC1	ZINC000872438264	FE	On-Demand	Anodyne	TBXA2R	43	36
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCN1C	ZINC000872438278	DE	On-Demand	Reactive	TRY1_BOVIN	44	38
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCN1C	ZINC000872438278	DE	On-Demand	Reactive	TPSAB1	17	41
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCN1C	ZINC000872438278	DE	On-Demand	Reactive	ST14	42	32
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCN1C	ZINC000872438278	DE	On-Demand	Reactive	TMPRSS6	54	32
Cc1c(F)ncnc1N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872438281	EE	On-Demand	Anodyne	HRH4	41	58
Cc1c(F)ncnc1N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000872438281	EE	On-Demand	Anodyne	AKR1C3	20	49
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2	ZINC000872438287	FF	On-Demand	Mild	PKM	37	42
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2	ZINC000872438288	FF	On-Demand	Mild	PKM	37	42
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000872438311	FE	On-Demand	Mild	CCR8	64	33
CC[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCO1	ZINC000872438318	DF	On-Demand	Reactive	ST14	41	33
CC[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CCO1	ZINC000872438318	DF	On-Demand	Reactive	TMPRSS6	58	33
CC(=NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872438322	CH	On-Demand	Reactive	TRY1_BOVIN	44	39
CC(=NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872438322	CH	On-Demand	Reactive	TPSAB1	18	46
CC(=NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872438322	CH	On-Demand	Reactive	ST14	47	34
CC(=NNC(=O)c1nc2ccccc2s1)C1CCCC1	ZINC000872438322	CH	On-Demand	Reactive	TMPRSS6	65	34
CC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438325	FE	On-Demand	Anodyne	GCKR	64	32
CC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438326	FE	On-Demand	Anodyne	GCKR	64	32
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCOCC1	ZINC000872438329	DG	On-Demand	Reactive	ST14	46	33
CCC(=NNC(=O)c1nc2ccccc2s1)C1CCOCC1	ZINC000872438329	DG	On-Demand	Reactive	TMPRSS6	63	33
C[C@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438331	CH	On-Demand	Reactive	TRY1_BOVIN	47	39
C[C@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438331	CH	On-Demand	Reactive	TPSAB1	18	44
C[C@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438331	CH	On-Demand	Reactive	ST14	51	36
C[C@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438331	CH	On-Demand	Reactive	TMPRSS6	79	36
CNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438335	FC	On-Demand	Anodyne	ADORA2B	44	32
CNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438335	FC	On-Demand	Anodyne	PKM	43	38
CNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438335	FC	On-Demand	Anodyne	F13A1	41	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000872438345	GF	On-Demand	Mild	EPHX2	34	48
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438353	FE	On-Demand	Reactive	TRY1_BOVIN	42	36
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438353	FE	On-Demand	Reactive	TPSAB1	16	40
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438353	FE	On-Demand	Reactive	ST14	47	33
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438353	FE	On-Demand	Reactive	TMPRSS6	64	33
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872438356	DC	On-Demand	Mild	ITGA4	28	42
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872438356	DC	On-Demand	Mild	EPHX2	19	40
Cn1ncc2c(N[C@@H]3CCCC[C@@H]3O)nc(Cl)nc21	ZINC000872438357	CD	On-Demand	Anodyne	Q4VQ11_PIG	44	34
Cn1ncc2c(N[C@H]3CCCC[C@H]3O)nc(Cl)nc21	ZINC000872438358	CD	On-Demand	Anodyne	Q4VQ11_PIG	44	34
Cn1ncc2c(N[C@H]3CCCC[C@@H]3O)nc(Cl)nc21	ZINC000872438359	CD	On-Demand	Anodyne	Q4VQ11_PIG	44	34
Cn1ncc2c(N[C@@H]3CCCC[C@H]3O)nc(Cl)nc21	ZINC000872438360	CD	On-Demand	Anodyne	Q4VQ11_PIG	44	34
CO[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438361	DF	On-Demand	Reactive	TRY1_BOVIN	41	36
CO[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438361	DF	On-Demand	Reactive	TPSAB1	17	40
CO[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438361	DF	On-Demand	Reactive	ST14	47	33
CO[C@@H]1CCCCC1=NNC(=O)c1nc2ccccc2s1	ZINC000872438361	DF	On-Demand	Reactive	TMPRSS6	64	33
CC(C)(C)N1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438364	EG	On-Demand	Reactive	TRY1_BOVIN	41	37
CC(C)(C)N1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438364	EG	On-Demand	Reactive	TPSAB1	17	41
CC(C)(C)N1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438364	EG	On-Demand	Reactive	ST14	46	33
CC(C)(C)N1CCC(=NNC(=O)c2nc3ccccc3s2)CC1	ZINC000872438364	EG	On-Demand	Reactive	TMPRSS6	59	33
CC(CS(C)(=O)=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872438376	DD	On-Demand	Reactive	TPSAB1	16	40
CC(CS(C)(=O)=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872438376	DD	On-Demand	Reactive	ST14	40	35
CC(CS(C)(=O)=O)=NNC(=O)c1nc2ccccc2s1	ZINC000872438376	DD	On-Demand	Reactive	TMPRSS6	57	35
Cn1ncc2c(N3CCC(C(=O)Nc4cccc(F)c4)CC3)nc(Cl)nc21	ZINC000872438377	GG	On-Demand	Anodyne	PIK3CA	16	40
CCC(=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872438380	CG	On-Demand	Reactive	TRY1_BOVIN	44	37
CCC(=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872438380	CG	On-Demand	Reactive	TPSAB1	17	42
CCC(=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872438380	CG	On-Demand	Reactive	ST14	49	36
CCC(=NNC(=O)c1nc2ccccc2s1)C1CC1	ZINC000872438380	CG	On-Demand	Reactive	TMPRSS6	72	36
O=C(c1cc2ccccc2[nH]1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872438381	EG	On-Demand	Anodyne	GRIN2B	36	43
O=C(c1cc2ccccc2[nH]1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872438381	EG	On-Demand	Anodyne	HRH4	29	54
O=C(c1cc2ccccc2[nH]1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872438381	EG	On-Demand	Anodyne	AKR1C3	21	51
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCCC2)CC1	ZINC000872438382	GG	On-Demand	Anodyne	CHRM2	25	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCCC2)CC1	ZINC000872438382	GG	On-Demand	Anodyne	APP	19	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCCC2)CC1	ZINC000872438382	GG	On-Demand	Anodyne	PKM	43	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCCC2)CC1	ZINC000872438382	GG	On-Demand	Anodyne	L3MBTL3	99	52
Cn1ncc2c1CCCC2=NNC(=O)c1nc2ccccc2s1	ZINC000872438383	EF	On-Demand	Reactive	BCL2L1	18	42
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872438397	GD	On-Demand	Anodyne	PKM	25	43
CC(CC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438398	CG	On-Demand	Reactive	TRY1_BOVIN	42	39
CC(CC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438398	CG	On-Demand	Reactive	TPSAB1	18	42
CC(CC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438398	CG	On-Demand	Reactive	ST14	46	34
CC(CC1CC1)=NNC(=O)c1nc2ccccc2s1	ZINC000872438398	CG	On-Demand	Reactive	TMPRSS6	64	34
O=C(Nc1nccs1)[C@H]1CCCN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872438404	FE	On-Demand	Anodyne	MAP1	48	39
O=C(Nc1nccs1)[C@@H]1CCCN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872438405	FE	On-Demand	Anodyne	MAP1	48	39
O=C(NN=C1CCCS(=O)(=O)C1)c1nc2ccccc2s1	ZINC000872438410	DD	On-Demand	Reactive	TMPRSS6	43	31
Cc1cccc(C#N)c1S(=O)(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872438434	FE	On-Demand	Mild	PLG	15	43
Cc1cccc(C#N)c1S(=O)(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872438434	FE	On-Demand	Mild	MAPK11	28	42
Cc1cccc(C#N)c1S(=O)(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872438434	FE	On-Demand	Mild	MAPK14	33	44
Cc1cccc(C#N)c1S(=O)(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872438434	FE	On-Demand	Mild	ST14	15	43
Cc1cccc(C#N)c1S(=O)(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000872438434	FE	On-Demand	Mild	EZH2	40	37
O=C(NC1CC1)c1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872438440	EF	On-Demand	Anodyne	PLG	16	40
O=C(NC1CC1)c1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872438440	EF	On-Demand	Anodyne	DRD4	40	30
O=C(NC1CC1)c1cccc(OS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872438440	EF	On-Demand	Anodyne	ST14	17	40
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C1CC1	ZINC000872438442	DF	On-Demand	Reactive	TRY1_BOVIN	41	36
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C1CC1	ZINC000872438442	DF	On-Demand	Reactive	TPSAB1	17	40
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C1CC1	ZINC000872438442	DF	On-Demand	Reactive	ST14	47	33
C[C@H]1CC(=NNC(=O)c2nc3ccccc3s2)CN1C1CC1	ZINC000872438442	DF	On-Demand	Reactive	TMPRSS6	64	33
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872438447	DC	On-Demand	Mild	ITGA4	29	43
O=C(NCC1CC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438450	GF	On-Demand	Anodyne	EPHX2	15	41
O=C(NCC1CC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438450	GF	On-Demand	Anodyne	CACNA1I	62	36
O=C(NCC1CC1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438451	GF	On-Demand	Anodyne	EPHX2	15	41
O=C(NCC1CC1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872438451	GF	On-Demand	Anodyne	CACNA1I	62	36
CCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438487	CG	On-Demand	Reactive	TPSAB1	16	42
CCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438487	CG	On-Demand	Reactive	ST14	50	39
CCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438487	CG	On-Demand	Reactive	TMPRSS6	79	39
O=C(NN=C1CCSCC1)c1nc2ccccc2s1	ZINC000872438489	CF	On-Demand	Reactive	ST14	46	34
O=C(NN=C1CCSCC1)c1nc2ccccc2s1	ZINC000872438489	CF	On-Demand	Reactive	TMPRSS6	63	34
CC(C)(C)OC(=O)N1CC(=NNC(=O)c2nc3ccccc3s2)C1	ZINC000872438490	EF	On-Demand	Reactive	TMPRSS6	44	32
Oc1nnc(Cl)cc1N1CCC(Cc2ccc(F)cc2)CC1	ZINC000872438491	DG	On-Demand	Anodyne	GRIN2B	45	45
Oc1nnc(Cl)cc1N1CCC(Cc2ccc(F)cc2)CC1	ZINC000872438491	DG	On-Demand	Anodyne	CCR3	73	37
O=[N+]([O-])c1ccccc1CNS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872438492	DF	On-Demand	Bother	COLA	82	33
O=C(NN=C1CCS(=O)(=O)C1)c1nc2ccccc2s1	ZINC000872438501	DD	On-Demand	Reactive	TMPRSS6	48	32
Cc1ccc(S(=O)(=O)N2CCSCC2)c(C#N)c1	ZINC000872438502	CD	On-Demand	Mild	TRPV4	47	40
NC(=O)c1cc(N2CCN(Cc3cccc(O)c3)CC2)nc(Cl)n1	ZINC000872438514	ED	On-Demand	Anodyne	DRD2	15	47
NC(=O)c1cc(N2CCN(Cc3cccc(O)c3)CC2)nc(Cl)n1	ZINC000872438514	ED	On-Demand	Anodyne	DRD4	27	42
NC(=O)c1cc(N2CCN(Cc3cccc(O)c3)CC2)nc(Cl)n1	ZINC000872438514	ED	On-Demand	Anodyne	FAAH	20	42
O=C(NN=C1CCCCC1)c1nc2ccccc2s1	ZINC000872438515	CG	On-Demand	Reactive	TPSAB1	17	40
O=C(NN=C1CCCCC1)c1nc2ccccc2s1	ZINC000872438515	CG	On-Demand	Reactive	ST14	48	34
O=C(NN=C1CCCCC1)c1nc2ccccc2s1	ZINC000872438515	CG	On-Demand	Reactive	TMPRSS6	70	34
Cc1c(F)ncnc1N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000872438516	EG	On-Demand	Anodyne	AKT2	48	38
CCC(COC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438517	CE	On-Demand	Reactive	PYK	15	49
CCC(COC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438517	CE	On-Demand	Reactive	TMPRSS6	55	35
CC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438526	CG	On-Demand	Reactive	TPSAB1	17	44
CC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438526	CG	On-Demand	Reactive	ST14	43	38
CC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438526	CG	On-Demand	Reactive	TMPRSS6	66	38
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872438534	EC	On-Demand	Anodyne	MMP13	27	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872438534	EC	On-Demand	Anodyne	MMP3	30	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872438534	EC	On-Demand	Anodyne	MMP7	37	45
CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872438534	EC	On-Demand	Anodyne	MMP1	34	48
O=C(CCNS(=O)(=O)c1cccc(Br)n1)NC1CCCCC1	ZINC000872438540	GD	On-Demand	Anodyne	EPHX2	16	43
Cc1c(F)ncnc1N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872438556	FG	On-Demand	Anodyne	GRM5	22	52
Cc1c(F)ncnc1N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872438556	FG	On-Demand	Anodyne	ETHR	23	45
Cc1c(F)ncnc1N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872438557	FG	On-Demand	Anodyne	GRM5	22	52
Cc1c(F)ncnc1N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872438557	FG	On-Demand	Anodyne	ETHR	23	45
CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438561	CG	On-Demand	Reactive	TACR3	46	38
CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438561	CG	On-Demand	Reactive	TPSAB1	18	46
CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438561	CG	On-Demand	Reactive	ST14	53	40
CC[C@@H](C)C(C)=NNC(=O)c1nc2ccccc2s1	ZINC000872438561	CG	On-Demand	Reactive	TMPRSS6	77	40
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	ADRA1D	28	40
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	ADRA1A	21	40
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	ADRA1B	22	40
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	HTR7	20	48
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	SFRP1	125	40
O=S(=O)(NC1CCN(Cc2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872438565	GG	On-Demand	Anodyne	WNT3	80	35
CCNC(=O)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872438580	FD	On-Demand	Anodyne	PKM	32	41
COc1cccc([C@@H](C)NS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872438591	DG	On-Demand	Anodyne	DUT	36	42
COc1cccc([C@H](C)NS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872438592	DG	On-Demand	Anodyne	DUT	36	42
Nc1nc(C(F)F)nc(N2CCN(Cc3cccc(O)c3)CC2)n1	ZINC000872438593	ED	On-Demand	Anodyne	DRD4	21	43
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872438606	GF	On-Demand	Mild	CCR8	99	41
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872438606	GF	On-Demand	Mild	SFRP1	73	33
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872438606	GF	On-Demand	Mild	WNT3	40	33
Oc1nnc(Cl)cc1N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000872438608	FG	On-Demand	Anodyne	AKT2	45	38
CC(=O)N1CCN(c2ccccc2CNc2cc(Cl)nnc2O)CC1	ZINC000872438613	FE	On-Demand	Anodyne	MC4R	60	40
CC(=O)N1CCN(c2ccccc2CNc2cc(Cl)nnc2O)CC1	ZINC000872438613	FE	On-Demand	Anodyne	KCNQ2	65	39
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438620	DG	On-Demand	Anodyne	ACACB	16	44
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438620	DG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438620	DG	On-Demand	Anodyne	GPR119	20	44
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438621	DG	On-Demand	Anodyne	ACACB	16	44
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438621	DG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872438621	DG	On-Demand	Anodyne	GPR119	20	44
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872438634	GF	On-Demand	Mild	CCR8	107	46
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872438634	GF	On-Demand	Mild	SFRP1	121	37
CCC(CC)C(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872438634	GF	On-Demand	Mild	WNT3	82	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872438640	FD	On-Demand	Mild	SLC6A1	57	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872438640	FD	On-Demand	Mild	EPHX2	20	48
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000872438640	FD	On-Demand	Mild	PDE8B	25	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872438641	FD	On-Demand	Mild	SLC6A1	57	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872438641	FD	On-Demand	Mild	EPHX2	20	48
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000872438641	FD	On-Demand	Mild	PDE8B	25	40
COCCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438669	DG	On-Demand	Reactive	TPSAB1	15	40
COCCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438669	DG	On-Demand	Reactive	ST14	46	37
COCCC(=NNC(=O)c1nc2ccccc2s1)C(C)C	ZINC000872438669	DG	On-Demand	Reactive	TMPRSS6	69	36
CCC(CC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438681	CG	On-Demand	Reactive	TPSAB1	17	41
CCC(CC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438681	CG	On-Demand	Reactive	ST14	49	37
CCC(CC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438681	CG	On-Demand	Reactive	PYK	25	54
CCC(CC)=NNC(=O)c1nc2ccccc2s1	ZINC000872438681	CG	On-Demand	Reactive	TMPRSS6	72	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(N2CCCCC2)CC1	ZINC000872438684	EF	On-Demand	Mild	L3MBTL3	85	44
O=C(Nc1cccc(F)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872438685	FF	On-Demand	Anodyne	NPY2R	30	40
O=C(Nc1cccc(F)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872438685	FF	On-Demand	Anodyne	TYK2	45	36
O=C(Nc1cccc(F)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872438685	FF	On-Demand	Anodyne	TAAR1	22	42
O=C(Nc1cccc(F)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872438685	FF	On-Demand	Anodyne	LIMK2	15	43
O=C(c1cccnc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438690	GE	On-Demand	Anodyne	TGM2	61	34
O=C(c1cccnc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438690	GE	On-Demand	Anodyne	F13A1	59	33
O=C(c1cccnc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438690	GE	On-Demand	Anodyne	AKR1C3	40	37
O=C(c1cccnc1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872438690	GE	On-Demand	Anodyne	SFRP1	16	41
CC(=O)N[C@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438703	GF	On-Demand	Anodyne	SLC6A5	33	41
CC(=O)N[C@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438703	GF	On-Demand	Anodyne	EPHX2	17	48
CC(=O)N[C@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438703	GF	On-Demand	Anodyne	MCHR1	20	44
CC(=O)N[C@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438703	GF	On-Demand	Anodyne	BIRC2	27	48
CC(=O)N[C@@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438704	GF	On-Demand	Anodyne	SLC6A5	33	41
CC(=O)N[C@@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438704	GF	On-Demand	Anodyne	EPHX2	17	48
CC(=O)N[C@@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438704	GF	On-Demand	Anodyne	MCHR1	20	44
CC(=O)N[C@@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872438704	GF	On-Demand	Anodyne	BIRC2	27	48
CC(=O)N1CCN(c2ccccc2CNc2ccnc3ncccc23)CC1	ZINC000872438753	FF	On-Demand	Anodyne	KCNQ2	44	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNc2cc(Cl)nnc2O)C1	ZINC000872438754	EF	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CCC[C@H](CNc2cc(Cl)nnc2O)C1	ZINC000872438755	EF	On-Demand	Anodyne	CACNA1I	43	33
Cn1ncc2c(N3CCN(Cc4cccc(O)c4)CC3)nc(Cl)nc21	ZINC000872438760	FE	On-Demand	Anodyne	PIK3CA	15	46
Cn1ncc2c(N3CCN(Cc4cccc(O)c4)CC3)nc(Cl)nc21	ZINC000872438760	FE	On-Demand	Anodyne	MTOR	18	46
CC(C)c1nnc(N2CCC(CNC(=O)c3cnn(C)c3)CC2)o1	ZINC000872438773	ED	On-Demand	Anodyne	CACNA1I	65	39
COC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438779	DD	On-Demand	Mild	EPHX2	36	49
COC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438779	DD	On-Demand	Mild	TRPV4	44	37
CC(=O)N1CCN(c2ccccc2CNc2cc(C)nc3c2cnn3C)CC1	ZINC000872438781	GF	On-Demand	Anodyne	KCNQ2	54	33
Cc1c(F)ncnc1N1CCN(Cc2cccc(O)c2)CC1	ZINC000872438795	DD	On-Demand	Anodyne	DRD2	15	47
Cc1c(F)ncnc1N1CCN(Cc2cccc(O)c2)CC1	ZINC000872438795	DD	On-Demand	Anodyne	DRD4	27	45
Cc1c(F)ncnc1N1CCN(Cc2cccc(O)c2)CC1	ZINC000872438795	DD	On-Demand	Anodyne	ABCC1	83	36
Cc1c(F)ncnc1N1CCN(Cc2cccc(O)c2)CC1	ZINC000872438795	DD	On-Demand	Anodyne	ABCB1A	50	33
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000872438804	FE	On-Demand	Mild	CCR8	51	32
CN1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872438813	CD	On-Demand	Anodyne	CACNA1I	47	34
O=S(=O)(NC1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872438833	DE	On-Demand	Anodyne	ADRA1D	19	40
O=S(=O)(NC1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872438833	DE	On-Demand	Anodyne	LEF	19	44
Cc1c(F)ncnc1NCc1ccc2c(c1)CCO2	ZINC000872438842	CE	On-Demand	Anodyne	CLK4	45	38
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438851	EF	On-Demand	Anodyne	ACACB	17	48
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438851	EF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438851	EF	On-Demand	Anodyne	SIRT3	54	43
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438851	EF	On-Demand	Anodyne	SIRT2	56	42
CC(C)(C)OC(=O)NC[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438851	EF	On-Demand	Anodyne	SIRT1	55	43
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438852	EF	On-Demand	Anodyne	ACACB	17	48
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438852	EF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438852	EF	On-Demand	Anodyne	SIRT3	54	43
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438852	EF	On-Demand	Anodyne	SIRT2	56	42
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872438852	EF	On-Demand	Anodyne	SIRT1	55	43
COC(=O)[C@H]1CCN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872438861	ED	On-Demand	Anodyne	MMP1	15	40
Cn1ncc2c(N3CC[C@@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872438876	FE	On-Demand	Anodyne	ACACB	16	46
Cn1ncc2c(N3CC[C@@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872438876	FE	On-Demand	Anodyne	CACNA1I	44	35
Cn1ncc2c(N3CC[C@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872438877	FE	On-Demand	Anodyne	ACACB	16	46
Cn1ncc2c(N3CC[C@H](CNC(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872438877	FE	On-Demand	Anodyne	CACNA1I	44	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCOCC3)cc2N1	ZINC000872438905	FE	On-Demand	Anodyne	PKM	36	46
CCOC(=O)C1CCN(C(=O)CN(C)c2cc(Cl)nnc2O)CC1	ZINC000872438912	FD	On-Demand	Anodyne	FDFT1	16	42
Cc1c(F)ncnc1NCc1cccc(OCC(F)F)c1	ZINC000872438913	CG	On-Demand	Anodyne	CLK4	18	43
Cc1c(F)ncnc1NCc1cccc(OCC(F)F)c1	ZINC000872438913	CG	On-Demand	Anodyne	PDS	61	37
Cc1c(F)ncnc1NCC(=O)N1CCc2ccccc21	ZINC000872438921	CD	On-Demand	Anodyne	EIF2AK3	79	38
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000872438931	EF	On-Demand	Anodyne	TRPV1	19	50
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000872438931	EF	On-Demand	Anodyne	EPHX2	22	48
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000872438931	EF	On-Demand	Anodyne	LIMK2	50	59
CCN1CCC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438932	DD	On-Demand	Mild	CCR8	51	35
CCN1CCC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872438933	DD	On-Demand	Mild	CCR8	51	35
CN1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872438951	DC	On-Demand	Anodyne	CTSC	16	44
Cc1ccc(S(=O)(=O)N2CCN(Cc3cscn3)CC2)c(C#N)c1	ZINC000872438952	FD	On-Demand	Mild	TRPV4	43	35
CC(=O)Nc1cccc2c1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C2	ZINC000872438992	GE	On-Demand	Anodyne	AKR1C3	53	39
CC(=O)Nc1cccc2c1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C2	ZINC000872438993	GE	On-Demand	Anodyne	AKR1C3	53	39
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	HTR1A	70	45
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	DRD2	61	57
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	DRD1	16	42
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	DRD4	41	42
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	HTR2A	44	57
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	HTR2C	22	41
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	SLC6A4	17	57
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	ADRA1A	22	41
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	HRH1	20	42
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	ADRA1B	19	40
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	DRD3	58	42
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	SLC6A3	20	41
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	HTR7	64	48
Oc1nnc(Cl)cc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872438995	EF	On-Demand	Anodyne	SIGMAR1	45	57
CCC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872439021	ED	On-Demand	Mild	TRPV4	44	36
Oc1cccc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872439029	DF	On-Demand	Anodyne	DRD2	23	47
Oc1cccc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872439029	DF	On-Demand	Anodyne	DRD4	28	45
Oc1cccc(CN2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872439029	DF	On-Demand	Anodyne	DRD3	18	47
COC(=O)[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872439038	GD	On-Demand	Anodyne	PKM	33	42
O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439042	FF	On-Demand	Anodyne	ADRA1D	31	41
O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439042	FF	On-Demand	Anodyne	ADRA1A	22	41
O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439042	FF	On-Demand	Anodyne	ADRA1B	24	41
O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439042	FF	On-Demand	Anodyne	SFRP1	122	39
O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439042	FF	On-Demand	Anodyne	WNT3	79	35
Cc1c(F)ncnc1NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000872439043	DF	On-Demand	Anodyne	GPR119	62	46
Cc1c(F)ncnc1NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000872439044	DF	On-Demand	Anodyne	GPR119	62	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCOC3)cc2N1	ZINC000872439052	FE	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCOC3)cc2N1	ZINC000872439053	FE	On-Demand	Anodyne	PKM	26	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccsc3)CC2)c(C#N)c1	ZINC000872439065	GE	On-Demand	Mild	TRPV4	41	34
CNC(=O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872439068	DD	On-Demand	Anodyne	TBXA2R	53	39
CCOC(=O)CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872439073	EE	On-Demand	Anodyne	P2RY12	42	37
Oc1cccc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872439088	DF	On-Demand	Anodyne	HTR1A	28	43
Oc1cccc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872439088	DF	On-Demand	Anodyne	DRD2	26	49
Oc1cccc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872439088	DF	On-Demand	Anodyne	DRD4	41	44
Oc1cccc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872439088	DF	On-Demand	Anodyne	DRD3	20	49
Oc1cccc(CN2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872439088	DF	On-Demand	Anodyne	HTR7	20	43
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000872439108	DD	On-Demand	Anodyne	HPGD	41	35
CCOC(=O)C1CCN(C(=O)CN(C)c2ccnc3ncccc23)CC1	ZINC000872439135	FD	On-Demand	Anodyne	PTR1	46	36
COC(=O)[C@H]1CCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872439159	DD	On-Demand	Mild	EPHX2	28	40
O=C(Nc1cccc(CNS(=O)(=O)CC2CC3(CCC3)C2)c1)c1ccncc1	ZINC000872439168	GG	On-Demand	Anodyne	KCNK3	58	44
CC(=O)Nc1cccc2c1CCN(S(=O)(=O)c1c(C)cccc1C#N)C2	ZINC000872439171	FF	On-Demand	Mild	AKR1C3	58	40
Cn1ncc2c(NCCCNc3ccccc3)nc(Cl)nc21	ZINC000872439176	DF	On-Demand	Anodyne	ABL1	31	42
COC(=O)CN(Cc1ccccc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872439178	GD	On-Demand	Anodyne	MMP8	18	41
COC(=O)CN(Cc1ccccc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872439178	GD	On-Demand	Anodyne	MMP9	15	41
COC(=O)CN(Cc1ccccc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872439179	GD	On-Demand	Anodyne	MMP8	18	41
COC(=O)CN(Cc1ccccc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872439179	GD	On-Demand	Anodyne	MMP9	15	41
Cc1c(F)ncnc1N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872439191	FG	On-Demand	Anodyne	GRM5	15	57
Cc1c(F)ncnc1N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872439192	FG	On-Demand	Anodyne	GRM5	15	57
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872439195	GF	On-Demand	Anodyne	CASP3	44	36
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872439195	GF	On-Demand	Anodyne	CHRNA10	28	41
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872439195	GF	On-Demand	Anodyne	CASP7	57	36
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872439197	GF	On-Demand	Anodyne	CASP3	44	36
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872439197	GF	On-Demand	Anodyne	CHRNA10	28	41
COc1cccc(C[C@@H]2CCCN2S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872439197	GF	On-Demand	Anodyne	CASP7	57	36
CC(=O)Nc1cccc2c1CCN(S(=O)(=O)c1ccc(C)cc1C#N)C2	ZINC000872439213	FF	On-Demand	Mild	AKR1C3	64	44
CN1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872439216	FD	On-Demand	Anodyne	PKM	38	47
COc1ccc(OC)c2sc(NC3CCC(NC(C)=O)CC3)nc12	ZINC000872439221	EG	On-Demand	Anodyne	ADORA2B	18	41
Oc1cccc(CN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872439228	DD	On-Demand	Anodyne	HTR1A	19	43
Oc1cccc(CN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872439228	DD	On-Demand	Anodyne	DRD2	28	53
Oc1cccc(CN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872439228	DD	On-Demand	Anodyne	DRD4	50	42
Oc1cccc(CN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872439228	DD	On-Demand	Anodyne	DRD3	22	53
Oc1cccc(CN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872439228	DD	On-Demand	Anodyne	SIGMAR1	15	43
Cc1cccc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872439261	GF	On-Demand	Anodyne	PKM	39	48
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(C)(C)C)CC1	ZINC000872439263	EE	On-Demand	Mild	CCR8	75	35
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(C)(C)C)CC1	ZINC000872439263	EE	On-Demand	Mild	SFRP1	40	37
C[C@@H](Nc1ccnc2ncccc12)C(=O)N1CCCC[C@H]1C	ZINC000872439281	CF	On-Demand	Anodyne	PREP	18	42
C[C@H]1CCCCN1C(=O)[C@@H](C)Nc1ccnc2ncccc12	ZINC000872439283	CF	On-Demand	Anodyne	PREP	18	42
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000872439294	GF	On-Demand	Anodyne	PDGFRB	23	43
Cn1ncc2c(N3CCC(C(=O)Nc4ccc(F)cc4)CC3)nc(Cl)nc21	ZINC000872439310	GG	On-Demand	Anodyne	PIK3CA	23	43
Cn1ncc2c(N3CCC(C(=O)Nc4ccc(F)cc4)CC3)nc(Cl)nc21	ZINC000872439310	GG	On-Demand	Anodyne	MTOR	69	35
O=S(=O)(NC1CCN(Cc2ccncc2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439326	GG	On-Demand	Anodyne	HTR7	15	43
O=S(=O)(NC1CCN(Cc2ccncc2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439326	GG	On-Demand	Anodyne	SIGMAR1	19	41
O=S(=O)(NC1CCN(Cc2ccncc2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439326	GG	On-Demand	Anodyne	SSTR5	42	35
O=S(=O)(NC1CCN(Cc2ccncc2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872439326	GG	On-Demand	Anodyne	SFRP1	58	36
CN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872439331	CF	On-Demand	Anodyne	GRIN2B	19	41
CN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872439331	CF	On-Demand	Anodyne	HRH4	18	50
CN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872439331	CF	On-Demand	Anodyne	VCP	64	39
CN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872439331	CF	On-Demand	Anodyne	PKNB	34	54
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1	ZINC000872439332	GF	On-Demand	Mild	EPHX2	28	41
Cc1ccc(S(=O)(=O)N2CCN(CC3CC3)CC2)c(C#N)c1	ZINC000872439343	DD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CCN(CC3CC3)CC2)c(C#N)c1	ZINC000872439343	DD	On-Demand	Mild	TRPV4	44	36
Cc1c(F)ncnc1N1CCC(CNC(=O)c2cnn(C)c2)CC1	ZINC000872439374	ED	On-Demand	Anodyne	CACNA1I	66	37
Cc1c(F)ncnc1N1CCC(CNC(=O)c2cnn(C)c2)CC1	ZINC000872439374	ED	On-Demand	Anodyne	SIRT3	64	34
Cc1c(F)ncnc1N1CCC(CNC(=O)c2cnn(C)c2)CC1	ZINC000872439374	ED	On-Demand	Anodyne	SIRT2	60	34
Cc1c(F)ncnc1N1CCC(CNC(=O)c2cnn(C)c2)CC1	ZINC000872439374	ED	On-Demand	Anodyne	SIRT1	53	34
CC(C)(C)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872439376	GE	On-Demand	Anodyne	CCR8	61	32
CC(C)(C)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872439376	GE	On-Demand	Anodyne	SFRP1	86	32
CC(C)(C)OC(=O)NC[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439389	EE	On-Demand	Anodyne	ACACB	16	49
CC(C)(C)OC(=O)NC[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439389	EE	On-Demand	Anodyne	CACNA1I	63	38
CC(C)(C)OC(=O)NC[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439389	EE	On-Demand	Anodyne	SIRT3	63	46
CC(C)(C)OC(=O)NC[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439389	EE	On-Demand	Anodyne	SIRT2	57	46
CC(C)(C)OC(=O)NC[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439389	EE	On-Demand	Anodyne	SIRT1	57	46
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439390	EE	On-Demand	Anodyne	ACACB	16	49
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439390	EE	On-Demand	Anodyne	CACNA1I	63	38
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439390	EE	On-Demand	Anodyne	SIRT3	63	46
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439390	EE	On-Demand	Anodyne	SIRT2	57	46
CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439390	EE	On-Demand	Anodyne	SIRT1	57	46
O=C(CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCCC1	ZINC000872439411	GF	On-Demand	Anodyne	LEF	25	41
Cn1ncc2c(N3CCC(c4n[nH]c(-c5ccccc5)n4)CC3)nc(Cl)nc21	ZINC000872439430	GG	On-Demand	Anodyne	AKT2	46	39
O=C(Nc1ccc(F)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872439432	FH	On-Demand	Anodyne	TRPV1	18	52
O=C(Nc1ccc(F)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872439432	FH	On-Demand	Anodyne	EPHX2	15	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ccccn1	ZINC000872439436	FH	On-Demand	Anodyne	CASP3	59	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ccccn1	ZINC000872439436	FH	On-Demand	Anodyne	CASP7	63	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ccccn1	ZINC000872439437	FH	On-Demand	Anodyne	CASP3	59	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ccccn1	ZINC000872439437	FH	On-Demand	Anodyne	CASP7	63	35
O=S(=O)(CC1CC2(CCC2)C1)NCc1ccccc1N1CCCC1	ZINC000872439444	EG	On-Demand	Anodyne	KCNQ2	42	36
CCOC(=O)[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872439451	ED	On-Demand	Anodyne	LEF	46	52
COc1ccc(N2CCC(Nc3nc(N)nc(C(F)F)n3)CC2)cc1	ZINC000872439484	FE	On-Demand	Clean	HRH4	46	37
CN(Cc1ccoc1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872439493	FG	On-Demand	Anodyne	PKM	27	41
O=C(Nc1ccccc1)NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872439503	GG	On-Demand	Anodyne	EPHX2	51	50
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439504	EG	On-Demand	Anodyne	CCR3	30	41
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439504	EG	On-Demand	Anodyne	EPHX2	42	41
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439504	EG	On-Demand	Anodyne	TRPM8	18	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439505	EG	On-Demand	Anodyne	CCR3	30	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439505	EG	On-Demand	Anodyne	EPHX2	42	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872439505	EG	On-Demand	Anodyne	TRPM8	18	42
O=S(=O)(NC1CCN(CC2CC2)CC1)c1cccc(Br)n1	ZINC000872439512	FD	On-Demand	Anodyne	CCR8	42	33
O=S(=O)(NC1CCN(CC2CC2)CC1)c1cccc(Br)n1	ZINC000872439512	FD	On-Demand	Anodyne	SFRP1	44	34
COc1ccnc(N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)n1	ZINC000872439521	FD	On-Demand	Mild	TRPV4	42	34
Cc1c(F)ncnc1N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439531	DE	On-Demand	Anodyne	ACACB	16	46
Cc1c(F)ncnc1N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439531	DE	On-Demand	Anodyne	CACNA1I	42	32
Cc1c(F)ncnc1N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439531	DE	On-Demand	Anodyne	SIRT3	72	47
Cc1c(F)ncnc1N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439531	DE	On-Demand	Anodyne	SIRT2	62	47
Cc1c(F)ncnc1N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439531	DE	On-Demand	Anodyne	SIRT1	58	47
Cc1c(F)ncnc1N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439532	DE	On-Demand	Anodyne	ACACB	16	46
Cc1c(F)ncnc1N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439532	DE	On-Demand	Anodyne	CACNA1I	42	32
Cc1c(F)ncnc1N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439532	DE	On-Demand	Anodyne	SIRT3	72	47
Cc1c(F)ncnc1N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439532	DE	On-Demand	Anodyne	SIRT2	62	47
Cc1c(F)ncnc1N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872439532	DE	On-Demand	Anodyne	SIRT1	58	47
CN(CC1CC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872439539	EF	On-Demand	Anodyne	PKM	30	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC2CC2)CC1	ZINC000872439541	EE	On-Demand	Anodyne	CCR3	17	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC2CC2)CC1	ZINC000872439541	EE	On-Demand	Anodyne	PKM	48	40
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CC2CC2)CC1	ZINC000872439548	EE	On-Demand	Mild	CCR8	80	36
O=S(=O)(c1cccc(CNc2cc(Cl)nnc2O)c1)N1CCCCC1	ZINC000872439556	GF	On-Demand	Anodyne	NAMPT	23	42
CCOCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872439557	FF	On-Demand	Anodyne	PKM	38	48
Oc1nnc(Cl)cc1N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872439576	GG	On-Demand	Anodyne	GRM5	22	51
Oc1nnc(Cl)cc1N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872439576	GG	On-Demand	Anodyne	ETHR	34	46
Oc1nnc(Cl)cc1N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872439577	GG	On-Demand	Anodyne	GRM5	22	51
Oc1nnc(Cl)cc1N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000872439577	GG	On-Demand	Anodyne	ETHR	34	46
CCC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439583	FE	On-Demand	Anodyne	PKM	46	41
CCC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439583	FE	On-Demand	Anodyne	F13A1	47	35
CCC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439583	FE	On-Demand	Anodyne	NOD2	18	45
COC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439603	ED	On-Demand	Anodyne	EPHX2	30	42
Cc1cc(N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c2cnn(C)c2n1	ZINC000872439610	EF	On-Demand	Anodyne	ACACB	17	49
Cc1cc(N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c2cnn(C)c2n1	ZINC000872439610	EF	On-Demand	Anodyne	CACNA1I	41	32
Cn1cc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cn1	ZINC000872439615	FD	On-Demand	Anodyne	PKM	35	44
N#CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872439616	CD	On-Demand	Mild	DRD4	16	40
CC(=O)N1CCN(c2ccccc2CNc2ncnc(F)c2C)CC1	ZINC000872439619	EE	On-Demand	Anodyne	KCNQ2	41	33
Oc1nnc(Cl)cc1N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872439621	GG	On-Demand	Anodyne	GRM5	18	56
Oc1nnc(Cl)cc1N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000872439623	GG	On-Demand	Anodyne	GRM5	18	56
O=C(CCNc1cc(-c2ccccc2)ncn1)N1CCN(c2ncccn2)CC1	ZINC000872439639	GE	On-Demand	Anodyne	P2RX3	16	41
CC(=O)Nc1cccc2c1CCN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872439654	GG	On-Demand	Anodyne	AKR1C3	74	48
O=C(Nc1ccc(F)cc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872439660	FF	On-Demand	Anodyne	EPHX2	15	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	HTR1A	38	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	DRD2	39	52
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	DRD4	29	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	HTR2A	26	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	DRD3	21	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	SLC6A3	20	41
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	HTR7	24	45
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	HRH3	15	41
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	SIGMAR1	40	52
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	ABCC1	93	44
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	ABCB1A	47	37
Cc1c(F)ncnc1N1CCCN(CCCc2ccccc2)CC1	ZINC000872439668	EG	On-Demand	Anodyne	RPS6KB1	43	36
Cc1c(F)ncnc1NCC(=O)N1CCc2ccccc2C1	ZINC000872439695	DD	On-Demand	Anodyne	DPP8	31	51
Cc1c(F)ncnc1NCC(=O)N1CCc2ccccc2C1	ZINC000872439695	DD	On-Demand	Anodyne	NOD2	40	36
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(O)c1	ZINC000872439696	DD	On-Demand	Anodyne	DRD4	41	33
O=C(CCNc1ccnc2ncccc12)N1CCN(c2ncccn2)CC1	ZINC000872439702	FD	On-Demand	Anodyne	HNMT	49	36
CCOC(=O)C1CCN(C(=O)CN(C)c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872439704	GF	On-Demand	Anodyne	FDFT1	23	42
Cc1noc(C2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872439705	GG	On-Demand	Anodyne	PKM	46	39
O=C(CNc1cc(Cl)nnc1O)N1CCc2ccccc2C1	ZINC000872439708	DD	On-Demand	Anodyne	DPP8	27	48
O=C(c1cccc(O)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872439711	ED	On-Demand	Anodyne	NPY2R	29	40
CC(C)(C)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439712	FG	On-Demand	Anodyne	ADRA1D	33	43
CC(C)(C)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439712	FG	On-Demand	Anodyne	ADRA1A	23	43
CC(C)(C)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439712	FG	On-Demand	Anodyne	ADRA1B	26	43
CC(C)(C)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439712	FG	On-Demand	Anodyne	SFRP1	130	37
CC(C)(C)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872439712	FG	On-Demand	Anodyne	WNT3	86	37
CCC(=O)c1c(Cl)cccc1N[C@@H]1CC(=O)N(C)C1	ZINC000872439731	CF	On-Demand	Anodyne	P2RX7	15	41
CCC(=O)c1c(Cl)cccc1N[C@H]1CC(=O)N(C)C1	ZINC000872439732	CF	On-Demand	Anodyne	P2RX7	15	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3COCCO3)cc2N1	ZINC000872439737	FD	On-Demand	Anodyne	PKM	34	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3COCCO3)cc2N1	ZINC000872439738	FD	On-Demand	Anodyne	PKM	34	44
CCOC(=O)C1CCN(C(=O)CN(C)c2nc(Cl)nc3sccc23)CC1	ZINC000872439756	GF	On-Demand	Anodyne	PTR1	46	36
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)c2cc(Cl)nnc2O)C1	ZINC000872439771	FD	On-Demand	Anodyne	FDFT1	23	41
COC(=O)N1CCC[C@@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872439783	DD	On-Demand	Anodyne	Q4VQ11_PIG	46	34
COC(=O)N1CCC[C@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872439784	DD	On-Demand	Anodyne	Q4VQ11_PIG	46	34
Nc1nc(NCc2cccc(OCC(F)F)c2)nc(C(F)F)n1	ZINC000872439801	EF	On-Demand	Anodyne	PDS	52	34
N#Cc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)nc1	ZINC000872439826	GF	On-Demand	Mild	PKM	35	42
N#Cc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)nc1	ZINC000872439826	GF	On-Demand	Mild	GCK	59	36
N#Cc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)nc1	ZINC000872439826	GF	On-Demand	Mild	GCKR	51	33
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000872439841	GH	On-Demand	Anodyne	EPHX2	20	48
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000872439841	GH	On-Demand	Anodyne	LIMK2	32	50
CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872439845	DD	On-Demand	Anodyne	MMP12	64	35
CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872439845	DD	On-Demand	Anodyne	LEF	45	59
Cc1c(F)ncnc1N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439846	EE	On-Demand	Anodyne	CCR3	46	41
Cc1c(F)ncnc1N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439846	EE	On-Demand	Anodyne	EPHX2	46	39
Cc1c(F)ncnc1N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439846	EE	On-Demand	Anodyne	LIMK2	41	39
Cc1c(F)ncnc1N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439847	EE	On-Demand	Anodyne	CCR3	46	41
Cc1c(F)ncnc1N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439847	EE	On-Demand	Anodyne	EPHX2	46	39
Cc1c(F)ncnc1N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000872439847	EE	On-Demand	Anodyne	LIMK2	41	39
Nc1nc(C(F)F)nc(N2CCC(C(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000872439858	FE	On-Demand	Anodyne	MTOR	18	42
Cn1ncc2c(N3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439883	GF	On-Demand	Anodyne	PIK3CA	25	47
Cn1ncc2c(N3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439883	GF	On-Demand	Anodyne	MTOR	78	40
Cn1ncc2c(N3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439883	GF	On-Demand	Anodyne	EPHX2	43	39
Cn1ncc2c(N3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439884	GF	On-Demand	Anodyne	PIK3CA	25	47
Cn1ncc2c(N3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439884	GF	On-Demand	Anodyne	MTOR	78	40
Cn1ncc2c(N3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872439884	GF	On-Demand	Anodyne	EPHX2	43	39
Cc1cc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c2cnn(C)c2n1	ZINC000872439886	FF	On-Demand	Anodyne	CCR3	60	32
Cc1cc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c2cnn(C)c2n1	ZINC000872439886	FF	On-Demand	Anodyne	PIK3CA	15	41
Cc1cc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c2cnn(C)c2n1	ZINC000872439886	FF	On-Demand	Anodyne	MTOR	47	36
CCOC(=O)C1CCN(C(=O)CN(C)c2ccncc2C2CC2)CC1	ZINC000872439888	EE	On-Demand	Anodyne	PTR1	44	34
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439889	FE	On-Demand	Anodyne	CCR3	40	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439889	FE	On-Demand	Anodyne	EPHX2	48	45
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439890	FE	On-Demand	Anodyne	CCR3	40	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(c2cc(Cl)nnc2O)C1	ZINC000872439890	FE	On-Demand	Anodyne	EPHX2	48	45
Cn1ncc2c(NCC(=O)N3CCc4ccccc4C3)nc(Cl)nc21	ZINC000872439899	FE	On-Demand	Anodyne	DPP8	17	43
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439915	DE	On-Demand	Anodyne	ADRA1D	23	40
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439915	DE	On-Demand	Anodyne	ADRA1A	16	40
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439915	DE	On-Demand	Anodyne	ADRA1B	18	40
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439915	DE	On-Demand	Anodyne	SFRP1	63	33
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439915	DE	On-Demand	Anodyne	WNT3	45	32
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C)C1	ZINC000872439918	CC	On-Demand	Mild	CTSC	16	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C)C1	ZINC000872439918	CC	On-Demand	Mild	CCR8	52	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C)C1	ZINC000872439919	CC	On-Demand	Mild	CTSC	16	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C)C1	ZINC000872439919	CC	On-Demand	Mild	CCR8	52	33
COc1ccc(N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872439921	DG	On-Demand	Clean	CCR4	16	40
COc1ccc(N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872439921	DG	On-Demand	Clean	GRM1	15	44
COc1ccc(N2CCC(Nc3ncnc(F)c3C)CC2)cc1	ZINC000872439921	DG	On-Demand	Clean	EHMT2	40	35
Oc1nnc(Cl)cc1N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000872439922	GH	On-Demand	Anodyne	GRM5	18	49
Oc1nnc(Cl)cc1N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000872439923	GH	On-Demand	Anodyne	GRM5	18	49
CCN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439927	EF	On-Demand	Anodyne	HTR7	15	51
CCN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439927	EF	On-Demand	Anodyne	SFRP1	46	33
CCN1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439928	EF	On-Demand	Anodyne	HTR7	15	51
CCN1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872439928	EF	On-Demand	Anodyne	SFRP1	46	33
O=C(Nc1ccc(F)cc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872439960	EH	On-Demand	Anodyne	HTR1F	41	36
O=C(Nc1ccc(F)cc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872439960	EH	On-Demand	Anodyne	TRPM8	16	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(Cc2cscn2)CC1	ZINC000872439964	GF	On-Demand	Anodyne	SCN5A	43	37
O=S1(=O)CCCN1CCCNc1ccnc2ncccc12	ZINC000872439993	DD	On-Demand	Anodyne	HRP1_PLAFA	97	36
O=S1(=O)CCCN1CCCNc1ccnc2ncccc12	ZINC000872439993	DD	On-Demand	Anodyne	HNMT	77	47
CCOC(=O)C1CCN(C(=O)CN(C)c2cc(-c3ccccc3)ncn2)CC1	ZINC000872440002	GE	On-Demand	Anodyne	P2RY12	79	42
CCOC(=O)C1CCN(C(=O)CN(C)c2cc(-c3ccccc3)ncn2)CC1	ZINC000872440002	GE	On-Demand	Anodyne	FDFT1	16	41
Nc1nc(NCC(=O)N2CCc3ccccc3C2)nc(C(F)F)n1	ZINC000872440018	ED	On-Demand	Anodyne	DPP8	22	46
COc1ccc(N2CCC(Nc3nc(Cl)nc4c3cnn4C)CC2)cc1	ZINC000872440028	FG	On-Demand	Clean	EHMT2	75	40
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)c2ccncc2C2CC2)C1	ZINC000872440036	EE	On-Demand	Anodyne	FDFT1	19	42
O=C(CN=c1cc[nH]cc1C1CC1)N1CCc2ccccc2C1	ZINC000872440059	DE	On-Demand	Anodyne	DPP8	15	41
CCC(=O)c1c(Cl)cccc1N1CCC[C@@H](C2OCCO2)C1	ZINC000872440060	DH	On-Demand	Anodyne	KCNQ2	43	34
CCC(=O)c1c(Cl)cccc1N1CCC[C@H](C2OCCO2)C1	ZINC000872440061	DH	On-Demand	Anodyne	KCNQ2	43	34
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(C)s3)CC2)c(C#N)c1	ZINC000872440081	GE	On-Demand	Mild	TRPV4	41	34
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	HTR1A	22	47
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	DRD2	18	49
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	DRD4	17	43
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	HTR2A	18	49
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	DRD3	15	41
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	SLC6A3	20	40
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	HTR7	20	45
Nc1nc(C(F)F)nc(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000872440093	FF	On-Demand	Anodyne	SIGMAR1	35	51
CCCN(CC(=O)NC)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872440112	ED	On-Demand	Anodyne	MMP8	23	40
CN1CCC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872440132	FD	On-Demand	Anodyne	PKM	37	46
Nc1nc(C(F)F)nc(N2CCc3ccc(O)cc3CC2)n1	ZINC000872440148	DD	On-Demand	Anodyne	DRD5	18	40
C[C@@H](CNc1nc(N)nc(C(F)F)n1)N1CCN(C)CC1	ZINC000872440162	DC	On-Demand	Anodyne	HRH4	23	43
COc1ccc2c(c1)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872440177	EF	On-Demand	Mild	DRD5	17	40
COc1ccc2c(c1)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872440177	EF	On-Demand	Mild	TRPV4	49	40
COc1ccc2c(c1)CN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872440177	EF	On-Demand	Mild	AKR1C3	49	53
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc(C)oc3C)CC2)c(C#N)c1	ZINC000872440185	GE	On-Demand	Mild	TRPV4	43	35
COC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440193	ED	On-Demand	Mild	EPHX2	15	43
COC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440193	ED	On-Demand	Mild	CTSC	16	40
COC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440193	ED	On-Demand	Mild	CCR8	113	48
COC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440193	ED	On-Demand	Mild	SFRP1	126	39
COC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440193	ED	On-Demand	Mild	WNT3	84	37
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872440205	EF	On-Demand	Anodyne	PRCP	18	51
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872440205	EF	On-Demand	Anodyne	GRM5	15	46
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872440205	EF	On-Demand	Anodyne	SMO	40	40
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000872440205	EF	On-Demand	Anodyne	ETHR	49	36
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440206	FE	On-Demand	Anodyne	HTR4	42	36
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440206	FE	On-Demand	Anodyne	EPHX2	29	40
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440206	FE	On-Demand	Anodyne	TGM2	40	38
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440206	FE	On-Demand	Anodyne	CACNA1I	66	38
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	ADRA1D	35	43
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	ADRA1A	25	43
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	ADRA1B	28	43
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	CCR8	92	39
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	SFRP1	135	42
COC(=O)N1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440241	FE	On-Demand	Anodyne	WNT3	92	39
CCN(Cc1ccccc1)C(=O)CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872440268	GD	On-Demand	Anodyne	LIMK2	19	41
CCN(Cc1ccccc1)C(=O)CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872440269	GD	On-Demand	Anodyne	LIMK2	19	41
CN(C)C(=O)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872440274	GD	On-Demand	Anodyne	PKM	37	46
CCC[C@@H](Nc1cc(Cl)nnc1O)c1cccc(C(F)(F)F)c1	ZINC000872440307	EJ	On-Demand	Anodyne	PDS	41	34
Cc1cccc(C#N)c1S(=O)(=O)NC[C@H]1CCCN1C	ZINC000872440310	CD	On-Demand	Mild	CHRNA10	66	44
Cc1cccc(C#N)c1S(=O)(=O)NC[C@@H]1CCCN1C	ZINC000872440311	CD	On-Demand	Mild	CHRNA10	66	44
C[C@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccc(F)cc1	ZINC000872440312	FF	On-Demand	Anodyne	GRIA4	20	47
C[C@@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccc(F)cc1	ZINC000872440313	FF	On-Demand	Anodyne	GRIA4	20	47
C[C@@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccc(F)cc1	ZINC000872440314	FF	On-Demand	Anodyne	GRIA4	20	47
C[C@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccc(F)cc1	ZINC000872440315	FF	On-Demand	Anodyne	GRIA4	20	47
Cc1cc(N2CCc3ccc(O)cc3CC2)c2cnn(C)c2n1	ZINC000872440349	DF	On-Demand	Anodyne	DRD5	23	42
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440358	ED	On-Demand	Mild	EPHX2	35	55
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440358	ED	On-Demand	Mild	TRPV4	49	40
CC(=O)NCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440358	ED	On-Demand	Mild	CACNA1I	57	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872440371	GF	On-Demand	Mild	CACNA1I	48	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872440372	GF	On-Demand	Mild	CACNA1I	48	32
c1ccc(-c2noc(C3CCN(c4ccncc4C4CC4)CC3)n2)nc1	ZINC000872440380	EH	On-Demand	Anodyne	PRCP	19	48
c1ccc(-c2noc(C3CCN(c4ccncc4C4CC4)CC3)n2)nc1	ZINC000872440380	EH	On-Demand	Anodyne	ETHR	41	34
CCN(CC)C(=O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872440384	GD	On-Demand	Anodyne	PKM	38	45
CC(C)c1nnc(NC2CCN(C(=O)CC(F)(F)F)CC2)o1	ZINC000872440413	DF	On-Demand	Anodyne	EPHX2	17	43
O=C(CC(F)(F)F)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872440414	FG	On-Demand	Anodyne	PRKD1	46	36
O=C(CC(F)(F)F)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872440414	FG	On-Demand	Anodyne	SFRP1	70	35
O=C(CC(F)(F)F)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872440414	FG	On-Demand	Anodyne	WNT3	42	35
O=C(CC(F)(F)F)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872440414	FG	On-Demand	Anodyne	HPGDS	34	44
CC(=O)N(C)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440415	FE	On-Demand	Anodyne	PKM	42	38
C#CCCN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440417	DD	On-Demand	Mild	TRPV4	46	38
COc1ccc2c(c1)CN(S(=O)(=O)c1cccc(Br)n1)CC2	ZINC000872440419	GF	On-Demand	Anodyne	DRD5	18	42
COc1ccc2c(c1)CN(S(=O)(=O)c1cccc(Br)n1)CC2	ZINC000872440419	GF	On-Demand	Anodyne	AKR1C3	63	58
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(c2nccs2)CC1	ZINC000872440422	GG	On-Demand	Anodyne	GCK	41	35
CCOC(=O)N(C)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872440430	CD	On-Demand	Anodyne	SIRT3	50	34
CN(C[C@@H]1CCCO1)c1cc(-c2ccccc2)ncn1	ZINC000872440436	CF	On-Demand	Anodyne	TNK2	58	39
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000872440446	EE	On-Demand	Anodyne	HCRTR1	15	41
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000872440446	EE	On-Demand	Anodyne	P2RX7	16	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000872440446	EE	On-Demand	Anodyne	AKT1	28	42
NC(=O)[C@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440454	EE	On-Demand	Anodyne	SLC6A1	161	42
NC(=O)[C@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440454	EE	On-Demand	Anodyne	CHRNA7	22	42
NC(=O)[C@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440454	EE	On-Demand	Anodyne	HNMT	49	35
NC(=O)[C@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440454	EE	On-Demand	Anodyne	VCP	59	39
NC(=O)[C@@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440455	EE	On-Demand	Anodyne	SLC6A1	161	42
NC(=O)[C@@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440455	EE	On-Demand	Anodyne	CHRNA7	22	42
NC(=O)[C@@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440455	EE	On-Demand	Anodyne	HNMT	49	35
NC(=O)[C@@H]1CCCN(CCCNc2cc(-c3ccccc3)ncn2)C1	ZINC000872440455	EE	On-Demand	Anodyne	VCP	59	39
COc1ccc2c(c1)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872440464	EF	On-Demand	Mild	DRD5	21	42
COc1ccc2c(c1)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872440464	EF	On-Demand	Mild	TRPV4	40	32
COc1ccc2c(c1)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872440464	EF	On-Demand	Mild	AKR1C3	63	57
Cn1ncc2c(N3CCN(C(=O)c4ccc(F)cc4F)CC3)nc(Cl)nc21	ZINC000872440465	GE	On-Demand	Anodyne	P2RX7	21	41
COC[C@@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872440490	FE	On-Demand	Anodyne	PKM	40	48
COC[C@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872440491	FE	On-Demand	Anodyne	PKM	40	48
O=C(CC(F)(F)F)N1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872440506	GI	On-Demand	Anodyne	PRKD1	44	36
Nc1nc(C(F)F)nc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)n1	ZINC000872440515	FD	On-Demand	Anodyne	P2RX7	15	44
Cc1c(F)ncnc1NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872440523	DE	On-Demand	Anodyne	EPHX2	15	47
Cn1ncc2c(N3CCc4ccc(O)cc4CC3)nc(Cl)nc21	ZINC000872440545	EE	On-Demand	Anodyne	DRD5	36	42
O=S(=O)(N[C@@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440547	EE	On-Demand	Anodyne	ADRA1D	38	49
O=S(=O)(N[C@@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440547	EE	On-Demand	Anodyne	ADRA1A	27	49
O=S(=O)(N[C@@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440547	EE	On-Demand	Anodyne	ADRA1B	30	49
O=S(=O)(N[C@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440548	EE	On-Demand	Anodyne	ADRA1D	38	49
O=S(=O)(N[C@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440548	EE	On-Demand	Anodyne	ADRA1A	27	49
O=S(=O)(N[C@H]1CCN(C2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872440548	EE	On-Demand	Anodyne	ADRA1B	30	49
C[C@@H](CNc1cc(-c2ccccc2)ncn1)N1CCN(C)CC1	ZINC000872440553	DE	On-Demand	Anodyne	HRH4	20	51
O=C(CC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)NC1CCCC1	ZINC000872440555	GG	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)N(C)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872440561	EG	On-Demand	Anodyne	P2RY12	86	36
C#CCCN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872440570	EE	On-Demand	Mild	PKM	44	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccoc3)cc2N1	ZINC000872440592	FF	On-Demand	Anodyne	PKM	37	45
CC(=O)NCC1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872440593	GD	On-Demand	Anodyne	HTR4	44	42
CC(=O)NCC1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872440593	GD	On-Demand	Anodyne	CACNA1I	49	35
CC(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440603	ED	On-Demand	Mild	EPHX2	28	46
CC(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872440603	ED	On-Demand	Mild	TRPV4	43	35
COC(=O)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872440607	ED	On-Demand	Anodyne	CCR8	45	36
CC(=O)NCC1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440626	ED	On-Demand	Mild	EPHX2	27	45
CC(=O)NCC1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440626	ED	On-Demand	Mild	CACNA1I	51	33
CN(C)C(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872440627	ED	On-Demand	Anodyne	TBXA2R	44	35
CN(C)C(=O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872440627	ED	On-Demand	Anodyne	LEF	32	41
Cn1ncc2c(N3CCC(c4nc(-c5ccccn5)no4)CC3)nc(Cl)nc21	ZINC000872440638	GF	On-Demand	Anodyne	PRCP	18	46
CCO[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872440642	DE	On-Demand	Mild	TRPV4	42	35
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	F2	28	41
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	OPRM1	26	44
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	MME	48	40
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	FCER2	50	34
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	TRY2_BOVIN	72	33
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	CPA1	22	49
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	NPFFR2	59	39
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	CAPN1	40	37
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	CAPN2	45	34
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	ST14	41	33
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	NPFFR1	65	39
NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440655	ED	On-Demand	Anodyne	TMPRSS11D	70	37
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	F2	28	41
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	OPRM1	26	44
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	MME	48	40
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	FCER2	50	34
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	TRY2_BOVIN	72	33
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	CPA1	22	49
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	NPFFR2	59	39
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	CAPN1	40	37
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	CAPN2	45	34
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	ST14	41	33
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	NPFFR1	65	39
NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872440656	ED	On-Demand	Anodyne	TMPRSS11D	70	37
COC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872440673	GD	On-Demand	Anodyne	CCR8	104	43
COC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872440673	GD	On-Demand	Anodyne	SFRP1	117	38
COC(=O)N1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872440673	GD	On-Demand	Anodyne	WNT3	79	34
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872440680	GD	On-Demand	Anodyne	P2RX7	19	42
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872440680	GD	On-Demand	Anodyne	SCD1	20	42
NC(=O)c1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)nc(Cl)n1	ZINC000872440680	GD	On-Demand	Anodyne	SCD	18	42
COc1ccc2c(c1)CN(S(=O)(=O)CC1CC3(CCC3)C1)CC2	ZINC000872440681	EF	On-Demand	Anodyne	AKR1C3	20	46
CN(CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C1CC1	ZINC000872440688	FD	On-Demand	Anodyne	PKM	41	49
CC(=O)NCC1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC1	ZINC000872440693	FC	On-Demand	Anodyne	CACNA1I	42	32
CC(=O)NCC1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC1	ZINC000872440694	FC	On-Demand	Anodyne	CACNA1I	42	32
C[C@@H](CNc1cc(-c2cccc(Cl)c2)ncn1)N1CCN(C)CC1	ZINC000872440697	EF	On-Demand	Anodyne	HRH4	20	42
C#CCN(CC)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872440717	EE	On-Demand	Mild	PKM	29	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCCO3)cc2N1	ZINC000872440726	FE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCCO3)cc2N1	ZINC000872440727	FE	On-Demand	Anodyne	PKM	36	44
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000872440733	DD	On-Demand	Mild	ADRA1D	25	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000872440733	DD	On-Demand	Mild	ADRA1A	18	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000872440733	DD	On-Demand	Mild	ADRA1B	20	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000872440733	DD	On-Demand	Mild	CCR8	43	31
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C2CC2)C1	ZINC000872440734	DD	On-Demand	Mild	ADRA1D	25	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C2CC2)C1	ZINC000872440734	DD	On-Demand	Mild	ADRA1A	18	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C2CC2)C1	ZINC000872440734	DD	On-Demand	Mild	ADRA1B	20	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C2CC2)C1	ZINC000872440734	DD	On-Demand	Mild	CCR8	43	31
COc1ccc2c(c1)CN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC2	ZINC000872440753	FE	On-Demand	Anodyne	DRD5	18	42
COc1ccc2c(c1)CN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC2	ZINC000872440753	FE	On-Demand	Anodyne	AKR1C3	35	52
COc1ccc2c(c1)CN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC2	ZINC000872440754	FE	On-Demand	Anodyne	DRD5	18	42
COc1ccc2c(c1)CN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC2	ZINC000872440754	FE	On-Demand	Anodyne	AKR1C3	35	52
O=C(c1ccc(F)cc1F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872440760	FE	On-Demand	Anodyne	P2RX7	23	45
O=C(CC(F)(F)F)N1CCC(Nc2nc(Cl)nc3sccc23)CC1	ZINC000872440771	GH	On-Demand	Anodyne	ETHR	54	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(CC(=O)NC2CCCC2)CC1	ZINC000872440772	GF	On-Demand	Mild	EPHX2	36	46
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872440778	GI	On-Demand	Anodyne	EPHX2	20	44
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872440778	GI	On-Demand	Anodyne	CCR8	43	36
c1ccc(-c2noc(C3CCN(c4ccnc5ncccc45)CC3)n2)nc1	ZINC000872440781	FG	On-Demand	Anodyne	METAP1	40	38
c1ccc(-c2noc(C3CCN(c4ccnc5ncccc45)CC3)n2)nc1	ZINC000872440781	FG	On-Demand	Anodyne	PRCP	17	45
c1ccc(-c2noc(C3CCN(c4ccnc5ncccc45)CC3)n2)nc1	ZINC000872440781	FG	On-Demand	Anodyne	SMO	37	40
c1ccc(-c2noc(C3CCN(c4ccnc5ncccc45)CC3)n2)nc1	ZINC000872440781	FG	On-Demand	Anodyne	ETHR	42	34
COC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440794	ED	On-Demand	Mild	CCR8	107	45
COC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440794	ED	On-Demand	Mild	SFRP1	97	36
COC(=O)N1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440794	ED	On-Demand	Mild	WNT3	64	33
CCC(=O)c1c(Cl)cccc1N1CCCNC(=O)C1	ZINC000872440797	CE	On-Demand	Anodyne	KCNQ2	54	35
CCC(=O)c1c(Cl)cccc1N1CCCNC(=O)C1	ZINC000872440797	CE	On-Demand	Anodyne	NOX1	50	31
CCC(=O)c1c(Cl)cccc1N1CCCNC(=O)C1	ZINC000872440797	CE	On-Demand	Anodyne	NOX5	47	31
Oc1ccc2c(c1)CCN(c1cc(Cl)nnc1O)CC2	ZINC000872440801	CE	On-Demand	Anodyne	DRD5	30	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCN(C4CC4)C3)cc2N1	ZINC000872440826	GE	On-Demand	Anodyne	PKM	28	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCN(C4CC4)C3)cc2N1	ZINC000872440827	GE	On-Demand	Anodyne	PKM	28	44
O=C(CC(F)(F)F)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872440834	EF	On-Demand	Anodyne	EPHX2	15	45
O=C(CC(F)(F)F)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872440834	EF	On-Demand	Anodyne	CCR8	51	38
O=C(CC(F)(F)F)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872440834	EF	On-Demand	Anodyne	SCD	20	42
c1cnc2nccc(NCc3cn4c(n3)CCCC4)c2c1	ZINC000872440836	CF	On-Demand	Anodyne	HNMT	59	39
C[C@H](CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872440847	DG	On-Demand	Anodyne	LEF	27	41
C[C@@H](CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872440848	DG	On-Demand	Anodyne	LEF	27	41
NC(=O)c1cc(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)nc(Cl)n1	ZINC000872440858	GD	On-Demand	Anodyne	SCD1	20	42
NC(=O)c1cc(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)nc(Cl)n1	ZINC000872440858	GD	On-Demand	Anodyne	SCD	17	40
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872440860	GE	On-Demand	Anodyne	PROKR1	60	33
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872440861	GE	On-Demand	Anodyne	PROKR1	60	33
c1cnc2nccc(N3CC[C@@H](N4CCCC4)C3)c2c1	ZINC000872440864	CE	On-Demand	Anodyne	HRH3	20	50
c1cnc2nccc(N3CC[C@@H](N4CCCC4)C3)c2c1	ZINC000872440864	CE	On-Demand	Anodyne	L3MBTL3	63	41
c1cnc2nccc(N3CC[C@H](N4CCCC4)C3)c2c1	ZINC000872440865	CE	On-Demand	Anodyne	HRH3	20	50
c1cnc2nccc(N3CC[C@H](N4CCCC4)C3)c2c1	ZINC000872440865	CE	On-Demand	Anodyne	L3MBTL3	63	41
c1cc(N2CCCN(Cc3cscn3)CC2)c(C2CC2)cn1	ZINC000872440869	DG	On-Demand	Anodyne	SCN5A	41	34
c1cc(N2CC[C@H](N3CCCC3)C2)c(C2CC2)cn1	ZINC000872440872	CF	On-Demand	Anodyne	L3MBTL3	62	41
c1cc(N2CC[C@@H](N3CCCC3)C2)c(C2CC2)cn1	ZINC000872440873	CF	On-Demand	Anodyne	L3MBTL3	62	41
CCOc1ccccc1CCNc1cc(C(N)=O)nc(Cl)n1	ZINC000872440878	DE	On-Demand	Anodyne	METG	47	33
COc1ccc(OC)c2sc(Nc3cnn(CC(=O)N(C)C)c3)nc12	ZINC000872440879	FE	On-Demand	Anodyne	PDGFRB	17	40
COc1ccc(OC)c2sc(Nc3cnn(CC(=O)N(C)C)c3)nc12	ZINC000872440879	FE	On-Demand	Anodyne	ADORA2B	15	41
COc1ccc(OC)c2sc(Nc3cnn(CC(=O)N(C)C)c3)nc12	ZINC000872440879	FE	On-Demand	Anodyne	ENPP1	49	29
Oc1nnc(Cl)cc1N1CCC[C@@H](c2ccccc2)CC1	ZINC000872440889	DH	On-Demand	Anodyne	SLC18A3	46	39
Oc1nnc(Cl)cc1N1CCC[C@H](c2ccccc2)CC1	ZINC000872440890	DH	On-Demand	Anodyne	SLC18A3	46	39
Cc1c(F)ncnc1N1CCC(C(=O)OC(C)(C)C)CC1	ZINC000872440895	CE	On-Demand	Anodyne	SIRT3	50	40
Cc1c(F)ncnc1N1CCC(C(=O)OC(C)(C)C)CC1	ZINC000872440895	CE	On-Demand	Anodyne	SIRT2	38	40
Cc1c(F)ncnc1N1CCC(C(=O)OC(C)(C)C)CC1	ZINC000872440895	CE	On-Demand	Anodyne	SIRT1	34	40
CNC(=O)CCN(C)c1cc(-c2ccccc2)ncn1	ZINC000872440901	CD	On-Demand	Anodyne	GSK3A	21	42
c1ccc(-c2cc(N3CCC[C@H](c4ncc[nH]4)C3)ncn2)cc1	ZINC000872440907	DG	On-Demand	Anodyne	HTR2B	15	45
c1ccc(-c2cc(N3CCC[C@@H](c4ncc[nH]4)C3)ncn2)cc1	ZINC000872440908	DG	On-Demand	Anodyne	HTR2B	15	45
CN(CCN1CCOCC1)c1cc(-c2ccccc2)ncn1	ZINC000872440933	CD	On-Demand	Anodyne	CASR	48	40
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000872440935	FF	On-Demand	Anodyne	P2RX7	21	42
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000872440935	FF	On-Demand	Anodyne	AKT3	50	35
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000872440935	FF	On-Demand	Anodyne	PARP1	36	40
O=S(=O)(CC1CC2(CCC2)C1)NCCn1cnc2ccccc21	ZINC000872440939	EF	On-Demand	Anodyne	NR1I2	41	32
Cc1cc(C(=O)NC2CCN(c3cc(-c4ccccc4)ncn3)CC2)c(C)o1	ZINC000872440965	GH	On-Demand	Anodyne	CNR2	19	40
CCCCN1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872440989	EE	On-Demand	Mild	CCR8	81	37
c1ccc(-c2cc(N3CC[C@H](N4CCCC4)C3)ncn2)cc1	ZINC000872441000	CF	On-Demand	Anodyne	HRH3	24	43
c1ccc(-c2cc(N3CC[C@H](N4CCCC4)C3)ncn2)cc1	ZINC000872441000	CF	On-Demand	Anodyne	L3MBTL3	58	39
c1ccc(-c2cc(N3CC[C@@H](N4CCCC4)C3)ncn2)cc1	ZINC000872441001	CF	On-Demand	Anodyne	HRH3	24	43
c1ccc(-c2cc(N3CC[C@@H](N4CCCC4)C3)ncn2)cc1	ZINC000872441001	CF	On-Demand	Anodyne	L3MBTL3	58	39
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872441020	EF	On-Demand	Anodyne	SLC27A4	41	30
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872441021	EF	On-Demand	Anodyne	SLC27A4	41	30
O=C(c1c(F)cccc1F)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872441024	EG	On-Demand	Anodyne	RBP4	24	41
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCCO2	ZINC000872441072	CF	On-Demand	Anodyne	CLK1	29	43
Cc1c(F)ncnc1NCc1ccc2c(c1)OCCCO2	ZINC000872441072	CF	On-Demand	Anodyne	CLK4	57	43
NC(=O)c1cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)nc(Cl)n1	ZINC000872441147	GD	On-Demand	Anodyne	SCD1	18	40
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)C1CCCCC1	ZINC000872441173	GG	On-Demand	Anodyne	EPHX2	24	53
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000872441192	GF	On-Demand	Mild	EPHX2	55	65
CN1CC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872441214	CC	On-Demand	Anodyne	CACNA1I	49	33
CN1CC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872441220	CF	On-Demand	Anodyne	VCP	57	36
CN1CC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872441220	CF	On-Demand	Anodyne	PKNB	32	48
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(C2CC2)CC1	ZINC000872441222	EE	On-Demand	Anodyne	PKM	51	42
C[C@H](O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872441235	CD	On-Demand	Anodyne	HTR1A	15	43
C[C@H](O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872441235	CD	On-Demand	Anodyne	SORD	42	39
Oc1nnc(Cl)cc1NCc1ccc2c(c1)OCCCO2	ZINC000872441260	DF	On-Demand	Anodyne	CLK2	23	41
Oc1nnc(Cl)cc1NCc1ccc2c(c1)OCCCO2	ZINC000872441260	DF	On-Demand	Anodyne	CLK4	18	41
Cc1c(F)ncnc1N1CCCN(Cc2cscn2)CC1	ZINC000872441284	DE	On-Demand	Anodyne	SCN5A	43	35
Oc1nnc(Cl)cc1N1CC[C@@H](N2CCCC2)C1	ZINC000872441309	CD	On-Demand	Anodyne	HRH3	19	44
Oc1nnc(Cl)cc1N1CC[C@@H](N2CCCC2)C1	ZINC000872441309	CD	On-Demand	Anodyne	L3MBTL3	67	38
Oc1nnc(Cl)cc1N1CC[C@H](N2CCCC2)C1	ZINC000872441310	CD	On-Demand	Anodyne	HRH3	19	44
Oc1nnc(Cl)cc1N1CC[C@H](N2CCCC2)C1	ZINC000872441310	CD	On-Demand	Anodyne	L3MBTL3	67	38
NC(=O)C1(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCCC1	ZINC000872441315	FE	On-Demand	Anodyne	PLAU	15	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CN1CCCC1	ZINC000872441316	EE	On-Demand	Mild	CASP3	42	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CN1CCCC1	ZINC000872441316	EE	On-Demand	Mild	CASP7	43	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000872441317	EE	On-Demand	Mild	CASP3	42	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000872441317	EE	On-Demand	Mild	CASP7	43	36
O=C(c1ccc(Cl)cc1F)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872441328	FF	On-Demand	Anodyne	P2RX7	19	46
CN(C)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872441339	CF	On-Demand	Anodyne	PKNB	15	45
COC(=O)CCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872441347	EE	On-Demand	Anodyne	TBXA2R	45	35
COC(=O)CCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872441347	EE	On-Demand	Anodyne	LEF	31	43
C[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441352	CD	On-Demand	Anodyne	P2RX3	19	41
C[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441352	CD	On-Demand	Anodyne	SORD	58	43
O=C1CCN(c2cc(-c3ccccc3)ncn2)CCN1	ZINC000872441366	CD	On-Demand	Anodyne	MAPKAPK2	17	40
CO[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872441390	CF	On-Demand	Anodyne	PDE3A	41	40
CO[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872441390	CF	On-Demand	Anodyne	PDE3B	44	39
Cc1ccc(S(=O)(=O)N2CCN(C3CC3)CC2)c(C#N)c1	ZINC000872441422	DD	On-Demand	Mild	TRPV4	43	36
C#CCCN1CCN(c2ncnc(F)c2C)CC1	ZINC000872441440	BD	On-Demand	Mild	ABCC1	63	35
C#CCCN1CCN(c2ncnc(F)c2C)CC1	ZINC000872441440	BD	On-Demand	Mild	RPS6KB1	44	34
CNC(=O)CCN(C)c1nc2c(OC)ccc(OC)c2s1	ZINC000872441449	DD	On-Demand	Anodyne	ADORA2B	16	40
Oc1nnc(Cl)cc1NCCCCCc1ccccc1	ZINC000872441452	CH	On-Demand	Anodyne	SCNN1A	48	40
Oc1nnc(Cl)cc1NCCCCCc1ccccc1	ZINC000872441452	CH	On-Demand	Anodyne	CES1	47	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)C2CCCCC2)CC1	ZINC000872441470	GE	On-Demand	Mild	EPHX2	25	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)C2CCCCC2)CC1	ZINC000872441470	GE	On-Demand	Mild	TGM2	24	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(C(=O)C2CCCCC2)CC1	ZINC000872441470	GE	On-Demand	Mild	F13A1	20	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCCCC3)CC2)c(C#N)c1	ZINC000872441499	GE	On-Demand	Mild	EPHX2	32	48
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCCCC3)CC2)c(C#N)c1	ZINC000872441499	GE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCCCC3)CC2)c(C#N)c1	ZINC000872441499	GE	On-Demand	Mild	TGM2	19	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCCCC3)CC2)c(C#N)c1	ZINC000872441499	GE	On-Demand	Mild	F13A1	29	44
c1cnc2nccc(N3CCCN(Cc4cscn4)CC3)c2c1	ZINC000872441500	EF	On-Demand	Anodyne	SCN5A	41	33
CCCCN1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872441501	EE	On-Demand	Mild	CCR8	91	40
Cc1c(F)ncnc1N1CCCN(C(=O)C(C)C)CC1	ZINC000872441502	CD	On-Demand	Anodyne	AKT3	44	38
Cc1c(F)ncnc1N1CCCN(C(=O)C(C)C)CC1	ZINC000872441502	CD	On-Demand	Anodyne	AKT1	34	41
O[C@H]1CCC[C@H]1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872441554	CD	On-Demand	Anodyne	SLC18A3	52	49
O[C@H]1CCC[C@@H]1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872441555	CD	On-Demand	Anodyne	SLC18A3	52	49
O[C@@H]1CCC[C@H]1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872441556	CD	On-Demand	Anodyne	SLC18A3	52	49
O[C@@H]1CCC[C@@H]1N1CCN(c2ccnc3ncccc23)CC1	ZINC000872441557	CD	On-Demand	Anodyne	SLC18A3	52	49
CC(=O)NC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872441579	FE	On-Demand	Anodyne	CACNA1I	68	36
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	NPY2R	42	33
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	PIK3CA	18	40
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	MAPK9	40	54
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	MAPK10	47	54
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	PIK3CB	24	41
NC(=O)c1cc(Nc2ccc(N3CCOCC3)c(F)c2)nc(Cl)n1	ZINC000872441580	FD	On-Demand	Anodyne	STAT6	61	38
O[C@@H]1CCC[C@@H]1N1CCN(c2ccncc2C2CC2)CC1	ZINC000872441582	CD	On-Demand	Anodyne	SLC18A3	54	47
O[C@@H]1CCC[C@H]1N1CCN(c2ccncc2C2CC2)CC1	ZINC000872441583	CD	On-Demand	Anodyne	SLC18A3	54	47
O[C@H]1CCC[C@@H]1N1CCN(c2ccncc2C2CC2)CC1	ZINC000872441584	CD	On-Demand	Anodyne	SLC18A3	54	47
O[C@H]1CCC[C@H]1N1CCN(c2ccncc2C2CC2)CC1	ZINC000872441585	CD	On-Demand	Anodyne	SLC18A3	54	47
C[C@@H](CCc1ccc2c(c1)OCO2)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872441596	GE	On-Demand	Anodyne	BMP1	53	36
C[C@@H](CCc1ccc2c(c1)OCO2)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872441597	GE	On-Demand	Anodyne	BMP1	53	36
C[C@H](CCc1ccc2c(c1)OCO2)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872441598	GE	On-Demand	Anodyne	BMP1	53	36
C[C@H](CCc1ccc2c(c1)OCO2)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872441599	GE	On-Demand	Anodyne	BMP1	53	36
COC(=O)C1=C(C)N(C)C(=O)N(C)[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872441606	GD	On-Demand	Anodyne	PROKR1	63	34
COC(=O)C1=C(C)N(C)C(=O)N(C)[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872441607	GD	On-Demand	Anodyne	PROKR1	63	34
O=C(c1c(F)cccc1Cl)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872441608	FF	On-Demand	Anodyne	P2RX7	18	41
O[C@H]1CCC[C@H]1N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441609	DE	On-Demand	Anodyne	SLC18A3	56	51
O[C@@H]1CCC[C@H]1N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441610	DE	On-Demand	Anodyne	SLC18A3	56	51
O[C@H]1CCC[C@@H]1N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441611	DE	On-Demand	Anodyne	SLC18A3	56	51
O[C@@H]1CCC[C@@H]1N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872441612	DE	On-Demand	Anodyne	SLC18A3	56	51
c1cnc2nccc(N3CCC[C@H]3c3ccc4c(c3)OCO4)c2c1	ZINC000872441624	DH	On-Demand	Anodyne	NOS2	58	36
c1cnc2nccc(N3CCC[C@H]3c3ccc4c(c3)OCO4)c2c1	ZINC000872441624	DH	On-Demand	Anodyne	PDE11A	62	36
c1cnc2nccc(N3CCC[C@@H]3c3ccc4c(c3)OCO4)c2c1	ZINC000872441625	DH	On-Demand	Anodyne	NOS2	58	36
c1cnc2nccc(N3CCC[C@@H]3c3ccc4c(c3)OCO4)c2c1	ZINC000872441625	DH	On-Demand	Anodyne	PDE11A	62	36
O=C1[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1Cc1ccccc1	ZINC000872441630	GF	On-Demand	Anodyne	F10	40	57
O=C1[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1Cc1ccccc1	ZINC000872441630	GF	On-Demand	Anodyne	TRY2_BOVIN	18	47
O=C1[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1Cc1ccccc1	ZINC000872441631	GF	On-Demand	Anodyne	F10	40	57
O=C1[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1Cc1ccccc1	ZINC000872441631	GF	On-Demand	Anodyne	TRY2_BOVIN	18	47
C#CCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872441633	CD	On-Demand	Mild	HTR1A	34	45
C#CCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872441633	CD	On-Demand	Mild	DRD2	24	45
O=C(NCc1cccnc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872441641	EF	On-Demand	Anodyne	CHRNA7	46	35
O=C(NCc1cccnc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872441641	EF	On-Demand	Anodyne	TBK1	41	33
O=C(NCc1cccnc1)C1CCN(c2ccncc2C2CC2)CC1	ZINC000872441641	EF	On-Demand	Anodyne	NAMPT	104	43
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)c(F)c1	ZINC000872441644	DF	On-Demand	Anodyne	MAPK9	37	51
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)c(F)c1	ZINC000872441644	DF	On-Demand	Anodyne	MAPK10	43	51
Oc1nnc(Cl)cc1Nc1ccc(N2CCOCC2)c(F)c1	ZINC000872441644	DF	On-Demand	Anodyne	STAT6	45	33
Cc1cc(C(=O)NC2CCN(c3ncnc(F)c3C)CC2)c(C)o1	ZINC000872441649	EF	On-Demand	Anodyne	SIRT3	54	33
Cc1cc(C(=O)NC2CCN(c3ncnc(F)c3C)CC2)c(C)o1	ZINC000872441649	EF	On-Demand	Anodyne	SIRT2	53	32
Cc1cc(C(=O)NC2CCN(c3ncnc(F)c3C)CC2)c(C)o1	ZINC000872441649	EF	On-Demand	Anodyne	SIRT1	51	32
Cc1c(F)ncnc1N1CCC[C@@H](CCC(N)=O)C1	ZINC000872441659	CD	On-Demand	Anodyne	SIRT3	54	35
Cc1c(F)ncnc1N1CCC[C@@H](CCC(N)=O)C1	ZINC000872441659	CD	On-Demand	Anodyne	SIRT2	43	33
Cc1c(F)ncnc1N1CCC[C@@H](CCC(N)=O)C1	ZINC000872441659	CD	On-Demand	Anodyne	SIRT1	40	32
Cc1c(F)ncnc1N1CCC[C@H](CCC(N)=O)C1	ZINC000872441660	CD	On-Demand	Anodyne	SIRT3	54	35
Cc1c(F)ncnc1N1CCC[C@H](CCC(N)=O)C1	ZINC000872441660	CD	On-Demand	Anodyne	SIRT2	43	33
Cc1c(F)ncnc1N1CCC[C@H](CCC(N)=O)C1	ZINC000872441660	CD	On-Demand	Anodyne	SIRT1	40	32
c1ccc(-c2cc(N3CCCN(Cc4cscn4)CC3)ncn2)cc1	ZINC000872441668	FG	On-Demand	Anodyne	SCN5A	44	39
O=C(NC1CCCCC1)C1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872441709	GG	On-Demand	Anodyne	EPHX2	25	59
CCC[C@H](Cc1ccccc1)Nc1nc(N)nc(C(F)F)n1	ZINC000872441715	DG	On-Demand	Anodyne	TPH1	42	34
CCC[C@@H](Cc1ccccc1)Nc1nc(N)nc(C(F)F)n1	ZINC000872441716	DG	On-Demand	Anodyne	TPH1	42	34
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)Nc1cccc(F)c1	ZINC000872441742	GG	On-Demand	Anodyne	CCR3	89	45
CN(C)[C@@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872441747	CE	On-Demand	Anodyne	PKNB	16	49
COc1cc(Br)c(CNc2nc(N)nc(C(F)F)n2)cc1OC	ZINC000872441756	GF	On-Demand	Anodyne	DRTS_TOXGO	40	42
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872441757	FE	On-Demand	Mild	CCR8	100	42
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872441757	FE	On-Demand	Mild	SFRP1	77	37
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000872441757	FE	On-Demand	Mild	WNT3	45	37
NC(=O)c1cc(NCc2ccc3c(c2)OCCCO3)nc(Cl)n1	ZINC000872441769	EE	On-Demand	Anodyne	CLK2	18	40
NC(=O)c1cc(NCc2ccc3c(c2)OCCCO3)nc(Cl)n1	ZINC000872441769	EE	On-Demand	Anodyne	CLK4	15	40
O[C@@H](CNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872441798	CE	On-Demand	Anodyne	VCP	50	36
O[C@H](CNc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872441800	CE	On-Demand	Anodyne	VCP	50	36
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000872441823	ED	On-Demand	Anodyne	SIRT3	58	32
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000872441823	ED	On-Demand	Anodyne	SIRT2	41	31
CN(CCN1CCOCC1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872441856	CB	On-Demand	Anodyne	CASR	50	38
Nc1nc(C(F)F)nc(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)n1	ZINC000872441862	GE	On-Demand	Anodyne	P2RX7	16	46
CN(CCN1CCOCC1)c1ccnc2ncccc12	ZINC000872441865	CD	On-Demand	Anodyne	HNMT	19	56
NC(=O)c1cc(N2CC[C@@H](N3CCCC3)C2)nc(Cl)n1	ZINC000872441901	CC	On-Demand	Anodyne	L3MBTL3	75	36
NC(=O)c1cc(N2CC[C@H](N3CCCC3)C2)nc(Cl)n1	ZINC000872441902	CC	On-Demand	Anodyne	L3MBTL3	75	36
Cc1ccc(S(=O)(=O)N2C[C@@H](C)OC(C)(C)C2)c(C#N)c1	ZINC000872441927	DE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2C[C@H](C)OC(C)(C)C2)c(C#N)c1	ZINC000872441928	DE	On-Demand	Mild	TRPV4	44	36
CCOC(=O)CN1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872441941	FD	On-Demand	Mild	TRPV4	44	36
COc1ccccc1[C@@H]1CCCN1c1ccnc2ncccc12	ZINC000872441948	DH	On-Demand	Anodyne	HTR1A	16	41
COc1ccccc1[C@H]1CCCN1c1ccnc2ncccc12	ZINC000872441949	DH	On-Demand	Anodyne	HTR1A	16	41
O[C@H]1CCC[C@H]1N1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872441950	EE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@@H]1N1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872441951	EE	On-Demand	Anodyne	SLC18A3	29	40
O[C@H]1CCC[C@@H]1N1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872441952	EE	On-Demand	Anodyne	SLC18A3	29	40
O[C@@H]1CCC[C@H]1N1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872441953	EE	On-Demand	Anodyne	SLC18A3	29	40
COc1ccc(CC[C@@H](C)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1	ZINC000872441956	GF	On-Demand	Anodyne	MMP9	15	40
COc1ccc(CC[C@H](C)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1	ZINC000872441957	GF	On-Demand	Anodyne	MMP9	15	40
COc1ccc(CC[C@H](C)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1	ZINC000872441958	GF	On-Demand	Anodyne	MMP9	15	40
COc1ccc(CC[C@@H](C)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1	ZINC000872441959	GF	On-Demand	Anodyne	MMP9	15	40
CC(=O)NC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442010	ED	On-Demand	Mild	EPHX2	19	48
CC(=O)NC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442010	ED	On-Demand	Mild	TRPV4	42	35
CC(=O)NC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442010	ED	On-Demand	Mild	CACNA1I	49	36
Nc1nc(C(F)F)nc(N2CCN([C@@H]3CCC[C@@H]3O)CC2)n1	ZINC000872442024	DC	On-Demand	Anodyne	SLC18A3	26	43
Nc1nc(C(F)F)nc(N2CCN([C@H]3CCC[C@H]3O)CC2)n1	ZINC000872442025	DC	On-Demand	Anodyne	SLC18A3	26	43
Nc1nc(C(F)F)nc(N2CCN([C@H]3CCC[C@@H]3O)CC2)n1	ZINC000872442026	DC	On-Demand	Anodyne	SLC18A3	26	43
Nc1nc(C(F)F)nc(N2CCN([C@@H]3CCC[C@H]3O)CC2)n1	ZINC000872442027	DC	On-Demand	Anodyne	SLC18A3	26	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000872442052	GF	On-Demand	Mild	EPHX2	50	64
O=S(=O)(NC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872442061	GG	On-Demand	Anodyne	ADRA1D	27	40
O=S(=O)(NC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872442061	GG	On-Demand	Anodyne	ADRA1A	19	40
O=S(=O)(NC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872442061	GG	On-Demand	Anodyne	ADRA1B	21	40
O=S(=O)(NC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872442061	GG	On-Demand	Anodyne	SFRP1	129	41
O=S(=O)(NC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872442061	GG	On-Demand	Anodyne	WNT3	85	37
Cn1ncc2c(N3CCC(C(=O)NCc4cccnc4)CC3)nc(Cl)nc21	ZINC000872442066	GD	On-Demand	Anodyne	NAMPT	67	38
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000872442071	GC	On-Demand	Mild	EPHX2	38	50
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(C[C@H]2CCCO2)CC1	ZINC000872442080	GF	On-Demand	Anodyne	PKM	44	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(C[C@@H]2CCCO2)CC1	ZINC000872442081	GF	On-Demand	Anodyne	PKM	44	40
Cc1c(F)ncnc1N1CCN(C(=O)c2c(F)cccc2Cl)CC1	ZINC000872442084	FF	On-Demand	Anodyne	AKT3	40	35
CN1CC[C@H](CNc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872442087	DG	On-Demand	Anodyne	PKNB	18	41
CCCN(CC)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872442092	EG	On-Demand	Anodyne	PKM	35	42
CCOC(=O)CN1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442114	GE	On-Demand	Anodyne	NOD2	17	40
CCC(=O)c1c(Cl)cccc1NCC(C)(C)O	ZINC000872442122	CG	On-Demand	Anodyne	ECR	42	35
Oc1nnc(Cl)cc1N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872442138	CC	On-Demand	Anodyne	SLC18A3	35	46
Oc1nnc(Cl)cc1N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872442139	CC	On-Demand	Anodyne	SLC18A3	35	46
Oc1nnc(Cl)cc1N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872442140	CC	On-Demand	Anodyne	SLC18A3	35	46
Oc1nnc(Cl)cc1N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872442141	CC	On-Demand	Anodyne	SLC18A3	35	46
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(n2cccn2)CC1	ZINC000872442147	FF	On-Demand	Anodyne	PKM	42	39
O=[N+]([O-])c1cccc(CNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872442156	DF	On-Demand	Bother	CACNA1C	41	35
O=[N+]([O-])c1cccc(CNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872442156	DF	On-Demand	Bother	CACNA1D	69	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872442163	FD	On-Demand	Mild	F10	16	50
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000872442163	FD	On-Demand	Mild	TRY2_BOVIN	16	42
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872442164	FD	On-Demand	Mild	F10	16	50
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000872442164	FD	On-Demand	Mild	TRY2_BOVIN	16	42
CCOC(=O)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872442165	FD	On-Demand	Anodyne	PKM	31	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCN(C4CC4)CC3)cc2N1	ZINC000872442174	GE	On-Demand	Anodyne	PKM	20	42
CCOC(=O)C1=C(C)N(C)C(=O)N(C)[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872442175	GE	On-Demand	Anodyne	PROKR1	63	35
CCOC(=O)C1=C(C)N(C)C(=O)N(C)[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872442176	GE	On-Demand	Anodyne	PROKR1	63	35
Oc1nnc(Cl)cc1N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000872442192	EI	On-Demand	Anodyne	RBP4	59	41
Oc1nnc(Cl)cc1N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000872442193	EI	On-Demand	Anodyne	RBP4	59	41
O=C1OCCN1CCCNc1ccnc2ncccc12	ZINC000872442199	CD	On-Demand	Anodyne	HRP1_PLAFA	108	44
O=C1OCCN1CCCNc1ccnc2ncccc12	ZINC000872442199	CD	On-Demand	Anodyne	HNMT	59	44
O=C(NCc1cccnc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872442201	EF	On-Demand	Anodyne	CHRNA7	45	37
O=C(NCc1cccnc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872442201	EF	On-Demand	Anodyne	SCD	19	41
O=C(NCc1cccnc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872442201	EF	On-Demand	Anodyne	NAMPT	96	45
Cc1c(F)ncnc1N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872442230	ED	On-Demand	Anodyne	CHRNA7	44	36
Cc1c(F)ncnc1N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872442230	ED	On-Demand	Anodyne	SCD1	15	41
Cc1c(F)ncnc1N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872442230	ED	On-Demand	Anodyne	SCD	20	40
Cc1c(F)ncnc1N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872442230	ED	On-Demand	Anodyne	LIMK2	22	43
Cc1c(F)ncnc1N1CCC(C(=O)NCc2cccnc2)CC1	ZINC000872442230	ED	On-Demand	Anodyne	NAMPT	71	41
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872442266	FG	On-Demand	Anodyne	CCR3	101	47
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872442266	FG	On-Demand	Anodyne	LIMK2	57	37
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872442267	FG	On-Demand	Anodyne	CCR3	101	47
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000872442267	FG	On-Demand	Anodyne	LIMK2	57	37
CC(C)c1nnc(N2CCC(C(=O)NCc3cccnc3)CC2)o1	ZINC000872442281	EE	On-Demand	Anodyne	CHRNA7	46	37
CC(C)c1nnc(N2CCC(C(=O)NCc3cccnc3)CC2)o1	ZINC000872442281	EE	On-Demand	Anodyne	SCD1	22	45
CC(C)c1nnc(N2CCC(C(=O)NCc3cccnc3)CC2)o1	ZINC000872442281	EE	On-Demand	Anodyne	SCD	26	40
CC(C)c1nnc(N2CCC(C(=O)NCc3cccnc3)CC2)o1	ZINC000872442281	EE	On-Demand	Anodyne	NAMPT	85	42
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000872442286	FE	On-Demand	Mild	CCR8	65	33
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000872442286	FE	On-Demand	Mild	SFRP1	72	37
CN1CCN(c2nc(N)nc(C(F)F)n2)Cc2ccccc21	ZINC000872442298	DD	On-Demand	Anodyne	HRH4	35	42
O=C(NCc1cccnc1)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872442324	GG	On-Demand	Anodyne	NAMPT	61	38
Nc1nc(NC[C@H](O)Cc2ccccc2)nc(C(F)F)n1	ZINC000872442333	CD	On-Demand	Anodyne	TPH1	48	41
Nc1nc(NC[C@@H](O)Cc2ccccc2)nc(C(F)F)n1	ZINC000872442334	CD	On-Demand	Anodyne	TPH1	48	41
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	SCN2A	17	40
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	SCN10A	19	42
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	SIRT3	57	32
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	SIRT2	52	32
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	SIRT1	51	31
NC(=O)C1CCN(c2ncccc2CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872442335	GF	On-Demand	Anodyne	VCP	69	46
Cc1c(F)ncnc1N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872442339	CC	On-Demand	Anodyne	SLC18A3	29	44
Cc1c(F)ncnc1N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872442340	CC	On-Demand	Anodyne	SLC18A3	29	44
Cc1c(F)ncnc1N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872442341	CC	On-Demand	Anodyne	SLC18A3	29	44
Cc1c(F)ncnc1N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872442342	CC	On-Demand	Anodyne	SLC18A3	29	44
O=C(c1ccc(Oc2cc(Cl)nnc2O)cc1)N1CCCC1	ZINC000872442346	DF	On-Demand	Anodyne	HRH3	23	40
O=C(c1ccc(Oc2cc(Cl)nnc2O)cc1)N1CCCC1	ZINC000872442346	DF	On-Demand	Anodyne	L3MBTL3	62	40
Nc1nc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872442347	EE	On-Demand	Anodyne	GRIN2B	27	46
Nc1nc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872442347	EE	On-Demand	Anodyne	VCP	44	32
Nc1nc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872442348	EE	On-Demand	Anodyne	GRIN2B	27	46
Nc1nc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872442348	EE	On-Demand	Anodyne	VCP	44	32
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	HTR1A	43	49
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	DRD2	34	44
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	ADRA1D	15	40
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	HTR2A	26	42
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	ADRA1A	18	43
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	DRD3	39	46
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	HRP1_PLAFA	90	39
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	HTR7	24	40
Oc1nnc(Cl)cc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442360	FD	On-Demand	Anodyne	HNMT	71	42
C[C@@H](c1cccc(Nc2cc(C(N)=O)nc(Cl)n2)c1)N1CCOCC1	ZINC000872442365	FE	On-Demand	Anodyne	STAT6	52	33
Cc1c(F)ncnc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442367	DF	On-Demand	Anodyne	ACHE	15	42
Cc1c(F)ncnc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442367	DF	On-Demand	Anodyne	HTR1D	18	40
Cc1c(F)ncnc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442367	DF	On-Demand	Anodyne	HTR4	17	41
Cc1c(F)ncnc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442367	DF	On-Demand	Anodyne	GRIN2B	27	46
Cc1c(F)ncnc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442367	DF	On-Demand	Anodyne	SIGMAR1	29	43
Cc1c(F)ncnc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442368	DF	On-Demand	Anodyne	ACHE	15	42
Cc1c(F)ncnc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442368	DF	On-Demand	Anodyne	HTR1D	18	40
Cc1c(F)ncnc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442368	DF	On-Demand	Anodyne	HTR4	17	41
Cc1c(F)ncnc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442368	DF	On-Demand	Anodyne	GRIN2B	27	46
Cc1c(F)ncnc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442368	DF	On-Demand	Anodyne	SIGMAR1	29	43
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	HTR1A	57	52
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	DRD2	47	50
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	DRD4	31	50
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	ADRA1D	20	44
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	HTR2A	31	50
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	ADRA1A	23	45
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	DRD3	41	50
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	HRP1_PLAFA	97	42
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	HTR7	43	45
c1cnc(N2CCN(CCCCNc3ccnc4ncccc34)CC2)nc1	ZINC000872442371	FE	On-Demand	Anodyne	HNMT	112	56
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000872442386	ED	On-Demand	Anodyne	SIRT3	64	34
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000872442386	ED	On-Demand	Anodyne	SIRT2	47	34
Cc1c(F)ncnc1N1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000872442386	ED	On-Demand	Anodyne	SLC27A1	43	34
COc1ccnc(N2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872442389	ED	On-Demand	Anodyne	HRH4	26	42
COc1cccc([C@@H](C)N2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872442401	EF	On-Demand	Anodyne	UTS2R	18	41
COc1cccc([C@H](C)N2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872442402	EF	On-Demand	Anodyne	UTS2R	18	41
O=C(CN1CCCC1)N1CCN(c2ccncc2C2CC2)CC1	ZINC000872442403	DD	On-Demand	Anodyne	MAPK1	20	41
Cc1c(F)ncnc1N1CCC(CN(C)C(=O)OC(C)(C)C)CC1	ZINC000872442404	EG	On-Demand	Anodyne	SIRT3	60	40
Cc1c(F)ncnc1N1CCC(CN(C)C(=O)OC(C)(C)C)CC1	ZINC000872442404	EG	On-Demand	Anodyne	SIRT2	54	40
Cc1c(F)ncnc1N1CCC(CN(C)C(=O)OC(C)(C)C)CC1	ZINC000872442404	EG	On-Demand	Anodyne	SIRT1	51	36
CN(CC1CCN(c2cc(Cl)nnc2O)CC1)C(=O)OC(C)(C)C	ZINC000872442414	FF	On-Demand	Anodyne	SIRT3	43	38
CN(C)CCOc1ccc(CCNc2cc(Cl)nnc2O)cc1	ZINC000872442420	EE	On-Demand	Anodyne	ESRRG	46	36
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	HTR1A	36	49
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	DRD2	30	49
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	DRD4	27	49
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	ADRA1D	19	42
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	HTR2A	23	49
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	ADRA1A	22	47
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	DRD3	32	49
Cc1c(F)ncnc1NCCCCN1CCN(c2ncccn2)CC1	ZINC000872442426	ED	On-Demand	Anodyne	HNMT	43	37
OCCN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872442435	CD	On-Demand	Anodyne	DRD4	32	43
CC(=O)Nc1cccc(OCCNc2ncnc(F)c2C)c1	ZINC000872442439	DE	On-Demand	Anodyne	MTNR1A	20	43
CC(=O)Nc1cccc(OCCNc2ncnc(F)c2C)c1	ZINC000872442439	DE	On-Demand	Anodyne	MTNR1B	20	43
CC(=O)Nc1cccc(OCCNc2ncnc(F)c2C)c1	ZINC000872442439	DE	On-Demand	Anodyne	KCNK3	62	34
CC(=O)Nc1cccc(OCCNc2ncnc(F)c2C)c1	ZINC000872442439	DE	On-Demand	Anodyne	KCNK9	57	34
Cc1c(F)ncnc1NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872442448	ED	On-Demand	Anodyne	SIRT3	51	33
Cc1c(F)ncnc1NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872442448	ED	On-Demand	Anodyne	SIRT2	44	31
Cc1c(F)ncnc1NCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000872442448	ED	On-Demand	Anodyne	SIRT1	49	31
Cc1c(F)ncnc1N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872442468	DF	On-Demand	Mild	PDE3A	40	43
Cc1c(F)ncnc1N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872442468	DF	On-Demand	Mild	DCK	58	54
Cc1c(F)ncnc1N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872442468	DF	On-Demand	Mild	PDE3B	47	43
Cc1c(F)ncnc1N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872442468	DF	On-Demand	Mild	CHRNA10	34	42
Cc1c(F)ncnc1N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872442468	DF	On-Demand	Mild	LRRK2	20	47
COC(=O)CN1CCN(c2ccc(Nc3cc(Cl)nnc3O)cc2)CC1	ZINC000872442480	GD	On-Demand	Anodyne	STAT6	76	40
N#Cc1ccc(OC2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872442494	EH	On-Demand	Mild	PDE3B	16	44
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	DRD4	34	46
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	ACHE	38	47
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	SIGMAR1	42	41
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	AKT2	57	38
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	FAAH	15	43
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	MCHR1	23	41
OC1CCN(Cc2ccc(CNc3cc(-c4ccccc4)ncn3)cc2)CC1	ZINC000872442495	FH	On-Demand	Anodyne	VCP	45	38
Nc1nc(N[C@@H]2CCN(c3ccc(Br)cc3)C2)nc(C(F)F)n1	ZINC000872442512	GF	On-Demand	Anodyne	HRH4	55	38
Nc1nc(N[C@H]2CCN(c3ccc(Br)cc3)C2)nc(C(F)F)n1	ZINC000872442513	GF	On-Demand	Anodyne	HRH4	55	38
Cn1ncc2c(N3CCC(c4nc(-c5ccccc5)no4)CC3)nc(Cl)nc21	ZINC000872442521	GG	On-Demand	Anodyne	GRM5	17	41
Cn1ncc2c(N3CCC(c4nc(-c5ccccc5)no4)CC3)nc(Cl)nc21	ZINC000872442521	GG	On-Demand	Anodyne	ETHR	33	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CCCCC1	ZINC000872442523	FE	On-Demand	Anodyne	HTR1A	30	41
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CCCCC1	ZINC000872442523	FE	On-Demand	Anodyne	DRD4	20	46
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CCCCC1	ZINC000872442523	FE	On-Demand	Anodyne	CNR2	15	41
O=C(CN1CCN(c2ccnc3ncccc23)CC1)NC1CCCCC1	ZINC000872442523	FE	On-Demand	Anodyne	SLC27A1	41	38
COc1ccc(OC)c2sc(N3CCCN(CCO)CC3)nc12	ZINC000872442526	ED	On-Demand	Anodyne	HTR1A	43	39
Cc1c(F)ncnc1N1CCN([C@H](C)C(=O)NC2CCCC2)CC1	ZINC000872442560	ED	On-Demand	Anodyne	SIRT3	55	31
Cc1c(F)ncnc1N1CCN([C@@H](C)C(=O)NC2CCCC2)CC1	ZINC000872442561	ED	On-Demand	Anodyne	SIRT3	55	31
CN(C)CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872442564	EF	On-Demand	Anodyne	ESRRG	43	32
Oc1nnc(Cl)cc1N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872442579	FG	On-Demand	Anodyne	CPT1A	37	42
Oc1nnc(Cl)cc1N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872442579	FG	On-Demand	Anodyne	GRM5	20	46
Oc1nnc(Cl)cc1N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872442579	FG	On-Demand	Anodyne	ETHR	53	47
COc1ccc(OC)c2sc(N3CC[C@@H](C(N)=O)C3)nc12	ZINC000872442607	DD	On-Demand	Anodyne	PARE	47	32
COc1ccc(OC)c2sc(N3CC[C@H](C(N)=O)C3)nc12	ZINC000872442608	DD	On-Demand	Anodyne	PARE	47	32
O=S(=O)(N[C@@H]1CCCN(c2cc(Cl)nnc2O)C1)c1cccc(F)c1	ZINC000872442631	GD	On-Demand	Anodyne	SFRP1	44	33
O=S(=O)(N[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1cccc(F)c1	ZINC000872442632	GD	On-Demand	Anodyne	SFRP1	44	33
OC1CCN(Cc2ccc(CNc3ccnc4ncccc34)cc2)CC1	ZINC000872442644	EG	On-Demand	Anodyne	SIGMAR1	24	40
NC(=O)[C@@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872442654	DE	On-Demand	Anodyne	GRM5	15	45
NC(=O)[C@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872442656	DE	On-Demand	Anodyne	GRM5	15	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3nccs3)cc2N1	ZINC000872442661	GF	On-Demand	Anodyne	PKM	31	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3cscn3)cc2N1	ZINC000872442663	FF	On-Demand	Anodyne	PKM	31	44
O=C(CNS(=O)(=O)CC1CC2(CCC2)C1)NCCc1ccccc1	ZINC000872442674	FD	On-Demand	Anodyne	CA5B	16	42
c1cnc(N2CCN(CCCCN=c3cc[nH]cc3C3CC3)CC2)nc1	ZINC000872442677	FE	On-Demand	Anodyne	HTR1A	17	47
c1cnc(N2CCN(CCCCN=c3cc[nH]cc3C3CC3)CC2)nc1	ZINC000872442677	FE	On-Demand	Anodyne	DRD4	15	50
Nc1nc(NCc2cccc(CO)c2)nc(C(F)F)n1	ZINC000872442703	CD	On-Demand	Anodyne	TPH1	28	40
CCN(CC)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872442705	FE	On-Demand	Mild	EPHX2	34	48
CCN(CC)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872442705	FE	On-Demand	Mild	TRPV4	43	36
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872442743	FD	On-Demand	Mild	TRPV4	48	39
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872442743	FD	On-Demand	Mild	TGM2	38	43
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872442743	FD	On-Demand	Mild	F13A1	50	43
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442749	ED	On-Demand	Mild	EPHX2	30	46
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442749	ED	On-Demand	Mild	TRPV4	42	34
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442750	ED	On-Demand	Mild	EPHX2	30	46
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872442750	ED	On-Demand	Mild	TRPV4	42	34
O=S(=O)(N[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872442757	GF	On-Demand	Anodyne	SFRP1	104	38
O=S(=O)(N[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872442757	GF	On-Demand	Anodyne	WNT3	67	34
O=S(=O)(N[C@H]1CCN(CC(F)(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872442759	GF	On-Demand	Anodyne	SFRP1	104	38
O=S(=O)(N[C@H]1CCN(CC(F)(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872442759	GF	On-Demand	Anodyne	WNT3	67	34
COCCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872442765	EF	On-Demand	Anodyne	LEF	21	40
Cn1ncc2c(N3CCC(Oc4ccc(C#N)cc4)CC3)nc(Cl)nc21	ZINC000872442769	FF	On-Demand	Mild	DCK	27	42
COC(=O)CSCCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872442786	EF	On-Demand	Anodyne	ADORA2B	17	43
COC(=O)CSCCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872442786	EF	On-Demand	Anodyne	ENPP1	65	31
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	HTR1A	78	38
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	DRD2	68	41
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	DRD4	48	38
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	HTR2A	42	41
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	SLC6A4	20	40
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	DRD3	71	38
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	HTR7	67	41
CN(CCN1CCN(c2cc(Cl)nnc2O)CC1)Cc1ccccc1	ZINC000872442796	FE	On-Demand	Anodyne	SIGMAR1	32	45
Cc1ccc(S(=O)(=O)N2CC[C@H](c3ccccc3)C2)c(C#N)c1	ZINC000872442797	EG	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CC[C@@H](c3ccccc3)C2)c(C#N)c1	ZINC000872442798	EG	On-Demand	Mild	EPHX2	17	43
COc1ccnc(N2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872442800	DF	On-Demand	Anodyne	EBP	27	45
C#CCNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442807	FD	On-Demand	Mild	EPHX2	46	48
CCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872442825	EF	On-Demand	Anodyne	PKM	33	42
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442852	GF	On-Demand	Anodyne	APP	46	38
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442852	GF	On-Demand	Anodyne	PKM	40	41
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442852	GF	On-Demand	Anodyne	TGM2	66	50
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442852	GF	On-Demand	Anodyne	GCK	47	33
CCOC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872442852	GF	On-Demand	Anodyne	F13A1	76	50
C[C@@H](CC#N)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872442857	CE	On-Demand	Mild	LEF	34	40
NC(=O)c1cc(N2CC[C@H](c3cccc(F)c3)C2)nc(Cl)n1	ZINC000872442858	DE	On-Demand	Anodyne	CCR5	41	35
NC(=O)c1cc(N2CC[C@@H](c3cccc(F)c3)C2)nc(Cl)n1	ZINC000872442859	DE	On-Demand	Anodyne	CCR5	41	35
CCN(CC)C(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872442882	FE	On-Demand	Mild	EPHX2	27	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCOCC3)cc2N1	ZINC000872442893	FE	On-Demand	Anodyne	PKM	21	42
COc1ccnc(N2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872442916	DE	On-Demand	Anodyne	EBP	15	40
COCCCNC(=O)[C@H](C)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872442944	FD	On-Demand	Anodyne	DRD2	27	45
COCCCNC(=O)[C@H](C)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872442944	FD	On-Demand	Anodyne	DRD3	45	45
COCCCNC(=O)[C@@H](C)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872442946	FD	On-Demand	Anodyne	DRD2	27	45
COCCCNC(=O)[C@@H](C)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872442946	FD	On-Demand	Anodyne	DRD3	45	45
C[C@H]1CCC[C@@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872442953	CD	On-Demand	Anodyne	SYK	42	36
C[C@H]1CCC[C@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872442954	CD	On-Demand	Anodyne	SYK	42	36
C[C@@H]1CCC[C@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872442956	CD	On-Demand	Anodyne	SYK	42	36
Oc1nnc(Cl)cc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442961	EF	On-Demand	Anodyne	DRD4	23	40
Oc1nnc(Cl)cc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442961	EF	On-Demand	Anodyne	ACHE	28	41
Oc1nnc(Cl)cc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442961	EF	On-Demand	Anodyne	HTR4	18	41
Oc1nnc(Cl)cc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442961	EF	On-Demand	Anodyne	GRIN2B	26	43
Oc1nnc(Cl)cc1NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000872442961	EF	On-Demand	Anodyne	SIGMAR1	35	40
Oc1nnc(Cl)cc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442962	EF	On-Demand	Anodyne	DRD4	23	40
Oc1nnc(Cl)cc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442962	EF	On-Demand	Anodyne	ACHE	28	41
Oc1nnc(Cl)cc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442962	EF	On-Demand	Anodyne	HTR4	18	41
Oc1nnc(Cl)cc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442962	EF	On-Demand	Anodyne	GRIN2B	26	43
Oc1nnc(Cl)cc1NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000872442962	EF	On-Demand	Anodyne	SIGMAR1	35	40
O=C(CN1CCN(c2ccncc2C2CC2)CC1)NC1CCCCC1	ZINC000872442971	EF	On-Demand	Anodyne	SLC27A1	42	33
Cc1c(F)ncnc1N1CC[C@H](CN(C)C(=O)OC(C)(C)C)C1	ZINC000872442977	DF	On-Demand	Anodyne	SIRT3	40	37
Cc1c(F)ncnc1N1CC[C@@H](CN(C)C(=O)OC(C)(C)C)C1	ZINC000872442978	DF	On-Demand	Anodyne	SIRT3	40	37
Cn1ncc2c(N3CCC(Oc4cccc(C#N)c4)CC3)nc(Cl)nc21	ZINC000872442979	FF	On-Demand	Mild	DCK	30	44
N#Cc1cccc(OC2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872442994	DH	On-Demand	Mild	DCK	16	42
NC(=O)c1cc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443000	FE	On-Demand	Anodyne	DRD4	22	40
NC(=O)c1cc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443000	FE	On-Demand	Anodyne	HTR1D	18	41
NC(=O)c1cc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443000	FE	On-Demand	Anodyne	HTR4	18	40
NC(=O)c1cc(NC[C@@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443000	FE	On-Demand	Anodyne	VCP	48	38
NC(=O)c1cc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443001	FE	On-Demand	Anodyne	DRD4	22	40
NC(=O)c1cc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443001	FE	On-Demand	Anodyne	HTR1D	18	41
NC(=O)c1cc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443001	FE	On-Demand	Anodyne	HTR4	18	40
NC(=O)c1cc(NC[C@H]2CCN(CCc3ccccc3)C2)nc(Cl)n1	ZINC000872443001	FE	On-Demand	Anodyne	VCP	48	38
COCCCNC(=O)[C@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443011	GD	On-Demand	Anodyne	HTR1A	17	40
COCCCNC(=O)[C@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443011	GD	On-Demand	Anodyne	HTR2A	17	40
COCCCNC(=O)[C@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443011	GD	On-Demand	Anodyne	DRD3	51	40
COCCCNC(=O)[C@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443011	GD	On-Demand	Anodyne	P2RY12	86	38
COCCCNC(=O)[C@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443011	GD	On-Demand	Anodyne	PRNP	48	37
COCCCNC(=O)[C@@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443012	GD	On-Demand	Anodyne	HTR1A	17	40
COCCCNC(=O)[C@@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443012	GD	On-Demand	Anodyne	HTR2A	17	40
COCCCNC(=O)[C@@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443012	GD	On-Demand	Anodyne	DRD3	51	40
COCCCNC(=O)[C@@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443012	GD	On-Demand	Anodyne	P2RY12	86	38
COCCCNC(=O)[C@@H](C)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443012	GD	On-Demand	Anodyne	PRNP	48	37
N#Cc1cccc(OC2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872443023	EF	On-Demand	Mild	HRH1	17	51
N#Cc1cccc(OC2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872443023	EF	On-Demand	Mild	DCK	15	42
N#Cc1cccc(OC2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872443023	EF	On-Demand	Mild	CCR3	20	51
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872443055	ED	On-Demand	Mild	SLC6A1	50	34
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872443055	ED	On-Demand	Mild	EPHX2	18	42
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872443056	ED	On-Demand	Mild	SLC6A1	50	34
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872443056	ED	On-Demand	Mild	EPHX2	18	42
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872443087	GF	On-Demand	Anodyne	GPBAR1	19	40
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872443089	GF	On-Demand	Anodyne	GPBAR1	19	40
CCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443098	GD	On-Demand	Anodyne	PKM	53	43
CCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443098	GD	On-Demand	Anodyne	NOD2	17	40
CCOC(=O)N1CCCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872443134	GD	On-Demand	Anodyne	TGM2	44	45
CCOC(=O)N1CCCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872443134	GD	On-Demand	Anodyne	F13A1	53	45
COc1cccc([C@@H](C)N2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872443139	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)N2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872443141	GE	On-Demand	Anodyne	DRD4	41	32
Cc1c(F)ncnc1N1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000872443147	DF	On-Demand	Mild	PDE3A	38	53
Cc1c(F)ncnc1N1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000872443147	DF	On-Demand	Mild	DCK	50	52
Cc1c(F)ncnc1N1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000872443147	DF	On-Demand	Mild	PDE3B	44	53
O=C(CNS(=O)(=O)c1cccc(Br)n1)NC1CCCCC1	ZINC000872443153	GD	On-Demand	Anodyne	EPHX2	17	42
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872443155	EG	On-Demand	Anodyne	GRM5	19	43
Cc1c(F)ncnc1N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000872443155	EG	On-Demand	Anodyne	ETHR	52	48
Cn1ncc2c(N3CCC(Nc4cccnn4)CC3)nc(Cl)nc21	ZINC000872443156	ED	On-Demand	Anodyne	PRKD1	43	34
N#CC1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872443160	FF	On-Demand	Mild	PKM	16	40
c1ccc(-c2cc(Nc3cnn(CCN4CCOCC4)c3)ncn2)cc1	ZINC000872443166	FE	On-Demand	Anodyne	MAPK10	16	41
OCCN1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872443174	EE	On-Demand	Anodyne	HTR1A	17	51
NC(=O)c1cc(Oc2ccc(C(=O)N3CCCC3)cc2)nc(Cl)n1	ZINC000872443189	EE	On-Demand	Anodyne	L3MBTL3	52	37
NC(=O)[C@@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872443195	CD	On-Demand	Anodyne	VCP	50	35
NC(=O)[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872443196	CD	On-Demand	Anodyne	VCP	50	35
N#CCCCCNc1ccnc2ncccc12	ZINC000872443211	BF	On-Demand	Mild	HNMT	52	40
C#CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443238	ED	On-Demand	Mild	PRNP	44	34
C#CCNC(=O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443238	ED	On-Demand	Mild	SLC27A1	54	35
COc1ccnc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)c1	ZINC000872443253	EF	On-Demand	Anodyne	HRH4	16	67
COc1ccnc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)c1	ZINC000872443253	EF	On-Demand	Anodyne	EBP	21	41
COc1ccnc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)c1	ZINC000872443253	EF	On-Demand	Anodyne	SORD	42	39
C#CCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872443262	ED	On-Demand	Mild	EPHX2	46	58
C#CCNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872443262	ED	On-Demand	Mild	TRPV4	45	37
Cc1c(F)ncnc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000872443268	EE	On-Demand	Anodyne	SIGMAR1	21	42
Cc1c(F)ncnc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000872443268	EE	On-Demand	Anodyne	ABCC1	86	37
Cc1c(F)ncnc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000872443268	EE	On-Demand	Anodyne	ABCB1A	47	37
CN(C)CCOc1ccc(CCNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872443271	FD	On-Demand	Anodyne	PTGDR	23	43
Cc1ccc(S(=O)(=O)N2CCN(CC(F)F)CC2)c(C#N)c1	ZINC000872443288	ED	On-Demand	Mild	TRPV4	47	40
C#CCNC(=O)C1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872443294	GC	On-Demand	Mild	EPHX2	43	43
CN(CCN1CCN(c2nc(N)nc(C(F)F)n2)CC1)Cc1ccccc1	ZINC000872443337	GD	On-Demand	Anodyne	HTR7	20	41
CN(CCN1CCN(c2nc(N)nc(C(F)F)n2)CC1)Cc1ccccc1	ZINC000872443337	GD	On-Demand	Anodyne	SIGMAR1	20	40
CN(CCN1CCN(c2nc(N)nc(C(F)F)n2)CC1)Cc1ccccc1	ZINC000872443337	GD	On-Demand	Anodyne	HRH4	24	41
CCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872443372	FC	On-Demand	Mild	TRPV4	48	40
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCC1	ZINC000872443401	FE	On-Demand	Anodyne	LEF	29	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCOCC1	ZINC000872443402	DE	On-Demand	Anodyne	PKM	52	44
COCCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872443413	FF	On-Demand	Anodyne	PKM	38	48
CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872443423	GD	On-Demand	Anodyne	GPBAR1	19	40
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872443424	GD	On-Demand	Anodyne	GPBAR1	19	40
CCC(=O)c1c(Cl)cccc1NCC1CCN(C(C)=O)CC1	ZINC000872443431	DH	On-Demand	Anodyne	GRIN2B	26	40
CCC(=O)c1c(Cl)cccc1NCC1CCN(C(C)=O)CC1	ZINC000872443431	DH	On-Demand	Anodyne	CACNA1I	50	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(CC(F)F)CC1	ZINC000872443459	ED	On-Demand	Mild	PKM	21	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC(F)F)CC1	ZINC000872443465	FE	On-Demand	Anodyne	PKM	51	42
CN1CCO[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872443524	GD	On-Demand	Anodyne	PKM	34	45
CN1CCO[C@@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872443525	GD	On-Demand	Anodyne	PKM	34	45
N#CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443539	DF	On-Demand	Mild	PKM	41	38
Cc1c(F)ncnc1N1CC[C@@H](c2cccc(F)c2)C1	ZINC000872443543	CG	On-Demand	Anodyne	PDE3A	34	40
Cc1c(F)ncnc1N1CC[C@@H](c2cccc(F)c2)C1	ZINC000872443543	CG	On-Demand	Anodyne	CCR5	46	32
Cc1c(F)ncnc1N1CC[C@H](c2cccc(F)c2)C1	ZINC000872443544	CG	On-Demand	Anodyne	PDE3A	34	40
Cc1c(F)ncnc1N1CC[C@H](c2cccc(F)c2)C1	ZINC000872443544	CG	On-Demand	Anodyne	CCR5	46	32
CCN(CC)C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443558	GG	On-Demand	Anodyne	CHRM5	18	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA2	69	55
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA1	53	45
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA7	25	45
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA5B	51	45
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA4	76	55
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA5A	59	45
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	CA12	28	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	MTCA1	44	33
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Sc2ccccc2)c1	ZINC000872443577	HH	On-Demand	Anodyne	P96878_MYCTU	41	37
C[C@@H](CC#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872443589	EE	On-Demand	Mild	PKM	39	46
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCCC1	ZINC000872443612	FE	On-Demand	Anodyne	EPHX2	17	40
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NC1CCCCC1	ZINC000872443612	FE	On-Demand	Anodyne	LEF	27	42
C#CCNC(=O)C1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872443613	ED	On-Demand	Mild	EPHX2	43	50
c1ccc(-c2cc(N3CCC(Nc4cccnn4)CC3)ncn2)cc1	ZINC000872443642	EG	On-Demand	Anodyne	PRKD1	46	34
CCOC(=O)N1CCCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872443659	FD	On-Demand	Mild	TGM2	41	43
CCOC(=O)N1CCCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872443659	FD	On-Demand	Mild	F13A1	51	43
COc1ccc(OC)c2sc(NCC3CCN(C(C)=O)CC3)nc12	ZINC000872443684	EF	On-Demand	Anodyne	GRIN2B	25	41
COc1ccc(OC)c2sc(NCC3CCN(C(C)=O)CC3)nc12	ZINC000872443684	EF	On-Demand	Anodyne	ADORA2B	20	44
COc1ccc(OC)c2sc(NCC3CCN(C(C)=O)CC3)nc12	ZINC000872443684	EF	On-Demand	Anodyne	NPY5R	22	48
CCS(=O)(=O)N1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872443735	FC	On-Demand	Mild	PKM	21	40
COCC[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872443742	DE	On-Demand	Anodyne	LEF	38	40
COCC[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872443743	DE	On-Demand	Anodyne	LEF	38	40
CN1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872443744	DD	On-Demand	Anodyne	ADRA1D	18	41
CN1C[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872443745	DD	On-Demand	Anodyne	ADRA1D	18	41
Cc1c(F)ncnc1N1CCN(C[C@H](O)c2ccccc2)[C@@H](C)C1	ZINC000872443781	EE	On-Demand	Anodyne	LIMK2	49	41
Cc1c(F)ncnc1N1CCN(C[C@H](O)c2ccccc2)[C@H](C)C1	ZINC000872443782	EE	On-Demand	Anodyne	LIMK2	49	41
Cc1c(F)ncnc1N1CCN(C[C@@H](O)c2ccccc2)[C@H](C)C1	ZINC000872443783	EE	On-Demand	Anodyne	LIMK2	49	41
Cc1c(F)ncnc1N1CCN(C[C@@H](O)c2ccccc2)[C@@H](C)C1	ZINC000872443784	EE	On-Demand	Anodyne	LIMK2	49	41
C[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872443785	EF	On-Demand	Anodyne	PKM	24	43
C[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872443786	EF	On-Demand	Anodyne	PKM	24	43
Cc1c(F)ncnc1N1CCN(CCn2ccccc2=O)CC1	ZINC000872443818	DC	On-Demand	Anodyne	ABCC1	73	34
Cc1c(F)ncnc1N1CCN(CCn2ccccc2=O)CC1	ZINC000872443818	DC	On-Demand	Anodyne	RPS6KB1	46	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3CCOCC3)cc2N1	ZINC000872443823	FE	On-Demand	Anodyne	PKM	34	44
O[C@@H](CN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872443834	EE	On-Demand	Anodyne	HTR1A	20	49
O[C@@H](CN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872443834	EE	On-Demand	Anodyne	ABCB1	37	41
O[C@H](CN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872443835	EE	On-Demand	Anodyne	HTR1A	20	49
O[C@H](CN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1	ZINC000872443835	EE	On-Demand	Anodyne	ABCB1	37	41
NC(=O)c1cc(N2CCN(Cc3cnn(-c4ccccc4)c3)CC2)nc(Cl)n1	ZINC000872443880	GD	On-Demand	Anodyne	DRD4	26	57
O=C([C@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCCC1	ZINC000872443894	GE	On-Demand	Anodyne	WNT3	42	30
O=C([C@@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCCC1	ZINC000872443895	GE	On-Demand	Anodyne	WNT3	42	30
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(OC2CCCC2)CC1	ZINC000872443901	GH	On-Demand	Anodyne	PKM	43	38
O=C(CNS(=O)(=O)CC1CC2(CCC2)C1)Nc1cccnc1	ZINC000872443915	DD	On-Demand	Anodyne	NAMPT	48	39
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443921	GG	On-Demand	Anodyne	ADRA1D	24	40
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443921	GG	On-Demand	Anodyne	ADRA1A	17	40
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443921	GG	On-Demand	Anodyne	ADRA1B	18	40
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443921	GG	On-Demand	Anodyne	SFRP1	72	34
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872443921	GG	On-Demand	Anodyne	WNT3	43	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCSCC3)cc2N1	ZINC000872443928	FF	On-Demand	Anodyne	PKM	36	46
O=c1ccccn1CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443982	FE	On-Demand	Anodyne	HTR1A	36	40
O=c1ccccn1CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443982	FE	On-Demand	Anodyne	DRD4	31	44
O=c1ccccn1CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443982	FE	On-Demand	Anodyne	ADRA1D	24	40
O=c1ccccn1CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443982	FE	On-Demand	Anodyne	ADRA1A	16	40
O=c1ccccn1CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872443982	FE	On-Demand	Anodyne	ADRA1B	19	40
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000872443983	GE	On-Demand	Mild	CACNA1I	48	33
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000872443984	GE	On-Demand	Mild	CACNA1I	48	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000872443999	GE	On-Demand	Mild	EPHX2	36	47
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000872444000	GE	On-Demand	Mild	EPHX2	36	47
COc1ccc(OC)c2sc(NC3CCN(CCO)CC3)nc12	ZINC000872444016	EE	On-Demand	Anodyne	HTR4	20	41
COc1ccc(OC)c2sc(NC3CCN(CCO)CC3)nc12	ZINC000872444016	EE	On-Demand	Anodyne	SSTR5	44	45
COc1ccc(OC)c2sc(NC3CCN(CCO)CC3)nc12	ZINC000872444016	EE	On-Demand	Anodyne	EHMT2	64	35
CCOCCN1CCN(c2ncnc(F)c2C)CC1	ZINC000872444020	CD	On-Demand	Anodyne	ABCC1	49	33
Cc1ccc(S(=O)(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444030	GE	On-Demand	Mild	EPHX2	22	47
Cc1ccc(S(=O)(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444030	GE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444030	GE	On-Demand	Mild	CACNA1I	51	35
Cc1ccc(S(=O)(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444031	GE	On-Demand	Mild	EPHX2	22	47
Cc1ccc(S(=O)(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444031	GE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872444031	GE	On-Demand	Mild	CACNA1I	51	35
Oc1nnc(Cl)cc1N1CCN(Cc2cnn(-c3ccccc3)c2)CC1	ZINC000872444084	FE	On-Demand	Anodyne	DRD2	18	63
Oc1nnc(Cl)cc1N1CCN(Cc2cnn(-c3ccccc3)c2)CC1	ZINC000872444084	FE	On-Demand	Anodyne	DRD4	48	63
Oc1nnc(Cl)cc1N1CCN(Cc2cnn(-c3ccccc3)c2)CC1	ZINC000872444084	FE	On-Demand	Anodyne	DRD3	15	63
CCN1CCC[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872444088	GF	On-Demand	Anodyne	PKM	29	43
CCN1CCC[C@@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872444089	GF	On-Demand	Anodyne	PKM	29	43
Cc1ccc(S(=O)(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)c(C#N)c1	ZINC000872444102	GE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)c(C#N)c1	ZINC000872444103	GE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)c(C#N)c1	ZINC000872444104	GE	On-Demand	Mild	TRPV4	44	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccnn2)CC1	ZINC000872444143	FE	On-Demand	Anodyne	PKM	47	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccnn2)CC1	ZINC000872444143	FE	On-Demand	Anodyne	GCK	42	36
N#CCN1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872444159	GD	On-Demand	Mild	PKM	19	40
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	HTR1A	88	45
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	DRD2	62	45
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	DRD4	46	40
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	HTR1B	44	42
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	HTR2A	35	45
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	DRD3	37	42
O=c1ccccn1CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444184	ED	On-Demand	Anodyne	HTR7	50	42
Oc1nnc(Cl)cc1NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872444194	FF	On-Demand	Anodyne	SLC6A3	15	40
Oc1nnc(Cl)cc1NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872444194	FF	On-Demand	Anodyne	GRIN2B	18	47
Oc1nnc(Cl)cc1NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872444195	FF	On-Demand	Anodyne	SLC6A3	15	40
Oc1nnc(Cl)cc1NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872444195	FF	On-Demand	Anodyne	GRIN2B	18	47
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444209	CF	On-Demand	Anodyne	PKM	44	39
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444209	CF	On-Demand	Anodyne	GCKR	40	31
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444210	CF	On-Demand	Anodyne	PKM	44	39
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444210	CF	On-Demand	Anodyne	GCKR	40	31
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	HTR1A	46	39
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	DRD2	44	43
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	DRD4	42	43
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	HRH1	18	42
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	DRD3	45	43
CCOCCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872444211	DE	On-Demand	Anodyne	SIGMAR1	22	40
CCOC(=O)C1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872444235	FE	On-Demand	Mild	CCR8	59	36
CCN(C(C)C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872444274	EG	On-Demand	Anodyne	PKM	35	42
CCOC(=O)C1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872444307	FE	On-Demand	Mild	CCR8	78	39
C[C@H](O)CN1CCN(c2ccnc3ncccc23)C[C@H]1C	ZINC000872444318	CD	On-Demand	Anodyne	SORD	75	35
C[C@H](O)CN1CCN(c2ccnc3ncccc23)C[C@@H]1C	ZINC000872444320	CD	On-Demand	Anodyne	SORD	75	35
C[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)C[C@H]1C	ZINC000872444333	DE	On-Demand	Anodyne	SORD	65	39
C[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)C[C@@H]1C	ZINC000872444334	DE	On-Demand	Anodyne	SORD	65	39
C[C@H]1CN(c2cc(-c3ccccc3)ncn2)CCN1C[C@@H](C)O	ZINC000872444336	DE	On-Demand	Anodyne	SORD	65	39
COCC[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872444337	FE	On-Demand	Anodyne	PKM	38	45
COCC[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872444338	FE	On-Demand	Anodyne	PKM	38	45
O=S(=O)(NCC1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872444339	DE	On-Demand	Anodyne	LEF	21	42
CC[C@H](C)NC(=O)[C@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444395	GF	On-Demand	Anodyne	ITGA4	26	46
CC[C@H](C)NC(=O)[C@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444395	GF	On-Demand	Anodyne	MMP1	20	45
CC[C@H](C)NC(=O)[C@@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444397	GF	On-Demand	Anodyne	ITGA4	26	46
CC[C@H](C)NC(=O)[C@@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444397	GF	On-Demand	Anodyne	MMP1	20	45
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872444446	CE	On-Demand	Mild	CASP3	70	40
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872444446	CE	On-Demand	Mild	CASP7	85	41
CC[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872444448	CE	On-Demand	Mild	CASP3	70	40
CC[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872444448	CE	On-Demand	Mild	CASP7	85	41
O=C(Nc1ccc(CNS(=O)(=O)CC2CC3(CCC3)C2)cc1)c1cccnc1	ZINC000872444478	GG	On-Demand	Anodyne	NAMPT	78	46
O=c1ccccn1CCN1CCN(c2ccncc2C2CC2)CC1	ZINC000872444480	DD	On-Demand	Anodyne	HTR1A	50	47
O=c1ccccn1CCN1CCN(c2ccncc2C2CC2)CC1	ZINC000872444480	DD	On-Demand	Anodyne	ADRA1D	22	47
O=c1ccccn1CCN1CCN(c2ccncc2C2CC2)CC1	ZINC000872444480	DD	On-Demand	Anodyne	ADRA1A	19	47
O=c1ccccn1CCN1CCN(c2ccncc2C2CC2)CC1	ZINC000872444480	DD	On-Demand	Anodyne	ADRA1B	20	47
Cc1c(F)ncnc1NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872444516	EF	On-Demand	Anodyne	SLC6A3	19	40
Cc1c(F)ncnc1NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000872444516	EF	On-Demand	Anodyne	GRIN2B	25	44
Cc1c(F)ncnc1NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872444517	EF	On-Demand	Anodyne	SLC6A3	19	40
Cc1c(F)ncnc1NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000872444517	EF	On-Demand	Anodyne	GRIN2B	25	44
CC[C@@](C)(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872444556	EE	On-Demand	Anodyne	LEF	34	40
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872444573	GE	On-Demand	Mild	EPHX2	15	42
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872444573	GE	On-Demand	Mild	CCR8	104	44
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872444573	GE	On-Demand	Mild	SFRP1	128	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000872444573	GE	On-Demand	Mild	WNT3	86	41
Cc1nc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)c2cnn(C)c2n1	ZINC000872444585	GE	On-Demand	Anodyne	HRH4	19	57
O=C(CNS(=O)(=O)CC1CC2(CCC2)C1)N1CCc2ccccc2C1	ZINC000872444587	FE	On-Demand	Anodyne	DPP8	15	43
CCOC(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872444606	FE	On-Demand	Mild	EPHX2	24	42
CCOC(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872444606	FE	On-Demand	Mild	TRPV4	46	38
NC(=O)[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444641	GD	On-Demand	Anodyne	HTR2A	23	41
NC(=O)[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444641	GD	On-Demand	Anodyne	SLC6A1	123	38
NC(=O)[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444641	GD	On-Demand	Anodyne	HTR7	37	41
NC(=O)[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444641	GD	On-Demand	Anodyne	HTR6	17	41
CN1C[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872444652	FD	On-Demand	Anodyne	PKM	36	45
CN1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872444655	FD	On-Demand	Anodyne	PKM	36	45
Cc1ccc(S(=O)(=O)N2CCN(CC#N)CC2)c(C#N)c1	ZINC000872444661	DC	On-Demand	Mild	TRPV4	46	38
C[C@H](O)CN1CCN(c2ccncc2C2CC2)C[C@H]1C	ZINC000872444670	CD	On-Demand	Anodyne	SORD	40	35
O=S1(=O)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872444673	ED	On-Demand	Anodyne	PKM	48	40
C[C@H](O)CN1CCN(c2ccncc2C2CC2)C[C@@H]1C	ZINC000872444674	CD	On-Demand	Anodyne	SORD	40	35
CCOC[C@H](O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872444711	DD	On-Demand	Anodyne	ABCB1	44	36
CCOC[C@H](O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872444718	DD	On-Demand	Anodyne	ABCB1	70	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(C2OCCO2)CC1	ZINC000872444749	FF	On-Demand	Anodyne	PKM	51	42
Cc1cccc(C#N)c1S(=O)(=O)N(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000872444790	GF	On-Demand	Mild	CCR5	15	40
Cc1cccc(C#N)c1S(=O)(=O)N(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000872444790	GF	On-Demand	Mild	L3MBTL3	50	38
Cc1ccc(S(=O)(=O)N2CSC[C@H]2C(=O)NCC2CC2)c(C#N)c1	ZINC000872444804	FD	On-Demand	Mild	TRPV4	40	32
Cc1ccc(S(=O)(=O)N2CSC[C@@H]2C(=O)NCC2CC2)c(C#N)c1	ZINC000872444806	FD	On-Demand	Mild	TRPV4	40	32
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444813	DG	On-Demand	Anodyne	CASP3	113	46
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444813	DG	On-Demand	Anodyne	APP	30	40
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444813	DG	On-Demand	Anodyne	CASP7	127	46
CC[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444814	DG	On-Demand	Anodyne	CASP3	113	46
CC[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444814	DG	On-Demand	Anodyne	APP	30	40
CC[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444814	DG	On-Demand	Anodyne	CASP7	127	46
CC(C)(C)C(=O)NCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872444815	FE	On-Demand	Anodyne	LEF	33	42
NC(=O)[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444822	GD	On-Demand	Anodyne	HTR2A	23	41
NC(=O)[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444822	GD	On-Demand	Anodyne	SLC6A1	123	38
NC(=O)[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444822	GD	On-Demand	Anodyne	HTR7	37	41
NC(=O)[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444822	GD	On-Demand	Anodyne	HTR6	17	41
Cn1cc(CN2CCCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872444854	DE	On-Demand	Anodyne	DRD4	23	43
Cc1ccc(S(=O)(=O)N2CC[C@H](N3CCCC3)C2)c(C#N)c1	ZINC000872444877	DD	On-Demand	Mild	EPHX2	17	41
Cc1ccc(S(=O)(=O)N2CC[C@H](N3CCCC3)C2)c(C#N)c1	ZINC000872444877	DD	On-Demand	Mild	L3MBTL3	58	38
Cc1ccc(S(=O)(=O)N2CC[C@@H](N3CCCC3)C2)c(C#N)c1	ZINC000872444878	DD	On-Demand	Mild	EPHX2	17	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](N3CCCC3)C2)c(C#N)c1	ZINC000872444878	DD	On-Demand	Mild	L3MBTL3	58	38
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872444943	GF	On-Demand	Mild	EPHX2	25	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000872444943	GF	On-Demand	Mild	CACNA1I	53	35
N#CCN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872444958	ED	On-Demand	Mild	PKM	46	39
O=c1ccccn1CCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872444959	EC	On-Demand	Anodyne	HTR1A	74	40
O=c1ccccn1CCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872444959	EC	On-Demand	Anodyne	DRD2	51	40
O=c1ccccn1CCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872444959	EC	On-Demand	Anodyne	ADRA1D	44	38
O=c1ccccn1CCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872444959	EC	On-Demand	Anodyne	DRD3	58	36
O=c1ccccn1CCN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872444959	EC	On-Demand	Anodyne	HTR7	58	35
CN(C)[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872444998	DE	On-Demand	Anodyne	PKM	43	38
CO[C@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872445004	FE	On-Demand	Anodyne	PKM	19	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)C2)c(C#N)c1	ZINC000872445013	CD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)C2)c(C#N)c1	ZINC000872445013	CD	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@H](C)C2)c(C#N)c1	ZINC000872445015	CD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CC[C@H](C)C2)c(C#N)c1	ZINC000872445015	CD	On-Demand	Mild	TRPV4	42	35
COCC(C)(C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872445027	FE	On-Demand	Anodyne	PKM	39	47
O=C(Nc1ccc(CNS(=O)(=O)CC2CC3(CCC3)C2)cc1)c1ccncc1	ZINC000872445045	GG	On-Demand	Anodyne	NAMPT	30	40
CC[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872445051	CE	On-Demand	Mild	CASP3	68	35
CC[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872445051	CE	On-Demand	Mild	CASP7	78	35
CC[C@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872445052	CE	On-Demand	Mild	CASP3	68	35
CC[C@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872445052	CE	On-Demand	Mild	CASP7	78	35
Cc1c(F)ncnc1N1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000872445073	CC	On-Demand	Anodyne	LIMK2	54	34
Cc1c(F)ncnc1N1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000872445074	CC	On-Demand	Anodyne	LIMK2	54	34
Cc1c(F)ncnc1N1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000872445076	CC	On-Demand	Anodyne	LIMK2	54	34
Cc1c(F)ncnc1N1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000872445078	CC	On-Demand	Anodyne	LIMK2	54	34
CN(C1CCN(C(=O)c2ccccc2)CC1)S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872445117	GG	On-Demand	Anodyne	CCR5	16	43
CN(C1CCN(C(=O)c2ccccc2)CC1)S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872445117	GG	On-Demand	Anodyne	L3MBTL3	71	40
CC(C)(C)NC(=O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872445118	FE	On-Demand	Anodyne	TBXA2R	44	35
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	HTR1A	82	46
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	DRD2	67	46
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	DRD4	45	40
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	HTR2A	37	46
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	HRH1	16	41
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	DRD3	44	40
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	HTR7	46	38
CCOCCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872445145	CD	On-Demand	Anodyne	HNMT	44	33
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)OCC1CC1	ZINC000872445166	ED	On-Demand	Anodyne	LEF	29	40
c1ccc(-c2cc(N3CCC(Cc4ncc[nH]4)CC3)ncn2)cc1	ZINC000872445206	DG	On-Demand	Anodyne	HTR2B	22	56
CN(CCN1CCOCC1)S(=O)(=O)c1cccc(Br)n1	ZINC000872445211	FC	On-Demand	Anodyne	CASR	50	37
CCN(CC(=O)OC)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872445307	FD	On-Demand	Anodyne	PKM	36	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)Oc2ccccc2)CC1	ZINC000872445347	GF	On-Demand	Mild	FAAH	28	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)Oc2ccccc2)CC1	ZINC000872445347	GF	On-Demand	Mild	EPHX2	31	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445397	ED	On-Demand	Mild	CTSC	16	40
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445397	ED	On-Demand	Mild	CCR8	99	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445397	ED	On-Demand	Mild	SFRP1	116	35
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445397	ED	On-Demand	Mild	WNT3	77	35
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445398	ED	On-Demand	Mild	CTSC	16	40
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445398	ED	On-Demand	Mild	CCR8	99	41
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445398	ED	On-Demand	Mild	SFRP1	116	35
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445398	ED	On-Demand	Mild	WNT3	77	35
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872445404	DD	On-Demand	Mild	SLC6A1	58	35
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCc2ccccc2C1	ZINC000872445434	GF	On-Demand	Anodyne	HTR7	18	45
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCc2ccccc2C1	ZINC000872445434	GF	On-Demand	Anodyne	DPP8	21	43
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872445445	ED	On-Demand	Mild	CCR8	84	37
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872445445	ED	On-Demand	Mild	SFRP1	50	32
COC(=O)N1CCC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872445446	ED	On-Demand	Mild	CCR8	84	37
COC(=O)N1CCC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872445446	ED	On-Demand	Mild	SFRP1	50	32
CNC(=O)CCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872445467	FD	On-Demand	Anodyne	PKM	35	41
Oc1nnc(Cl)cc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445550	FD	On-Demand	Anodyne	ACOX1	85	39
Oc1nnc(Cl)cc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445550	FD	On-Demand	Anodyne	ABCB1	82	50
Oc1nnc(Cl)cc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445551	FD	On-Demand	Anodyne	ACOX1	85	39
Oc1nnc(Cl)cc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445551	FD	On-Demand	Anodyne	ABCB1	82	50
CCOC[C@H](O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872445552	CC	On-Demand	Anodyne	ABCB1	44	34
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](N2CCCC2)C1	ZINC000872445570	DD	On-Demand	Mild	L3MBTL3	58	38
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000872445571	DD	On-Demand	Mild	L3MBTL3	58	38
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445586	DD	On-Demand	Mild	EPHX2	24	43
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872445586	DD	On-Demand	Mild	TRPV4	43	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](N2CCCC2)C1	ZINC000872445591	EF	On-Demand	Anodyne	L3MBTL3	56	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](N2CCCC2)C1	ZINC000872445592	EF	On-Demand	Anodyne	L3MBTL3	56	45
O=S(=O)(c1cccc(Br)n1)N1CC[C@@H](N2CCCC2)C1	ZINC000872445629	FD	On-Demand	Anodyne	L3MBTL3	55	38
O=S(=O)(c1cccc(Br)n1)N1CC[C@H](N2CCCC2)C1	ZINC000872445630	FD	On-Demand	Anodyne	L3MBTL3	55	38
CC[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872445723	DE	On-Demand	Anodyne	CASP3	72	35
CC[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872445723	DE	On-Demand	Anodyne	CASP7	81	37
CC[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872445724	DE	On-Demand	Anodyne	CASP3	72	35
CC[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872445724	DE	On-Demand	Anodyne	CASP7	81	37
COc1cc(C)nc(N2CCN(c3ccnc4ncccc34)CC2)n1	ZINC000872445803	EE	On-Demand	Anodyne	SORD	22	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445827	GD	On-Demand	Anodyne	CCR8	83	36
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445827	GD	On-Demand	Anodyne	SFRP1	79	33
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445827	GD	On-Demand	Anodyne	WNT3	58	32
COC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445828	GD	On-Demand	Anodyne	CCR8	83	36
COC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445828	GD	On-Demand	Anodyne	SFRP1	79	33
COC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872445828	GD	On-Demand	Anodyne	WNT3	58	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)OC(C)(C)C)CC1	ZINC000872445875	FF	On-Demand	Mild	EPHX2	29	43
Cc1csc([C@H](C)NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872445877	GG	On-Demand	Anodyne	PKM	39	47
O=C(NC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)Oc1ccccc1	ZINC000872445890	GG	On-Demand	Anodyne	FAAH	27	42
Cc1c(F)ncnc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445908	ED	On-Demand	Anodyne	ADRB2	26	44
Cc1c(F)ncnc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445908	ED	On-Demand	Anodyne	ADRB1	25	44
Cc1c(F)ncnc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445908	ED	On-Demand	Anodyne	ADRB3	23	44
Cc1c(F)ncnc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445908	ED	On-Demand	Anodyne	ACOX1	81	39
Cc1c(F)ncnc1N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000872445908	ED	On-Demand	Anodyne	ABCB1	83	50
Cc1c(F)ncnc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445909	ED	On-Demand	Anodyne	ADRB2	26	44
Cc1c(F)ncnc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445909	ED	On-Demand	Anodyne	ADRB1	25	44
Cc1c(F)ncnc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445909	ED	On-Demand	Anodyne	ADRB3	23	44
Cc1c(F)ncnc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445909	ED	On-Demand	Anodyne	ACOX1	81	39
Cc1c(F)ncnc1N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000872445909	ED	On-Demand	Anodyne	ABCB1	83	50
CCOC[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872445939	ED	On-Demand	Anodyne	ACOX1	74	39
CCOC[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872445939	ED	On-Demand	Anodyne	ABCB1	68	39
CCOC[C@H](O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872445942	DC	On-Demand	Anodyne	ABCB1	41	36
CCCn1cc(CN2CCCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872445992	FF	On-Demand	Anodyne	DRD4	18	41
Cn1cc(CN2CCCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872445995	EF	On-Demand	Anodyne	DRD2	15	42
Cn1cc(CN2CCCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872445995	EF	On-Demand	Anodyne	DRD4	26	42
Cn1cc(CN2CCCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872445995	EF	On-Demand	Anodyne	DRD3	17	42
NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872446002	FD	On-Demand	Anodyne	PKM	46	42
NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872446002	FD	On-Demand	Anodyne	TGM2	52	37
NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872446002	FD	On-Demand	Anodyne	GCK	47	34
NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872446002	FD	On-Demand	Anodyne	F13A1	58	37
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	ADRA1D	28	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	ADRA1A	20	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	ADRA1B	22	41
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	CCR8	43	32
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	SFRP1	124	37
COC(=O)N1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446006	FE	On-Demand	Anodyne	WNT3	87	36
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	ADRA1D	28	41
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	ADRA1A	20	41
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	ADRA1B	22	41
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	CCR8	43	32
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	SFRP1	124	37
COC(=O)N1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446007	FE	On-Demand	Anodyne	WNT3	87	36
C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446035	GF	On-Demand	Anodyne	F2	17	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446035	GF	On-Demand	Anodyne	LEF	33	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446035	GF	On-Demand	Anodyne	WNT3	41	34
CO[C@@H](C)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446048	FE	On-Demand	Anodyne	PKM	39	48
COCC(C)(C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446078	DE	On-Demand	Anodyne	LEF	31	40
COC(=O)CN(CC(=O)OC)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446088	FD	On-Demand	Anodyne	MMP2	15	41
COC(=O)CN(CC(=O)OC)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446088	FD	On-Demand	Anodyne	MMP8	29	41
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)N(C)C1CC1	ZINC000872446105	GE	On-Demand	Anodyne	PKM	38	45
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)N(C)C1CC1	ZINC000872446106	GE	On-Demand	Anodyne	PKM	38	45
Cc1c(F)ncnc1N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000872446177	ED	On-Demand	Anodyne	SMO	15	52
O=C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1	ZINC000872446262	DD	On-Demand	Anodyne	PKM	43	37
C[C@@H](Cn1cncn1)NS(=O)(=O)c1cccc(Br)n1	ZINC000872446275	EC	On-Demand	Anodyne	HIS3	72	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872446289	GF	On-Demand	Mild	TRPV4	41	34
Cc1ccc(S(=O)(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872446290	GF	On-Demand	Mild	TRPV4	41	34
Cn1ncc2c(N[C@@H]3CCCOC3)nc(Cl)nc21	ZINC000872446306	CD	On-Demand	Anodyne	Q4VQ11_PIG	62	42
Cn1ncc2c(N[C@H]3CCCOC3)nc(Cl)nc21	ZINC000872446307	CD	On-Demand	Anodyne	Q4VQ11_PIG	62	42
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCO1	ZINC000872446328	DF	On-Demand	Anodyne	PKM	43	38
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCO1	ZINC000872446330	DF	On-Demand	Anodyne	PKM	43	38
Cn1cc(CN2CCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872446336	EE	On-Demand	Anodyne	DRD2	22	45
Cn1cc(CN2CCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872446336	EE	On-Demand	Anodyne	DRD4	38	45
Cn1cc(CN2CCN(c3cc(-c4ccccc4)ncn3)CC2)cn1	ZINC000872446336	EE	On-Demand	Anodyne	DRD3	22	45
CN(C)[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872446356	FD	On-Demand	Anodyne	PKM	23	41
Cc1ccc(S(=O)(=O)N2CCS(=O)(=O)CC2)c(C#N)c1	ZINC000872446377	DC	On-Demand	Mild	TRPV4	45	37
COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872446394	DC	On-Demand	Mild	TRPV4	42	34
COC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872446396	DC	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCNC(=O)CC2)c(C#N)c1	ZINC000872446399	CC	On-Demand	Mild	TRPV4	43	37
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCO1	ZINC000872446441	FE	On-Demand	Anodyne	PKM	20	40
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCO1	ZINC000872446442	FE	On-Demand	Anodyne	PKM	20	40
Cc1nn(C)cc1[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446443	GF	On-Demand	Anodyne	PKM	35	44
Cc1nn(C)cc1[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446448	GF	On-Demand	Anodyne	PKM	35	44
O[C@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446460	FE	On-Demand	Anodyne	ADRB2	17	48
O[C@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446460	FE	On-Demand	Anodyne	DRD4	24	51
O[C@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446460	FE	On-Demand	Anodyne	ACOX1	67	36
O[C@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446460	FE	On-Demand	Anodyne	ABCB1	85	51
O[C@@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446462	FE	On-Demand	Anodyne	ADRB2	17	48
O[C@@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446462	FE	On-Demand	Anodyne	DRD4	24	51
O[C@@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446462	FE	On-Demand	Anodyne	ACOX1	67	36
O[C@@H](COc1ccccc1)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872446462	FE	On-Demand	Anodyne	ABCB1	85	51
Cc1cccc2c1CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C2	ZINC000872446509	EE	On-Demand	Anodyne	AKR1C3	50	39
Cc1cccc2c1CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C2	ZINC000872446510	EE	On-Demand	Anodyne	AKR1C3	50	39
CC(C)(C)C(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872446511	EG	On-Demand	Anodyne	HRH4	17	48
CC(C)(C)C(=O)N[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872446511	EG	On-Demand	Anodyne	PDPK1	20	46
CC(C)(C)C(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872446512	EG	On-Demand	Anodyne	HRH4	17	48
CC(C)(C)C(=O)N[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872446512	EG	On-Demand	Anodyne	PDPK1	20	46
N#C[C@@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872446545	CD	On-Demand	Mild	STK3	22	48
N#C[C@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872446546	CD	On-Demand	Mild	STK3	22	48
Cc1cccc(C#N)c1S(=O)(=O)Oc1ccc(C(=O)N2CCCC2)cc1	ZINC000872446583	FF	On-Demand	Mild	L3MBTL3	59	34
O=C1CCC(=O)N1CCCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872446605	EF	On-Demand	Anodyne	HRP1_PLAFA	56	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C1CC1	ZINC000872446619	DG	On-Demand	Anodyne	CASP3	57	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C1CC1	ZINC000872446619	DG	On-Demand	Anodyne	CASP7	72	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C1CC1	ZINC000872446620	DG	On-Demand	Anodyne	CASP3	57	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C1CC1	ZINC000872446620	DG	On-Demand	Anodyne	CASP7	72	37
O=C1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCN1	ZINC000872446634	FD	On-Demand	Anodyne	PKM	23	42
C[C@@H](Cn1cncn1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446637	ED	On-Demand	Anodyne	HIS3	77	34
N#CCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446649	FF	On-Demand	Mild	PKM	37	46
O=C1CCC(=O)N1CCCNc1cc(Cl)nnc1O	ZINC000872446660	CC	On-Demand	Anodyne	HRP1_PLAFA	58	35
COc1ccnc(N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)c1	ZINC000872446664	FD	On-Demand	Mild	TRPV4	45	36
CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872446686	EE	On-Demand	Anodyne	SLC27A4	42	31
CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872446687	EE	On-Demand	Anodyne	SLC27A4	42	31
O=C1OCCN1CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872446699	FD	On-Demand	Anodyne	HTR7	28	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	ACE	26	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CELA1	16	55
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	MME	45	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	ANPEP	50	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CASP3	19	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	BMP1	19	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	KLK3	91	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CTSB	73	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	PAPA1_CARPA	84	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CYSP_TRYCR	60	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CTSK	43	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CTSL	50	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	PGA	25	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CAPNS1	73	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	HLA-DRB1	55	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	MMP11	67	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CTSS	20	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CAPN1	99	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CASP1	30	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CTRC	15	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CAPN2	146	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CASP6	22	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	CASP9	39	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	TPSAB1	23	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	NPR	87	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	PSMB5	47	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1	ZINC000872446725	HK	On-Demand	Anodyne	Q6PRC7_IXORI	44	40
C#CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872446760	FB	On-Demand	Mild	EPHX2	19	40
C#CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872446760	FB	On-Demand	Mild	TRPV4	47	38
COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872446813	FD	On-Demand	Anodyne	PROKR1	60	32
COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872446814	FD	On-Demand	Anodyne	PROKR1	60	32
CN1CC[C@H](CN(C)S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446836	EE	On-Demand	Anodyne	CCR5	23	40
CN1CC[C@@H](CN(C)S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872446837	EE	On-Demand	Anodyne	CCR5	23	40
Cc1ccc(S(=O)(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)c(C#N)c1	ZINC000872446842	FD	On-Demand	Mild	TRPV4	41	33
CC(=O)Nc1cccc(OCCNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872446843	FF	On-Demand	Anodyne	MTNR1A	27	41
CC(=O)Nc1cccc(OCCNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872446843	FF	On-Demand	Anodyne	MTNR1B	23	41
CC(=O)Nc1cccc(OCCNS(=O)(=O)CC2CC3(CCC3)C2)c1	ZINC000872446843	FF	On-Demand	Anodyne	EPHX2	20	41
O=C(c1ccc(OS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1)N1CCCC1	ZINC000872446853	GH	On-Demand	Anodyne	L3MBTL3	74	40
COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872446859	FE	On-Demand	Anodyne	TSHR	50	33
COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872446860	FE	On-Demand	Anodyne	TSHR	50	33
CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872446873	GD	On-Demand	Anodyne	PROKR1	60	33
CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872446874	GD	On-Demand	Anodyne	PROKR1	60	33
Cn1cc(CN2CCN(c3ccncc3C3CC3)CC2)cn1	ZINC000872446920	CE	On-Demand	Anodyne	DRD4	18	41
C[C@H]1C(=O)NCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446931	FD	On-Demand	Anodyne	PKM	22	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN3CCCC3)CC2)c(C#N)c1	ZINC000872446935	GC	On-Demand	Mild	TRPV4	46	36
Cn1cc(CN2CCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872446965	DD	On-Demand	Anodyne	HTR1A	19	42
Cn1cc(CN2CCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872446965	DD	On-Demand	Anodyne	DRD2	20	46
Cn1cc(CN2CCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872446965	DD	On-Demand	Anodyne	DRD4	32	46
Cn1cc(CN2CCN(c3ccnc4ncccc34)CC2)cn1	ZINC000872446965	DD	On-Demand	Anodyne	DRD3	19	46
C#CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872446976	GC	On-Demand	Mild	ADORA2B	41	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872446983	GF	On-Demand	Mild	HRH1	15	45
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000872446983	GF	On-Demand	Mild	CCR3	18	45
N#C[C@@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872446986	DF	On-Demand	Mild	STK3	22	49
N#C[C@@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872446986	DF	On-Demand	Mild	LRRK2	19	49
N#C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872446987	DF	On-Demand	Mild	STK3	22	49
N#C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872446987	DF	On-Demand	Mild	LRRK2	19	49
Cc1ncsc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872446998	GF	On-Demand	Anodyne	PKM	38	45
Cn1cc(CN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)cn1	ZINC000872447002	EC	On-Demand	Anodyne	IKBKB	41	40
Cc1ccccc1C1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872447031	EF	On-Demand	Anodyne	SCD1	19	40
C[C@@H]([C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1)N1CCOCC1	ZINC000872447053	FE	On-Demand	Anodyne	LEF	30	40
NC(=O)c1cc(N2CCC(CCO)CC2)nc(Cl)n1	ZINC000872447078	CC	On-Demand	Anodyne	SIRT3	58	35
NC(=O)c1cc(N2CCC(CCO)CC2)nc(Cl)n1	ZINC000872447078	CC	On-Demand	Anodyne	SIRT2	48	35
NC(=O)c1cc(N2CCC(CCO)CC2)nc(Cl)n1	ZINC000872447078	CC	On-Demand	Anodyne	SIRT1	45	32
Cc1ccc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872447093	FE	On-Demand	Mild	EPHX2	26	50
Cc1ccc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872447094	FE	On-Demand	Mild	EPHX2	26	50
CC(C)(C)OC(=O)NCc1cccc(Oc2cc(Cl)nnc2O)c1	ZINC000872447097	FH	On-Demand	Anodyne	PDS	68	37
N#CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447098	EE	On-Demand	Mild	SFRP1	111	38
N#CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447098	EE	On-Demand	Mild	WNT3	74	34
Cc1c(F)ncnc1N1CC[C@@H](c2ccccc2F)C1	ZINC000872447114	CG	On-Demand	Anodyne	DCK	46	39
Cc1c(F)ncnc1N1CC[C@H](c2ccccc2F)C1	ZINC000872447115	CG	On-Demand	Anodyne	DCK	46	39
CC(C)(C)C(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872447119	GG	On-Demand	Anodyne	SFRP1	40	34
CC(C)(C)C(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872447119	GG	On-Demand	Anodyne	GCKR	74	34
CC(C)(C)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872447120	GG	On-Demand	Anodyne	SFRP1	40	34
CC(C)(C)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872447120	GG	On-Demand	Anodyne	GCKR	74	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CC#N)CC1	ZINC000872447161	DD	On-Demand	Mild	CCR8	72	34
C=CCN1CCC(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872447162	GF	On-Demand	Mild	PKM	22	42
Cc1ccc(S(=O)(=O)N2CCN(Cc3cnn(C)c3)CC2)c(C#N)c1	ZINC000872447182	FD	On-Demand	Mild	ADORA2B	42	36
Cc1ccc(S(=O)(=O)N2CCN(Cc3cnn(C)c3)CC2)c(C#N)c1	ZINC000872447182	FD	On-Demand	Mild	TRPV4	40	33
Cc1c(F)ncnc1N1CCC([C@@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447236	EG	On-Demand	Anodyne	SIRT3	48	42
Cc1c(F)ncnc1N1CCC([C@@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447236	EG	On-Demand	Anodyne	SIRT2	42	42
Cc1c(F)ncnc1N1CCC([C@@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447236	EG	On-Demand	Anodyne	SIRT1	41	35
Cc1c(F)ncnc1N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447237	EG	On-Demand	Anodyne	SIRT3	48	42
Cc1c(F)ncnc1N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447237	EG	On-Demand	Anodyne	SIRT2	42	42
Cc1c(F)ncnc1N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1	ZINC000872447237	EG	On-Demand	Anodyne	SIRT1	41	35
COC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447279	FF	On-Demand	Anodyne	ADRA1D	30	42
COC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447279	FF	On-Demand	Anodyne	ADRA1A	21	42
COC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447279	FF	On-Demand	Anodyne	ADRA1B	23	42
COC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447279	FF	On-Demand	Anodyne	SFRP1	88	35
COC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447279	FF	On-Demand	Anodyne	WNT3	56	33
Cc1noc(C)c1CCNS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872447321	DE	On-Demand	Anodyne	ADAMTS4	27	40
O=C1CCCCN1CCCNc1ccnc2ncccc12	ZINC000872447323	CE	On-Demand	Anodyne	HRP1_PLAFA	117	47
O=C1CCCCN1CCCNc1ccnc2ncccc12	ZINC000872447323	CE	On-Demand	Anodyne	HNMT	92	49
O=C1CCCCN1CCCNc1cc(Cl)nnc1O	ZINC000872447333	CD	On-Demand	Anodyne	HRP1_PLAFA	61	41
CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872447350	GG	On-Demand	Anodyne	SFRP1	66	37
C=CCN1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872447387	DD	On-Demand	Mild	CCR8	74	35
CC(C)(C)OC(=O)N[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872447388	EG	On-Demand	Anodyne	PDPK1	20	52
Cc1c(F)ncnc1N[C@@H](C)CN1CCN(C)CC1	ZINC000872447405	CC	On-Demand	Anodyne	LPAR2	21	43
Cc1c(F)ncnc1N[C@H](C)CN1CCN(C)CC1	ZINC000872447406	CC	On-Demand	Anodyne	LPAR2	21	43
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HTR1A	81	57
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	DRD2	59	57
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	DRD4	45	38
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	ADRA1D	28	41
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HTR2A	71	57
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HTR2C	37	48
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	SLC6A4	17	51
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	ADRA1A	33	45
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	ADRA1B	17	45
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	DRD3	72	49
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HRP1_PLAFA	103	42
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HTR7	88	53
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HTR6	15	52
Oc1nnc(Cl)cc1NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872447411	GG	On-Demand	Anodyne	HNMT	59	41
Cc1c(F)ncnc1NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872447425	DF	On-Demand	Anodyne	GPR119	77	44
Cc1c(F)ncnc1NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872447426	DF	On-Demand	Anodyne	GPR119	77	44
Cc1ccc(S(=O)(=O)N2CCN(Cc3nccn3C)CC2)c(C#N)c1	ZINC000872447514	FD	On-Demand	Mild	TRPV4	42	35
NC(=O)c1cc(N[C@H]2CCN(c3ccccc3)C2)nc(Cl)n1	ZINC000872447540	DD	On-Demand	Anodyne	HRH4	33	41
NC(=O)c1cc(N[C@@H]2CCN(c3ccccc3)C2)nc(Cl)n1	ZINC000872447541	DD	On-Demand	Anodyne	HRH4	33	41
N#CCN1CCC(NS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872447548	FD	On-Demand	Mild	CTSC	16	43
O=S(=O)(CCNc1ccnc2ncccc12)N1CCSCC1	ZINC000872447553	ED	On-Demand	Anodyne	HRP1_PLAFA	69	36
COC(=O)CSCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447577	FD	On-Demand	Anodyne	TBXA2R	42	32
COC(=O)C1CCC(NS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872447592	ED	On-Demand	Mild	CCR8	54	33
COc1ccc(OC)c2sc(N[C@H](C)CN3CCN(C)CC3)nc12	ZINC000872447593	FE	On-Demand	Anodyne	ADORA2B	15	43
COc1ccc(OC)c2sc(N[C@@H](C)CN3CCN(C)CC3)nc12	ZINC000872447594	FE	On-Demand	Anodyne	ADORA2B	15	43
CC(C)(C)OC(=O)N1CC[C@H](CCNc2cc(Cl)nnc2O)C1	ZINC000872447595	EF	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNc2cc(Cl)nnc2O)C1	ZINC000872447596	EF	On-Demand	Anodyne	GPR119	39	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCCc2sccc2C1	ZINC000872447606	EG	On-Demand	Mild	AKR1C3	47	47
O=C1CCC(=O)N1CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447610	FD	On-Demand	Anodyne	HTR7	26	40
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC000872447620	FE	On-Demand	Mild	EPHX2	19	42
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000872447621	FE	On-Demand	Mild	EPHX2	19	42
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000872447625	EE	On-Demand	Mild	CCR8	65	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000872447626	EE	On-Demand	Mild	CCR8	65	33
C=CCN1C(=O)N[C@H](c2cn(Cc3ccc(OC)cc3)nn2)C(C(=O)OC)=C1C	ZINC000872447630	GE	On-Demand	Mild	PROKR1	46	30
C=CCN1C(=O)N[C@@H](c2cn(Cc3ccc(OC)cc3)nn2)C(C(=O)OC)=C1C	ZINC000872447631	GE	On-Demand	Mild	PROKR1	46	30
Nc1nc(N[C@@H]2CCN(c3ccccc3)C2)nc(C(F)F)n1	ZINC000872447637	DE	On-Demand	Anodyne	HRH4	61	39
Nc1nc(N[C@H]2CCN(c3ccccc3)C2)nc(C(F)F)n1	ZINC000872447638	DE	On-Demand	Anodyne	HRH4	61	39
COC(=O)C1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872447644	ED	On-Demand	Mild	CCR8	68	34
COC(=O)C1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872447644	ED	On-Demand	Mild	SFRP1	42	32
Nc1nc(N[C@@H]2CCN(c3ccc(F)cc3F)C2)nc(C(F)F)n1	ZINC000872447647	EE	On-Demand	Anodyne	HRH4	45	37
Nc1nc(N[C@H]2CCN(c3ccc(F)cc3F)C2)nc(C(F)F)n1	ZINC000872447648	EE	On-Demand	Anodyne	HRH4	45	37
COc1ccc(OC)c2sc(NC3CCN(CC#N)CC3)nc12	ZINC000872447718	EF	On-Demand	Mild	SSTR5	36	45
COC(=O)C1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872447719	DG	On-Demand	Anodyne	VCP	65	40
Cn1cc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)cn1	ZINC000872447721	GE	On-Demand	Anodyne	ADORA2B	52	36
Cn1cc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)cn1	ZINC000872447721	GE	On-Demand	Anodyne	PKM	43	37
Cn1cc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)cn1	ZINC000872447721	GE	On-Demand	Anodyne	GCK	40	38
Oc1nnc(Cl)cc1N1CC[C@H](N2CCCCC2)C1	ZINC000872447765	CD	On-Demand	Anodyne	HRH3	22	46
Oc1nnc(Cl)cc1N1CC[C@H](N2CCCCC2)C1	ZINC000872447765	CD	On-Demand	Anodyne	L3MBTL3	56	37
Oc1nnc(Cl)cc1N1CC[C@@H](N2CCCCC2)C1	ZINC000872447766	CD	On-Demand	Anodyne	HRH3	22	46
Oc1nnc(Cl)cc1N1CC[C@@H](N2CCCCC2)C1	ZINC000872447766	CD	On-Demand	Anodyne	L3MBTL3	56	37
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	TRY2_BOVIN	82	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	PAPA1_CARPA	40	39
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	CAPN1	29	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	CAPN2	48	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	ITGAV	50	38
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447776	FD	On-Demand	Mild	CTRB_BOVIN	47	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	TRY2_BOVIN	82	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	PAPA1_CARPA	40	39
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	CAPN1	29	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	CAPN2	48	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	ITGAV	50	38
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C	ZINC000872447777	FD	On-Demand	Mild	CTRB_BOVIN	47	34
Cc1ccc(S(=O)(=O)N2CC[C@H](N3CCCCC3)C2)c(C#N)c1	ZINC000872447779	EE	On-Demand	Mild	EPHX2	19	42
Cc1ccc(S(=O)(=O)N2CC[C@H](N3CCCCC3)C2)c(C#N)c1	ZINC000872447779	EE	On-Demand	Mild	L3MBTL3	48	37
Cc1ccc(S(=O)(=O)N2CC[C@@H](N3CCCCC3)C2)c(C#N)c1	ZINC000872447780	EE	On-Demand	Mild	EPHX2	19	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](N3CCCCC3)C2)c(C#N)c1	ZINC000872447780	EE	On-Demand	Mild	L3MBTL3	48	37
CCS(=O)(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872447782	GD	On-Demand	Mild	EPHX2	17	41
CCS(=O)(=O)N(C)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872447782	GD	On-Demand	Mild	TRPV4	43	36
CC(=O)N1CCN(C(=O)CCNc2ccnc3ncccc23)CC1	ZINC000872447803	ED	On-Demand	Anodyne	HNMT	50	37
CC(=O)N1CCN(C(=O)CCNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872447815	FD	On-Demand	Anodyne	P2RY12	69	39
c1ccc(-c2cc(N3CC[C@H](N4CCCCC4)C3)ncn2)cc1	ZINC000872447816	DG	On-Demand	Anodyne	HRH3	26	45
c1ccc(-c2cc(N3CC[C@H](N4CCCCC4)C3)ncn2)cc1	ZINC000872447816	DG	On-Demand	Anodyne	L3MBTL3	56	35
c1ccc(-c2cc(N3CC[C@@H](N4CCCCC4)C3)ncn2)cc1	ZINC000872447817	DG	On-Demand	Anodyne	HRH3	26	45
c1ccc(-c2cc(N3CC[C@@H](N4CCCCC4)C3)ncn2)cc1	ZINC000872447817	DG	On-Demand	Anodyne	L3MBTL3	56	35
Cn1ncc2c(NC3CCC3)nc(Cl)nc21	ZINC000872447826	BD	On-Demand	Anodyne	ADORA1	17	45
Cn1ncc2c(NC3CCC3)nc(Cl)nc21	ZINC000872447826	BD	On-Demand	Anodyne	Q4VQ11_PIG	53	39
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000872447880	FH	On-Demand	Anodyne	ACHE	22	40
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000872447880	FH	On-Demand	Anodyne	SIGMAR1	19	46
Oc1nnc(Cl)cc1NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000872447880	FH	On-Demand	Anodyne	CACNA1I	42	34
C=CCN1CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872447899	DD	On-Demand	Mild	CCR8	92	38
C=CCN1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872447906	EF	On-Demand	Mild	SFRP1	63	36
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000872447925	EE	On-Demand	Mild	L3MBTL3	45	37
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000872447926	EE	On-Demand	Mild	L3MBTL3	45	37
O=C1CCCCN1CCCNc1cc(-c2ccccc2)ncn1	ZINC000872447928	DF	On-Demand	Anodyne	HNMT	43	33
O=C1CCCCN1CCCNc1cc(-c2ccccc2)ncn1	ZINC000872447928	DF	On-Demand	Anodyne	TYRO3	19	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCOC3)cc2N1	ZINC000872447930	FE	On-Demand	Anodyne	PKM	37	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCOC3)cc2N1	ZINC000872447931	FE	On-Demand	Anodyne	PKM	37	46
CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447989	GC	On-Demand	Anodyne	F2	28	41
CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447989	GC	On-Demand	Anodyne	LGMN	42	34
CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447989	GC	On-Demand	Anodyne	SFRP1	51	36
CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872447989	GC	On-Demand	Anodyne	WNT3	62	36
CCCO[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448007	FH	On-Demand	Anodyne	CASP7	42	35
CCCO[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448008	FH	On-Demand	Anodyne	CASP7	42	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCN(CC4CC4)C3)cc2N1	ZINC000872448043	GE	On-Demand	Anodyne	PKM	22	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCN(CC4CC4)C3)cc2N1	ZINC000872448044	GE	On-Demand	Anodyne	PKM	22	42
c1cc(N2CC[C@H](N3CCCCC3)C2)c(C2CC2)cn1	ZINC000872448051	CG	On-Demand	Anodyne	HRH3	19	46
c1cc(N2CC[C@H](N3CCCCC3)C2)c(C2CC2)cn1	ZINC000872448051	CG	On-Demand	Anodyne	L3MBTL3	57	40
c1cc(N2CC[C@@H](N3CCCCC3)C2)c(C2CC2)cn1	ZINC000872448052	CG	On-Demand	Anodyne	HRH3	19	46
c1cc(N2CC[C@@H](N3CCCCC3)C2)c(C2CC2)cn1	ZINC000872448052	CG	On-Demand	Anodyne	L3MBTL3	57	40
CN1CCC[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872448059	GE	On-Demand	Anodyne	PKM	35	45
NC(=O)c1cc(N2CC[C@H](N3CCCCC3)C2)nc(Cl)n1	ZINC000872448078	DD	On-Demand	Anodyne	HRH3	20	41
NC(=O)c1cc(N2CC[C@H](N3CCCCC3)C2)nc(Cl)n1	ZINC000872448078	DD	On-Demand	Anodyne	L3MBTL3	71	35
NC(=O)c1cc(N2CC[C@@H](N3CCCCC3)C2)nc(Cl)n1	ZINC000872448079	DD	On-Demand	Anodyne	HRH3	20	41
NC(=O)c1cc(N2CC[C@@H](N3CCCCC3)C2)nc(Cl)n1	ZINC000872448079	DD	On-Demand	Anodyne	L3MBTL3	71	35
c1cnc2nccc(N3CC[C@H](N4CCCCC4)C3)c2c1	ZINC000872448080	CF	On-Demand	Anodyne	HRH3	23	52
c1cnc2nccc(N3CC[C@H](N4CCCCC4)C3)c2c1	ZINC000872448080	CF	On-Demand	Anodyne	L3MBTL3	58	40
c1cnc2nccc(N3CC[C@@H](N4CCCCC4)C3)c2c1	ZINC000872448081	CF	On-Demand	Anodyne	HRH3	23	52
c1cnc2nccc(N3CC[C@@H](N4CCCCC4)C3)c2c1	ZINC000872448081	CF	On-Demand	Anodyne	L3MBTL3	58	40
O=S(=O)(c1cccc(Br)n1)N1CC[C@@H](N2CCCCC2)C1	ZINC000872448084	FE	On-Demand	Anodyne	L3MBTL3	49	38
O=S(=O)(c1cccc(Br)n1)N1CC[C@H](N2CCCCC2)C1	ZINC000872448085	FE	On-Demand	Anodyne	L3MBTL3	49	38
CCOC(=O)[C@H](C)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872448116	GE	On-Demand	Anodyne	PKM	32	40
CN(C)[C@@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872448127	GE	On-Demand	Anodyne	PKM	19	40
COCc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1F	ZINC000872448129	DE	On-Demand	Anodyne	DRTS_TRYCR	45	35
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)C(F)F)CC2)c(C#N)c1	ZINC000872448176	GE	On-Demand	Mild	TRPV4	43	36
CN1CCC[C@H](N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)C1	ZINC000872448190	GE	On-Demand	Anodyne	PKM	43	37
C#CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872448231	ED	On-Demand	Mild	PKM	38	48
Cc1ccc(S(=O)(=O)N2CCN(Cc3cnc(C)s3)CC2)c(C#N)c1	ZINC000872448243	GE	On-Demand	Mild	TRPV4	42	35
NC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448246	FE	On-Demand	Anodyne	SFRP1	88	37
NC(=O)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448246	FE	On-Demand	Anodyne	WNT3	48	33
CN1CCC[C@H](CNc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872448247	CC	On-Demand	Anodyne	CACNA1I	41	32
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCOCC3CC3)cc2N1	ZINC000872448270	FE	On-Demand	Anodyne	PKM	33	44
O=S(=O)(N[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872448287	EF	On-Demand	Anodyne	HTR7	15	52
O=S(=O)(N[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872448287	EF	On-Demand	Anodyne	SFRP1	74	36
O=S(=O)(N[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872448288	EF	On-Demand	Anodyne	HTR7	15	52
O=S(=O)(N[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872448288	EF	On-Demand	Anodyne	SFRP1	74	36
CCOC(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872448290	DD	On-Demand	Anodyne	LEF	35	41
C=C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448303	DG	On-Demand	Mild	PKM	48	40
CCOCCN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448312	FE	On-Demand	Anodyne	PKM	41	37
NC(=O)c1cc(N2CCC([C@@H](O)c3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872448325	FE	On-Demand	Anodyne	SCD1	19	43
NC(=O)c1cc(N2CCC([C@H](O)c3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872448326	FE	On-Demand	Anodyne	SCD1	19	43
COc1ccc(OC)c2sc(NCCC(=O)N3CCN(C(C)=O)CC3)nc12	ZINC000872448333	GD	On-Demand	Anodyne	ADORA2B	20	45
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1c1cc(Cl)nnc1O	ZINC000872448351	EE	On-Demand	Anodyne	GPR119	39	44
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1cc(Cl)nnc1O	ZINC000872448352	EE	On-Demand	Anodyne	GPR119	39	44
NC(=O)c1cc(N[C@@H]2CCN(CC3CC3)C2)nc(Cl)n1	ZINC000872448430	CD	On-Demand	Anodyne	CCR2	16	42
NC(=O)c1cc(N[C@H]2CCN(CC3CC3)C2)nc(Cl)n1	ZINC000872448432	CD	On-Demand	Anodyne	CCR2	16	42
CCCO[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448447	EF	On-Demand	Mild	TRPV4	42	35
CCCO[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448448	EF	On-Demand	Mild	TRPV4	42	35
COc1ccc(OC)c2sc(NC3CCN(CC(=O)N(C)C)CC3)nc12	ZINC000872448451	GE	On-Demand	Anodyne	ADORA2B	18	40
COc1ccc(OC)c2sc(NC3CCN(CC(=O)N(C)C)CC3)nc12	ZINC000872448451	GE	On-Demand	Anodyne	SSTR5	50	44
C=CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448473	CE	On-Demand	Mild	EPHX2	18	43
C=CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448473	CE	On-Demand	Mild	TRPV4	44	36
Nc1nc(NCCCc2c[nH]c3ccccc23)nc(C(F)F)n1	ZINC000872448491	DF	On-Demand	Anodyne	MPO	67	38
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCC2)cc1	ZINC000872448497	DG	On-Demand	Anodyne	SIGMAR1	17	45
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCC2)cc1	ZINC000872448497	DG	On-Demand	Anodyne	SPHK2	48	35
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCC2)cc1	ZINC000872448497	DG	On-Demand	Anodyne	HNMT	46	38
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCC2)cc1	ZINC000872448497	DG	On-Demand	Anodyne	SPHK1	42	35
Oc1nnc(Cl)cc1Nc1ccc(CCN2CCCC2)cc1	ZINC000872448497	DG	On-Demand	Anodyne	YES1	17	40
CCOCCN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448510	ED	On-Demand	Mild	TRPV4	45	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(C1)OCCO2	ZINC000872448516	ED	On-Demand	Anodyne	PKM	41	36
Cc1c(F)ncnc1NC[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000872448525	DF	On-Demand	Anodyne	GPR119	48	40
Cc1c(F)ncnc1NC[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000872448526	DF	On-Demand	Anodyne	GPR119	48	40
COc1cc2c(cc1OC)CN(C(=O)CCCNc1ncnc(F)c1C)CC2	ZINC000872448535	GF	On-Demand	Anodyne	ABCB1B	41	32
COc1cc2c(cc1OC)CN(C(=O)CCCNc1ncnc(F)c1C)CC2	ZINC000872448535	GF	On-Demand	Anodyne	ABCB1	18	44
Cn1ncc2c(NCCCNC(=O)c3cccc(F)c3)nc(Cl)nc21	ZINC000872448537	FE	On-Demand	Anodyne	DRD4	42	32
Cn1ncc2c(NCCCNC(=O)c3cccc(F)c3)nc(Cl)nc21	ZINC000872448537	FE	On-Demand	Anodyne	TBK1	24	41
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(F)c1	ZINC000872448556	DE	On-Demand	Anodyne	DRD4	41	32
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(F)c1	ZINC000872448556	DE	On-Demand	Anodyne	MAPK14	18	43
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(F)c1	ZINC000872448556	DE	On-Demand	Anodyne	TBK1	23	45
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(F)c1	ZINC000872448556	DE	On-Demand	Anodyne	KCNK3	32	43
Cc1c(F)ncnc1NCCCNC(=O)c1cccc(F)c1	ZINC000872448556	DE	On-Demand	Anodyne	KCNK9	23	43
CCOc1cc(CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)ccc1OC	ZINC000872448579	GE	On-Demand	Anodyne	DRTS_TRYCR	43	31
CCOc1cc(CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)ccc1OC	ZINC000872448581	GE	On-Demand	Anodyne	DRTS_TRYCR	43	31
COC(=O)[C@@H]1CC12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872448588	ED	On-Demand	Mild	EPHX2	15	41
COC(=O)[C@@H]1CC12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872448588	ED	On-Demand	Mild	TRPV4	47	40
COc1ccc(OC)c2sc(NC3CCN(CCS(C)(=O)=O)CC3)nc12	ZINC000872448595	GE	On-Demand	Anodyne	SSTR5	36	44
COc1ccc(OC)c2sc(NC3CCN(CCS(C)(=O)=O)CC3)nc12	ZINC000872448595	GE	On-Demand	Anodyne	EHMT2	44	33
C=C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872448640	CE	On-Demand	Mild	TRPV4	45	37
c1ccc(-c2cc(NCCOCC3CC3)ncn2)cc1	ZINC000872448645	CF	On-Demand	Anodyne	VCP	57	38
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000872448649	EH	On-Demand	Anodyne	HTR1D	18	46
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000872448649	EH	On-Demand	Anodyne	HTR1B	15	46
Oc1nnc(Cl)cc1N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000872448649	EH	On-Demand	Anodyne	CCR2	21	42
Cc1c(F)ncnc1NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000872448679	FE	On-Demand	Anodyne	SLC6A1	93	34
Cc1c(F)ncnc1NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000872448680	FE	On-Demand	Anodyne	SLC6A1	93	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000872448686	FD	On-Demand	Mild	CCR8	74	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000872448687	FD	On-Demand	Mild	CCR8	74	34
CN1CCC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872448711	CF	On-Demand	Anodyne	HRH4	15	47
CN1CCC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872448711	CF	On-Demand	Anodyne	VCP	50	35
CN1CCC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872448711	CF	On-Demand	Anodyne	PKNB	29	42
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000872448721	DD	On-Demand	Mild	CCR8	66	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000872448723	DD	On-Demand	Mild	CCR8	66	33
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c(C#N)c1	ZINC000872448731	GE	On-Demand	Mild	ADORA2B	45	39
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c(C#N)c1	ZINC000872448731	GE	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c(C#N)c1	ZINC000872448731	GE	On-Demand	Mild	Q8WSF8_APLCA	42	41
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c(C#N)c1	ZINC000872448731	GE	On-Demand	Mild	NACHRBETA2	44	41
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	HTR1A	61	46
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	DRD2	63	48
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	DRD1	16	41
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	DRD4	52	48
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	ADRA1D	41	40
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	HTR2A	52	44
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	HTR2C	40	43
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	SLC6A4	18	42
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	ADRA1A	49	40
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	ADRA1B	25	42
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	DRD3	82	46
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	PLD1	46	35
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	ABCC1	89	41
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	PLD2	71	33
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	ABCB1A	47	38
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	AKT1	19	46
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	RPS6KB1	48	40
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	SIRT3	53	44
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	SIRT2	50	44
Cc1c(F)ncnc1N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000872448737	FD	On-Demand	Anodyne	SIRT1	40	44
O=S(=O)(NCCN1CCSCC1)c1ccc(F)c(C(F)F)c1	ZINC000872448770	FE	On-Demand	Anodyne	HTR7	33	42
CCCCN(CCOC)c1cc(C)nc2c1cnn2C	ZINC000872448797	CF	On-Demand	Anodyne	CRHR1	58	49
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000872448820	ED	On-Demand	Anodyne	SIRT3	58	36
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000872448820	ED	On-Demand	Anodyne	SIRT2	51	32
Cc1c(F)ncnc1N1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000872448820	ED	On-Demand	Anodyne	SIRT1	50	32
CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872448825	DD	On-Demand	Mild	SLC6A1	42	34
O=C([C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1)N1CCCC1	ZINC000872448830	GF	On-Demand	Anodyne	TGM2	16	40
O=C([C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1)N1CCCC1	ZINC000872448831	GF	On-Demand	Anodyne	TGM2	16	40
O=S(=O)(NCCN1CCSCC1)c1cccc(Br)n1	ZINC000872448834	FD	On-Demand	Anodyne	HTR7	26	41
Cc1c(F)ncnc1N1CCN(C[C@@H]2CCCCN2C)CC1	ZINC000872448847	DD	On-Demand	Anodyne	CHRNA10	48	38
Cc1c(F)ncnc1N1CCN(C[C@@H]2CCCCN2C)CC1	ZINC000872448847	DD	On-Demand	Anodyne	RPS6KB1	40	31
Cc1c(F)ncnc1N1CCN(C[C@H]2CCCCN2C)CC1	ZINC000872448848	DD	On-Demand	Anodyne	CHRNA10	48	38
Cc1c(F)ncnc1N1CCN(C[C@H]2CCCCN2C)CC1	ZINC000872448848	DD	On-Demand	Anodyne	RPS6KB1	40	31
CN(c1ccccc1)C1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872448850	EE	On-Demand	Anodyne	P2RY12	44	32
CN(c1ccccc1)C1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872448850	EE	On-Demand	Anodyne	SCD1	21	40
Cc1c(F)ncnc1N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000872448859	DG	On-Demand	Anodyne	AKT2	18	41
Cc1c(F)ncnc1N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000872448860	DG	On-Demand	Anodyne	AKT2	18	41
CNS(=O)(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872448864	GD	On-Demand	Anodyne	PKM	39	42
NC(=O)[C@@H]1CCCN(Cc2cccc(CNc3ccnc4ncccc34)c2)C1	ZINC000872448881	GF	On-Demand	Anodyne	HNMT	49	34
NC(=O)[C@H]1CCCN(Cc2cccc(CNc3ccnc4ncccc34)c2)C1	ZINC000872448882	GF	On-Demand	Anodyne	HNMT	49	34
CCOC[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872448890	FG	On-Demand	Anodyne	CASP7	46	39
CCOC[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872448983	DE	On-Demand	Mild	TRPV4	42	34
Cc1c(F)ncnc1NCCCNC(=O)c1ccc(F)cc1	ZINC000872449025	DE	On-Demand	Anodyne	FOLH1	20	41
Cc1c(F)ncnc1NCCCNC(=O)c1ccc(F)cc1	ZINC000872449025	DE	On-Demand	Anodyne	BCHE	21	44
Cc1c(F)ncnc1NCCCNC(=O)c1ccc(F)cc1	ZINC000872449025	DE	On-Demand	Anodyne	TBK1	21	41
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872449039	DD	On-Demand	Mild	TRPV4	43	36
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872449039	DD	On-Demand	Mild	CASP7	44	38
CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872449070	DD	On-Demand	Mild	EPHX2	32	45
O=C1[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CC(F)(F)F	ZINC000872449074	GE	On-Demand	Anodyne	F10	34	46
O=C1[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CC(F)(F)F	ZINC000872449075	GE	On-Demand	Anodyne	F10	34	46
CN(C)C(=O)CCN1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872449082	FE	On-Demand	Anodyne	SSTR5	48	39
N#C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C1CC1	ZINC000872449088	FE	On-Demand	Mild	GCKR	84	38
N#C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C1CC1	ZINC000872449089	FE	On-Demand	Mild	GCKR	84	38
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)N1CCCc2ccccc21	ZINC000872449095	GD	On-Demand	Anodyne	DRD2	23	51
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)N1CCCc2ccccc21	ZINC000872449095	GD	On-Demand	Anodyne	DRD4	33	60
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)N1CCCc2ccccc21	ZINC000872449095	GD	On-Demand	Anodyne	AVPR2	34	42
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	DRD4	21	41
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	SIGMAR1	32	53
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	SSTR5	76	42
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	CCR3	32	43
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	UTS2R	18	43
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000872449134	GI	On-Demand	Anodyne	MCHR1	37	48
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000872449138	GF	On-Demand	Mild	EPHX2	35	44
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CC(=O)N(C)C)CC1	ZINC000872449139	FC	On-Demand	Mild	CCR8	88	39
CN1CCC[C@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872449143	EE	On-Demand	Anodyne	HTR7	19	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](N2CCCCC2)C1	ZINC000872449168	FG	On-Demand	Anodyne	L3MBTL3	58	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](N2CCCCC2)C1	ZINC000872449169	FG	On-Demand	Anodyne	L3MBTL3	58	44
Cn1ncc2c(NCCCNC(=O)c3ccc(F)cc3)nc(Cl)nc21	ZINC000872449289	FE	On-Demand	Anodyne	BCHE	20	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000872449299	GE	On-Demand	Mild	CACNA1I	48	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000872449300	GE	On-Demand	Mild	CACNA1I	48	32
COCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872449308	DD	On-Demand	Mild	EPHX2	22	44
COCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872449308	DD	On-Demand	Mild	TRPV4	47	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1cncn1	ZINC000872449319	FE	On-Demand	Anodyne	CASP3	90	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1cncn1	ZINC000872449319	FE	On-Demand	Anodyne	CASP7	100	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1cncn1	ZINC000872449320	FE	On-Demand	Anodyne	CASP3	90	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1cncn1	ZINC000872449320	FE	On-Demand	Anodyne	CASP7	100	38
C=CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872449338	DG	On-Demand	Mild	PKM	41	38
C=CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872449338	DG	On-Demand	Mild	TGM2	44	33
COc1ccc(OC)c2sc(NC3CCN(CCC(=O)N(C)C)CC3)nc12	ZINC000872449351	GF	On-Demand	Anodyne	ADORA2B	17	41
COc1ccc(OC)c2sc(NC3CCN(CCC(=O)N(C)C)CC3)nc12	ZINC000872449351	GF	On-Demand	Anodyne	SSTR5	50	43
O=C(C1CCC1)N(CCCNc1ccnc2ncccc12)C1CC1	ZINC000872449359	DG	On-Demand	Anodyne	HNMT	52	39
Nc1nc(NCCCc2cccc(F)c2)nc(C(F)F)n1	ZINC000872449395	CF	On-Demand	Anodyne	NOS1	20	45
Cc1cccc(C#N)c1S(=O)(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000872449455	FF	On-Demand	Mild	ESRRG	48	37
CNC(=O)[C@@H]1CCCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872449459	GE	On-Demand	Anodyne	BIRC2	15	40
CN(C)C(=O)CCN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872449503	ED	On-Demand	Anodyne	SSTR5	42	33
CN(C)C(=O)CCN1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872449503	ED	On-Demand	Anodyne	HNMT	41	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3CCSCC3)cc2N1	ZINC000872449526	GG	On-Demand	Anodyne	PKM	34	44
COC(=O)CCN(C(C)C)S(=O)(=O)c1cccc(Br)n1	ZINC000872449537	FD	On-Demand	Anodyne	BMP1	45	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(C2CCC2)CC1	ZINC000872449550	EF	On-Demand	Anodyne	PKM	49	40
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872449556	EF	On-Demand	Anodyne	CASP3	51	41
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872449556	EF	On-Demand	Anodyne	CASP7	69	41
C[C@@]1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCOC1	ZINC000872449560	FE	On-Demand	Anodyne	PKM	37	44
C[C@]1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCOC1	ZINC000872449561	FE	On-Demand	Anodyne	PKM	37	44
CCc1nnc2n1CCN(S(=O)(=O)c1ccc(C)cc1C#N)C2	ZINC000872449569	ED	On-Demand	Mild	TRPV4	41	33
O=C1CCCN1C[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449574	GF	On-Demand	Anodyne	CASP3	88	39
O=C1CCCN1C[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449574	GF	On-Demand	Anodyne	CASP7	99	39
O=C1CCCN1C[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449575	GF	On-Demand	Anodyne	CASP3	88	39
O=C1CCCN1C[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449575	GF	On-Demand	Anodyne	CASP7	99	39
O=C([C@H]1CCCN(c2ccnc3ncccc23)C1)N1CCCC1	ZINC000872449615	DE	On-Demand	Anodyne	PREP	43	35
O=C([C@@H]1CCCN(c2ccnc3ncccc23)C1)N1CCCC1	ZINC000872449616	DE	On-Demand	Anodyne	PREP	43	35
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(C(N)=O)nc(Cl)n1	ZINC000872449627	ED	On-Demand	Anodyne	DRD4	53	41
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	HTR1A	74	46
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	DRD2	78	51
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	DRD1	32	44
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	DRD4	55	51
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	ADRA1D	47	39
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	HTR2A	57	46
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	HTR2C	43	46
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	SLC6A4	22	46
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	ADRA1A	48	39
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	DRD3	113	48
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	HTR4	27	40
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	HTR7	62	41
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	PLD1	71	39
O=C(NCCN1CCN(c2cc(Cl)nnc2O)CC1)c1ccccc1F	ZINC000872449639	GD	On-Demand	Anodyne	PLD2	100	36
CCOc1ccnc(N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)n1	ZINC000872449649	GD	On-Demand	Mild	TRPV4	43	35
C=CC[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449672	CG	On-Demand	Mild	LEF	34	40
C=CC[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872449673	CG	On-Demand	Mild	LEF	34	40
Cc1c(F)ncnc1N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000872449680	DF	On-Demand	Anodyne	SIRT3	78	37
Cc1c(F)ncnc1N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000872449680	DF	On-Demand	Anodyne	SIRT2	61	34
Cc1c(F)ncnc1N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000872449680	DF	On-Demand	Anodyne	SIRT1	51	34
Oc1nnc(Cl)cc1N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000872449697	FH	On-Demand	Anodyne	P2RX7	56	41
CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872449698	GD	On-Demand	Anodyne	PKM	22	40
Oc1nnc(Cl)cc1N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000872449710	FH	On-Demand	Anodyne	P2RX7	56	41
CCOC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872449713	GF	On-Demand	Anodyne	SLC27A4	46	31
CCOC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872449718	GF	On-Demand	Anodyne	SLC27A4	46	31
CCOC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872449721	GF	On-Demand	Anodyne	SLC27A4	46	31
CCOC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872449726	GF	On-Demand	Anodyne	SLC27A4	46	31
COCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872449750	EF	On-Demand	Anodyne	CASP3	53	39
COCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872449750	EF	On-Demand	Anodyne	PKM	42	38
COCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872449750	EF	On-Demand	Anodyne	CASP7	69	39
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](C(=O)N1CCCC1)C(C)C	ZINC000872449858	ED	On-Demand	Mild	TRY2_BOVIN	42	38
Cn1ncc2c(NCCCCCN3CCCCC3)nc(Cl)nc21	ZINC000872449898	EG	On-Demand	Anodyne	HNMT	82	43
C[C@@H]1CN(Cc2ccccc2)CCN1c1nc(N)nc(C(F)F)n1	ZINC000872449899	EE	On-Demand	Anodyne	SIGMAR1	22	40
O=C1c2ccccc2C(=O)N1CCCCNc1cc(Cl)nnc1O	ZINC000872449910	EE	On-Demand	Anodyne	HRP1_PLAFA	57	39
CNC(=O)[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872449924	CD	On-Demand	Anodyne	GPBAR1	18	43
C[C@@H](O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872449941	CF	On-Demand	Anodyne	PRNP	44	33
C[C@@H](O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872449941	CF	On-Demand	Anodyne	SORD	46	41
CC(C)(C)OC(=O)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872449946	DG	On-Demand	Anodyne	CCR8	71	44
CC(C)(C)OC(=O)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872449946	DG	On-Demand	Anodyne	GPR119	50	47
CC(C)(C)OC(=O)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872449947	DG	On-Demand	Anodyne	CCR8	71	44
CC(C)(C)OC(=O)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872449947	DG	On-Demand	Anodyne	GPR119	50	47
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872449948	DF	On-Demand	Anodyne	DRD2	20	41
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872449948	DF	On-Demand	Anodyne	DRD4	64	42
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872449948	DF	On-Demand	Anodyne	ACHE	18	40
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872449948	DF	On-Demand	Anodyne	DRD3	15	40
C[C@@H]1CN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872449948	DF	On-Demand	Anodyne	SIGMAR1	43	41
COC(=O)CCN(C(C)C)S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872450049	FF	On-Demand	Anodyne	BMP1	63	45
CN(C)CCOc1ccc(N(C)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1	ZINC000872450058	GE	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(N(C)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1	ZINC000872450060	GE	On-Demand	Anodyne	ESRRG	43	32
Cn1ncc2c(NC3CCN(CCS(C)(=O)=O)CC3)nc(Cl)nc21	ZINC000872450061	FC	On-Demand	Anodyne	EHMT2	41	32
CN(C)C[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872450077	GE	On-Demand	Anodyne	PKM	27	40
CC(C)(C)OC(=O)NCc1cccc(Nc2cc(Cl)nnc2O)c1	ZINC000872450115	FH	On-Demand	Anodyne	PDS	44	33
NC(=O)C1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872450116	CF	On-Demand	Anodyne	F11	16	42
NC(=O)C1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872450116	CF	On-Demand	Anodyne	CD38	15	46
NC(=O)C1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872450116	CF	On-Demand	Anodyne	VCP	69	47
Cc1ccc(S(=O)(=O)N2CCN(c3ccc(CN(C)C)cn3)CC2)c(C#N)c1	ZINC000872450121	GD	On-Demand	Mild	TRPV4	42	35
NC(=O)C1CCC(Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872450126	EG	On-Demand	Anodyne	VCP	42	40
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	ESR1	99	44
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	KCNH2	15	42
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	ESR2	68	44
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	LTA4H	66	55
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	HRH3	67	50
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	HNMT	72	43
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	PSMB2	45	48
Oc1nnc(Cl)cc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872450215	EF	On-Demand	Anodyne	PSMB1	50	48
Cc1ccc(S(=O)(=O)N2CCN(CC3CCOCC3)CC2)c(C#N)c1	ZINC000872450225	FD	On-Demand	Mild	TRPV4	41	34
Cc1c(F)ncnc1NCCCCCN1CCCCC1	ZINC000872450238	CF	On-Demand	Anodyne	HRH3	25	47
Cc1c(F)ncnc1NCCCCCN1CCCCC1	ZINC000872450238	CF	On-Demand	Anodyne	HNMT	91	47
Cc1nc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)no1	ZINC000872450241	GD	On-Demand	Anodyne	ADORA2B	48	33
Cc1nc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)no1	ZINC000872450241	GD	On-Demand	Anodyne	PKM	41	37
COc1ccc(OC)c2sc(NCC3(C(N)=O)CCOCC3)nc12	ZINC000872450244	FE	On-Demand	Anodyne	ADORA2B	16	41
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	ESR1	74	37
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	ESR2	53	39
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	LTA4H	64	54
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	HRH3	54	42
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	PSMB2	43	47
Nc1nc(NCc2ccc(OCCN3CCCC3)cc2)nc(C(F)F)n1	ZINC000872450247	FE	On-Demand	Anodyne	PSMB1	47	47
Cn1ncc2c(NCCCN(C(=O)C3CCC3)C3CC3)nc(Cl)nc21	ZINC000872450280	FF	On-Demand	Anodyne	TBK1	51	35
COCC1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872450284	GF	On-Demand	Anodyne	PKM	24	41
Cc1c(F)ncnc1N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000872450329	EH	On-Demand	Anodyne	AKT2	46	50
Cc1c(F)ncnc1N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000872450329	EH	On-Demand	Anodyne	AKT3	66	38
Cc1c(F)ncnc1N1CCC([C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872450330	EH	On-Demand	Anodyne	AKT2	46	50
Cc1c(F)ncnc1N1CCC([C@H](O)c2ccc(Cl)cc2)CC1	ZINC000872450330	EH	On-Demand	Anodyne	AKT3	66	38
Cc1ccc(S(=O)(=O)N2CCc3cncnc3C2)c(C#N)c1	ZINC000872450350	DD	On-Demand	Mild	TRPV4	43	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872450373	GE	On-Demand	Mild	ADORA2B	40	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872450373	GE	On-Demand	Mild	Q8WSF8_APLCA	41	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872450373	GE	On-Demand	Mild	NACHRBETA2	43	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](C(=O)N2CCCC2)C1	ZINC000872450392	FD	On-Demand	Mild	SLC6A1	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](C(=O)N2CCCC2)C1	ZINC000872450394	FD	On-Demand	Mild	SLC6A1	41	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCOc3cccnc3)cc2N1	ZINC000872450395	GE	On-Demand	Anodyne	PKM	34	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2cncnc2C1	ZINC000872450414	EE	On-Demand	Anodyne	AKR1C3	59	39
O=S(=O)(NC1CCN(C[C@H]2CCCO2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872450419	GF	On-Demand	Anodyne	SFRP1	95	36
O=S(=O)(NC1CCN(C[C@H]2CCCO2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872450419	GF	On-Demand	Anodyne	WNT3	62	35
O=S(=O)(NC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872450421	GF	On-Demand	Anodyne	SFRP1	95	36
O=S(=O)(NC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872450421	GF	On-Demand	Anodyne	WNT3	62	35
O=S(=O)(CCNc1cc(-c2ccccc2)ncn1)NCC1CCC1	ZINC000872450424	EE	On-Demand	Anodyne	VCP	56	36
COc1cc(C)nc(N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)n1	ZINC000872450478	GD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCN(C3CCC3)CC2)c(C#N)c1	ZINC000872450483	DD	On-Demand	Mild	EPHX2	16	42
Cc1ccc(S(=O)(=O)N2CCN(C3CCC3)CC2)c(C#N)c1	ZINC000872450483	DD	On-Demand	Mild	TRPV4	42	35
Cn1cc([C@@H]2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C2)cn1	ZINC000872450499	FF	On-Demand	Anodyne	GCKR	64	33
Nc1nc(NCCCCCN2CCCCC2)nc(C(F)F)n1	ZINC000872450524	DE	On-Demand	Anodyne	HNMT	77	40
Cn1ncc2c(N[C@@H]3CCN(C(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872450584	FE	On-Demand	Anodyne	GPR119	29	47
Cn1ncc2c(N[C@H]3CCN(C(=O)OC(C)(C)C)C3)nc(Cl)nc21	ZINC000872450585	FE	On-Demand	Anodyne	GPR119	29	47
CCNS(=O)(=O)CCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872450623	ED	On-Demand	Anodyne	ADORA2B	17	41
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR1A	92	47
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	DRD2	88	49
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	DRD1	19	42
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	DRD4	66	49
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	ADRA1D	39	43
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR1D	23	45
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR1B	30	45
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR2A	66	45
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR2C	39	44
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	SLC6A4	22	45
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	ADRA1A	45	44
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	ADRA1B	22	41
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	DRD3	102	48
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HRP1_PLAFA	25	40
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HTR7	71	42
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	PLD1	47	34
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	PLD2	79	35
O=C(NCCN1CCN(c2ccnc3ncccc23)CC1)c1ccccc1F	ZINC000872450687	GE	On-Demand	Anodyne	HPGDS	31	41
O=S(=O)(c1cccc(Br)n1)N1CCc2cncnc2C1	ZINC000872450702	FD	On-Demand	Anodyne	AKR1C3	46	37
C=CC[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450719	EF	On-Demand	Mild	PKM	39	46
C=CC[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450720	EF	On-Demand	Mild	PKM	39	46
CSC[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872450743	DF	On-Demand	Anodyne	LEF	36	41
C=C(Cl)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450762	EF	On-Demand	Mild	PKM	39	47
CNC(=O)[C@@H]1CCCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872450821	EG	On-Demand	Anodyne	GPBAR1	18	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CC2CCOCC2)CC1	ZINC000872450850	GE	On-Demand	Anodyne	PKM	49	39
CCN1CCCC[C@@H]1CNc1cc(Cl)nnc1O	ZINC000872450907	CE	On-Demand	Anodyne	DRD2	29	42
CNC(=O)[C@@H]1CCCN(c2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872450940	DE	On-Demand	Anodyne	GPBAR1	21	41
C[S@](=O)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450962	FD	On-Demand	Anodyne	PKM	40	50
C[S@@](=O)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450963	FD	On-Demand	Anodyne	PKM	40	50
C[S@@](=O)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872450970	GD	On-Demand	Anodyne	PKM	39	48
CC(C)(C)OC(=O)N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872450993	DE	On-Demand	Anodyne	GPR119	40	39
CC(C)(C)OC(=O)N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872450994	DE	On-Demand	Anodyne	GPR119	40	39
CNC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872451014	CE	On-Demand	Anodyne	SLC6A1	69	33
CNC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872451014	CE	On-Demand	Anodyne	PDPK1	15	45
CNC(=O)[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872451014	CE	On-Demand	Anodyne	GPBAR1	19	41
Oc1nnc(Cl)cc1NCCCCCN1CCCCC1	ZINC000872451051	CF	On-Demand	Anodyne	HRP1_PLAFA	81	38
Oc1nnc(Cl)cc1NCCCCCN1CCCCC1	ZINC000872451051	CF	On-Demand	Anodyne	HRH3	15	54
Oc1nnc(Cl)cc1NCCCCCN1CCCCC1	ZINC000872451051	CF	On-Demand	Anodyne	HNMT	100	54
CNC(=O)[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872451056	EF	On-Demand	Anodyne	GRM5	21	48
CNC(=O)[C@@H]1CCCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872451056	EF	On-Demand	Anodyne	GPBAR1	19	44
NC(=O)C1(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCC1	ZINC000872451107	ED	On-Demand	Anodyne	PLAU	15	41
CC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872451119	EC	On-Demand	Mild	EPHX2	17	41
CC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872451119	EC	On-Demand	Mild	TRPV4	42	34
Oc1nnc(Cl)cc1NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872451136	EG	On-Demand	Anodyne	DRD2	15	41
Oc1nnc(Cl)cc1NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872451136	EG	On-Demand	Anodyne	KCNH2	39	47
Oc1nnc(Cl)cc1NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000872451136	EG	On-Demand	Anodyne	LTA4H	19	51
Cc1c(F)ncnc1N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872451137	CE	On-Demand	Anodyne	GPR119	83	49
Cc1c(F)ncnc1N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000872451138	CE	On-Demand	Anodyne	GPR119	83	49
Nc1nc(N[C@@H]2CCN(c3ccccc3Br)C2)nc(C(F)F)n1	ZINC000872451139	GF	On-Demand	Anodyne	HRH4	43	35
Nc1nc(N[C@H]2CCN(c3ccccc3Br)C2)nc(C(F)F)n1	ZINC000872451140	GF	On-Demand	Anodyne	HRH4	43	35
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	ESR1	75	40
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	KCNH2	15	41
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	ESR2	54	40
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	LTA4H	67	57
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	HRH3	64	45
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	TNK2	29	43
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	PSMB2	46	50
Cc1c(F)ncnc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000872451141	EG	On-Demand	Anodyne	PSMB1	51	50
NC(=O)c1cc(NCCCCCN2CCCCC2)nc(Cl)n1	ZINC000872451157	EE	On-Demand	Anodyne	HNMT	69	43
C#CCNC(=O)CN1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872451185	FC	On-Demand	Mild	TRPV4	45	36
CSC[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872451199	FF	On-Demand	Anodyne	PKM	40	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@@H](O)C3)cc2N1	ZINC000872451228	FD	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@H](O)C3)cc2N1	ZINC000872451229	FD	On-Demand	Anodyne	PKM	35	44
COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872451249	GG	On-Demand	Anodyne	ADRA1D	47	39
COc1ccccc1[C@H]1CCN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872451250	GG	On-Demand	Anodyne	ADRA1D	47	39
Cc1c(F)ncnc1NCCCC(=O)N1CCc2ccccc21	ZINC000872451271	DF	On-Demand	Anodyne	EIF2AK3	73	36
O=C1[C@H](Nc2cc(-c3ccccc3)ncn2)CCN1CC(F)(F)F	ZINC000872451272	EF	On-Demand	Anodyne	HPGDS	27	40
O=C1[C@@H](Nc2cc(-c3ccccc3)ncn2)CCN1CC(F)(F)F	ZINC000872451273	EF	On-Demand	Anodyne	HPGDS	27	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1cccn1	ZINC000872451295	FF	On-Demand	Anodyne	CASP3	95	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1Cn1cccn1	ZINC000872451295	FF	On-Demand	Anodyne	CASP7	104	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1cccn1	ZINC000872451296	FF	On-Demand	Anodyne	CASP3	95	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1cccn1	ZINC000872451296	FF	On-Demand	Anodyne	CASP7	104	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H](O)c3ccccc3)cc2N1	ZINC000872451299	GF	On-Demand	Anodyne	PKM	41	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H](O)c3ccccc3)cc2N1	ZINC000872451300	GF	On-Demand	Anodyne	PKM	41	48
Cn1nccc1C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872451358	FG	On-Demand	Anodyne	PKM	41	36
CCN(CC)C(=O)CCCNc1ccnc2ncccc12	ZINC000872451433	CF	On-Demand	Anodyne	HNMT	42	36
Cc1ccc(S(=O)(=O)N2CCn3ccnc3C2)c(C#N)c1	ZINC000872451438	DD	On-Demand	Mild	TRPV4	45	36
O=S(=O)(N1CCC(CNc2cc(Cl)nnc2O)CC1)C(F)(F)F	ZINC000872451440	FD	On-Demand	Anodyne	CACNA1I	41	32
Cc1c(F)ncnc1N1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451454	FE	On-Demand	Anodyne	AKT2	48	38
Cc1c(F)ncnc1N1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451454	FE	On-Demand	Anodyne	AKT3	71	37
Cc1c(F)ncnc1N1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451454	FE	On-Demand	Anodyne	AKT1	44	39
Cc1c(F)ncnc1N1CCN([C@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451455	FE	On-Demand	Anodyne	AKT2	48	38
Cc1c(F)ncnc1N1CCN([C@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451455	FE	On-Demand	Anodyne	AKT3	71	37
Cc1c(F)ncnc1N1CCN([C@H](CO)c2ccc(Cl)cc2)CC1	ZINC000872451455	FE	On-Demand	Anodyne	AKT1	44	39
Cc1cccc(C#N)c1S(=O)(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872451468	GF	On-Demand	Mild	CCR8	69	37
CN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872451470	DD	On-Demand	Anodyne	F10	34	46
CN1CC[C@H](N(C)S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1=O	ZINC000872451565	GD	On-Demand	Anodyne	PKM	19	40
O=S1(=O)CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872451571	FD	On-Demand	Anodyne	PKM	41	38
O=C(c1ccccc1)N1CCC(CNS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872451573	GG	On-Demand	Anodyne	L3MBTL3	68	35
Cc1c(F)ncnc1NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000872451574	FD	On-Demand	Anodyne	GPR119	21	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H](O)C1	ZINC000872451643	DD	On-Demand	Anodyne	GCKR	54	32
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H](O)C1	ZINC000872451644	DD	On-Demand	Anodyne	GCKR	54	32
COc1cccc(OCCCNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872451700	GE	On-Demand	Anodyne	MTNR1A	25	48
COc1cccc(OCCCNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872451700	GE	On-Demand	Anodyne	MTNR1B	23	48
COc1cccc(OCCCNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872451701	GE	On-Demand	Anodyne	MTNR1A	25	48
COc1cccc(OCCCNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872451701	GE	On-Demand	Anodyne	MTNR1B	23	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCO)cc2N1	ZINC000872451706	DC	On-Demand	Anodyne	PKM	42	51
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H](N2CCCC2)CC1	ZINC000872451724	GE	On-Demand	Anodyne	L3MBTL3	73	43
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H](N2CCCC2)CC1	ZINC000872451725	GE	On-Demand	Anodyne	L3MBTL3	73	43
Cc1ccoc1C(=O)NCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872451726	GF	On-Demand	Anodyne	LEF	33	40
CN1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1=O	ZINC000872451727	GD	On-Demand	Anodyne	PKM	35	44
CN1C[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1=O	ZINC000872451728	GD	On-Demand	Anodyne	PKM	35	44
CN1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1=O	ZINC000872451763	FD	On-Demand	Anodyne	PKM	36	47
C[C@@H](Cc1ccc(C(F)(F)F)cc1)Nc1nc(N)nc(C(F)F)n1	ZINC000872451776	EG	On-Demand	Anodyne	TPH1	32	42
O=S(=O)(CC1CC2(CCC2)C1)NC[C@H](O)COc1ccccc1	ZINC000872451822	ED	On-Demand	Anodyne	ADRB2	51	49
O=S(=O)(CC1CC2(CCC2)C1)NC[C@H](O)COc1ccccc1	ZINC000872451822	ED	On-Demand	Anodyne	ADRB1	74	46
O=S(=O)(CC1CC2(CCC2)C1)NC[C@H](O)COc1ccccc1	ZINC000872451822	ED	On-Demand	Anodyne	ADRB3	51	46
O=S(=O)(CC1CC2(CCC2)C1)NC[C@@H](O)COc1ccccc1	ZINC000872451823	ED	On-Demand	Anodyne	ADRB2	51	49
O=S(=O)(CC1CC2(CCC2)C1)NC[C@@H](O)COc1ccccc1	ZINC000872451823	ED	On-Demand	Anodyne	ADRB1	74	46
O=S(=O)(CC1CC2(CCC2)C1)NC[C@@H](O)COc1ccccc1	ZINC000872451823	ED	On-Demand	Anodyne	ADRB3	51	46
CN(CCO)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872451883	ED	On-Demand	Anodyne	PKM	33	42
O=S(=O)(NC[C@@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451900	GF	On-Demand	Anodyne	ADRB2	28	48
O=S(=O)(NC[C@@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451900	GF	On-Demand	Anodyne	ADRB1	35	48
O=S(=O)(NC[C@@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451900	GF	On-Demand	Anodyne	GRIN1	27	43
O=S(=O)(NC[C@@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451900	GF	On-Demand	Anodyne	ADRB3	28	48
O=S(=O)(NC[C@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451902	GF	On-Demand	Anodyne	ADRB2	28	48
O=S(=O)(NC[C@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451902	GF	On-Demand	Anodyne	ADRB1	35	48
O=S(=O)(NC[C@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451902	GF	On-Demand	Anodyne	GRIN1	27	43
O=S(=O)(NC[C@H](O)COc1ccc(F)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872451902	GF	On-Demand	Anodyne	ADRB3	28	48
O=S(=O)(NCCO)c1ccc(F)c(C(F)F)c1	ZINC000872451957	CD	On-Demand	Anodyne	TBXA2R	44	36
Cc1c(F)ncnc1N1CCC(CS(N)(=O)=O)CC1	ZINC000872451958	CC	On-Demand	Anodyne	SIRT3	52	36
Cc1c(F)ncnc1N1CCC(CS(N)(=O)=O)CC1	ZINC000872451958	CC	On-Demand	Anodyne	SIRT2	40	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H](N2CCCC2)CC1	ZINC000872451974	GG	On-Demand	Anodyne	L3MBTL3	83	50
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H](N2CCCC2)CC1	ZINC000872451975	GG	On-Demand	Anodyne	L3MBTL3	83	50
Cc1nc(CN2CCC(CNc3cc(Cl)nnc3O)CC2)oc1C	ZINC000872451985	FF	On-Demand	Anodyne	CACNA1I	47	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CO	ZINC000872452027	DD	On-Demand	Anodyne	CASP3	106	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CO	ZINC000872452027	DD	On-Demand	Anodyne	CASP7	118	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CO	ZINC000872452028	DD	On-Demand	Anodyne	CASP3	106	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CO	ZINC000872452028	DD	On-Demand	Anodyne	CASP7	118	44
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	ADRB3	26	42
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	MMP13	19	41
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	MMP2	17	41
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	MMP8	15	41
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	MMP9	17	44
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	MMP12	18	41
COc1ccc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452032	GF	On-Demand	Anodyne	FFAR4	21	41
CN1CCC(N2CC[C@@H](Nc3cc(C(N)=O)nc(Cl)n3)C2)CC1	ZINC000872452053	EC	On-Demand	Anodyne	SLC6A5	18	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(CO)CC3)cc2N1	ZINC000872452058	FE	On-Demand	Anodyne	PKM	25	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2ccc(O)cc2CC1	ZINC000872452085	EE	On-Demand	Mild	DRD1	20	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2ccc(O)cc2CC1	ZINC000872452085	EE	On-Demand	Mild	DRD5	38	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2ccc(O)cc2CC1	ZINC000872452085	EE	On-Demand	Mild	AKR1C3	56	47
O=S(=O)(c1ccc(F)c(C(F)F)c1)N(CCO)Cc1ccccc1	ZINC000872452109	FF	On-Demand	Anodyne	MMP8	28	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N(CCO)Cc1ccccc1	ZINC000872452109	FF	On-Demand	Anodyne	MMP1	17	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N(CCO)Cc1ccccc1	ZINC000872452109	FF	On-Demand	Anodyne	RORC	22	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000872452118	EF	On-Demand	Mild	L3MBTL3	70	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000872452119	EF	On-Demand	Mild	L3MBTL3	70	42
CC(C)n1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872452159	GF	On-Demand	Anodyne	PKM	37	44
NS(=O)(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872452164	FE	On-Demand	Anodyne	ADK	18	41
NC(=O)[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872452176	FE	On-Demand	Anodyne	LEF	24	40
NC(=O)[C@H]1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872452177	FE	On-Demand	Anodyne	LEF	24	40
NC(=O)[C@H]1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872452178	FE	On-Demand	Anodyne	LEF	24	40
NC(=O)[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872452179	FE	On-Demand	Anodyne	LEF	24	40
Cc1ccc(S(=O)(=O)N2CC[C@H](O)C2)c(C#N)c1	ZINC000872452209	CC	On-Demand	Mild	EPHX2	19	43
Cc1ccc(S(=O)(=O)N2CC[C@H](O)C2)c(C#N)c1	ZINC000872452209	CC	On-Demand	Mild	TRPV4	44	36
O=S(=O)(CC1CC2(CCC2)C1)N1CCC(CCO)CC1	ZINC000872452271	DD	On-Demand	Anodyne	ADAMTS4	41	33
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)CC1	ZINC000872452272	DD	On-Demand	Anodyne	PKM	48	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)CC1	ZINC000872452272	DD	On-Demand	Anodyne	GCK	42	33
O=S(=O)(NC[C@@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452293	GE	On-Demand	Anodyne	ADRB2	35	48
O=S(=O)(NC[C@@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452293	GE	On-Demand	Anodyne	ADRB1	48	48
O=S(=O)(NC[C@@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452293	GE	On-Demand	Anodyne	GRIN1	26	40
O=S(=O)(NC[C@@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452293	GE	On-Demand	Anodyne	ADRB3	41	48
O=S(=O)(NC[C@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452294	GE	On-Demand	Anodyne	ADRB2	35	48
O=S(=O)(NC[C@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452294	GE	On-Demand	Anodyne	ADRB1	48	48
O=S(=O)(NC[C@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452294	GE	On-Demand	Anodyne	GRIN1	26	40
O=S(=O)(NC[C@H](O)COc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452294	GE	On-Demand	Anodyne	ADRB3	41	48
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000872452299	DE	On-Demand	Anodyne	SIRT3	54	45
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000872452299	DE	On-Demand	Anodyne	SIRT2	45	38
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000872452300	DE	On-Demand	Anodyne	SIRT3	54	45
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000872452300	DE	On-Demand	Anodyne	SIRT2	45	38
O=S(=O)(CC1CC2(CCC2)C1)NC[C@H](O)c1cccc(Cl)c1	ZINC000872452317	EF	On-Demand	Anodyne	ADRB1	31	41
O=S(=O)(CC1CC2(CCC2)C1)NC[C@H](O)c1cccc(Cl)c1	ZINC000872452317	EF	On-Demand	Anodyne	ADRB3	43	41
O=S(=O)(CC1CC2(CCC2)C1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872452322	EF	On-Demand	Anodyne	ADRB1	31	41
O=S(=O)(CC1CC2(CCC2)C1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000872452322	EF	On-Demand	Anodyne	ADRB3	43	41
Cc1c(F)ncnc1N[C@@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872452329	DD	On-Demand	Anodyne	SIRT3	40	31
Cc1c(F)ncnc1N[C@@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872452329	DD	On-Demand	Anodyne	SIRT1	40	31
Cc1c(F)ncnc1N[C@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872452331	DD	On-Demand	Anodyne	SIRT3	40	31
Cc1c(F)ncnc1N[C@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000872452331	DD	On-Demand	Anodyne	SIRT1	40	31
Cc1ccc(S(=O)(=O)N2CCc3ccc(O)cc3CC2)c(C#N)c1	ZINC000872452361	EE	On-Demand	Mild	DRD1	17	42
Cc1ccc(S(=O)(=O)N2CCc3ccc(O)cc3CC2)c(C#N)c1	ZINC000872452361	EE	On-Demand	Mild	DRD5	37	42
Cc1ccc(S(=O)(=O)N2CCc3ccc(O)cc3CC2)c(C#N)c1	ZINC000872452361	EE	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2CCc3ccc(O)cc3CC2)c(C#N)c1	ZINC000872452361	EE	On-Demand	Mild	AKR1C3	39	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)c3ccccc3)cc2N1	ZINC000872452371	GF	On-Demand	Anodyne	PKM	40	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)c3ccccc3)cc2N1	ZINC000872452372	GF	On-Demand	Anodyne	PKM	40	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@H](O)C3)cc2N1	ZINC000872452395	ED	On-Demand	Anodyne	PKM	30	43
CCCN(CCO)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452398	FE	On-Demand	Anodyne	PKM	33	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(O)CCC3)cc2N1	ZINC000872452399	FD	On-Demand	Anodyne	PKM	38	46
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(CO)CC1	ZINC000872452404	DE	On-Demand	Anodyne	PKM	42	39
O=S(=O)(N[C@@H](CO)Cc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452413	FF	On-Demand	Anodyne	TRY2_BOVIN	59	34
O=S(=O)(N[C@@H](CO)Cc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452413	FF	On-Demand	Anodyne	LEF	31	41
O=S(=O)(N[C@H](CO)Cc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452414	FF	On-Demand	Anodyne	TRY2_BOVIN	59	34
O=S(=O)(N[C@H](CO)Cc1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872452414	FF	On-Demand	Anodyne	LEF	31	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(O)CCCC3)cc2N1	ZINC000872452417	FE	On-Demand	Anodyne	PKM	38	46
O=S(=O)(NCCCN1CCC(O)CC1)c1cccc(Br)n1	ZINC000872452424	GC	On-Demand	Anodyne	HTR2A	30	40
O=S(=O)(NCCCN1CCC(O)CC1)c1cccc(Br)n1	ZINC000872452424	GC	On-Demand	Anodyne	HTR7	48	40
O=S(=O)(NCCCN1CCC(O)CC1)c1cccc(Br)n1	ZINC000872452424	GC	On-Demand	Anodyne	HTR6	19	40
Cc1cccc(C#N)c1S(=O)(=O)NC[C@H](O)COCC(C)C	ZINC000872452452	ED	On-Demand	Mild	ADRB1	40	32
Cc1cccc(C#N)c1S(=O)(=O)NC[C@@H](O)COCC(C)C	ZINC000872452453	ED	On-Demand	Mild	ADRB1	40	32
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccccc3CO)cc2N1	ZINC000872452464	GF	On-Demand	Anodyne	PKM	39	45
COCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872452468	CG	On-Demand	Anodyne	P2RY12	18	41
COCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872452468	CG	On-Demand	Anodyne	DCK	34	43
O=S(=O)(c1cccc(Br)n1)N1CCc2ccc(O)cc2CC1	ZINC000872452484	GE	On-Demand	Anodyne	DRD5	20	42
O=S(=O)(c1cccc(Br)n1)N1CCc2ccc(O)cc2CC1	ZINC000872452484	GE	On-Demand	Anodyne	AKR1C3	56	48
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452493	EG	On-Demand	Anodyne	SIRT3	31	42
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452493	EG	On-Demand	Anodyne	SIRT2	25	42
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452493	EG	On-Demand	Anodyne	SIRT1	24	42
CC(C)(C)C(=O)NC[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452494	EG	On-Demand	Anodyne	SIRT3	31	42
CC(C)(C)C(=O)NC[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452494	EG	On-Demand	Anodyne	SIRT2	25	42
CC(C)(C)C(=O)NC[C@H]1CCCN(c2ccnc3ncccc23)C1	ZINC000872452494	EG	On-Demand	Anodyne	SIRT1	24	42
COCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872452507	DH	On-Demand	Anodyne	PDE4D	21	40
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872452508	EE	On-Demand	Anodyne	CACNA1I	54	37
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872452508	EE	On-Demand	Anodyne	SIRT3	36	43
CC(C)(C)C(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872452509	EE	On-Demand	Anodyne	CACNA1I	54	37
CC(C)(C)C(=O)NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872452509	EE	On-Demand	Anodyne	SIRT3	36	43
COCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872452541	CD	On-Demand	Anodyne	SIRT3	41	31
CN(Cc1ccc(O)cc1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452556	GG	On-Demand	Anodyne	PKM	32	41
Cc1ccc(S(=O)(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c(C#N)c1	ZINC000872452560	GD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c(C#N)c1	ZINC000872452561	GD	On-Demand	Mild	TRPV4	43	35
CCC[C@](C)(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452569	FE	On-Demand	Anodyne	PKM	38	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3cccc(CO)c3)cc2N1	ZINC000872452623	GF	On-Demand	Anodyne	PKM	38	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H](O)C3CC3)cc2N1	ZINC000872452639	FD	On-Demand	Anodyne	PKM	39	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H](O)C3CC3)cc2N1	ZINC000872452640	FD	On-Demand	Anodyne	PKM	39	46
CCC[C@@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452655	FE	On-Demand	Anodyne	PKM	40	48
CCC[C@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452656	FE	On-Demand	Anodyne	PKM	40	48
C[C@H](CCO)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872452657	EE	On-Demand	Anodyne	CRTM	15	45
C[C@@H](CCO)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872452658	EE	On-Demand	Anodyne	CRTM	15	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(CCO)CC3)cc2N1	ZINC000872452665	GE	On-Demand	Anodyne	PKM	24	40
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452695	FH	On-Demand	Anodyne	SIRT3	27	40
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452695	FH	On-Demand	Anodyne	SIRT2	23	40
CC(C)(C)C(=O)NC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452695	FH	On-Demand	Anodyne	VCP	44	39
CC(C)(C)C(=O)NC[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452696	FH	On-Demand	Anodyne	SIRT3	27	40
CC(C)(C)C(=O)NC[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452696	FH	On-Demand	Anodyne	SIRT2	23	40
CC(C)(C)C(=O)NC[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872452696	FH	On-Demand	Anodyne	VCP	44	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H](O)C(F)(F)F)cc2N1	ZINC000872452703	GD	On-Demand	Anodyne	PKM	40	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H](O)C(F)(F)F)cc2N1	ZINC000872452704	GD	On-Demand	Anodyne	PKM	40	46
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(CCO)CC1	ZINC000872452712	EF	On-Demand	Anodyne	PKM	40	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(CCO)CC1	ZINC000872452712	EF	On-Demand	Anodyne	ADAMTS4	54	34
CN1CCC(N2CC[C@@H](Nc3cc(-c4ccccc4)ncn3)C2)CC1	ZINC000872452714	EF	On-Demand	Anodyne	SLC6A5	17	44
CN1CCC(N2CC[C@@H](Nc3cc(-c4ccccc4)ncn3)C2)CC1	ZINC000872452714	EF	On-Demand	Anodyne	PKNB	20	45
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccc(O)cc2)CC1	ZINC000872452727	GF	On-Demand	Mild	EPHX2	28	41
CN1CCC(N2CC[C@@H](Nc3cc(Cl)nnc3O)C2)CC1	ZINC000872452730	DD	On-Demand	Anodyne	SLC6A5	15	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(O)CCCCC3)cc2N1	ZINC000872452741	GF	On-Demand	Anodyne	PKM	38	45
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	HTR1A	17	52
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	HTR1D	48	52
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	HTR1B	36	52
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	MPO	86	46
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	MTNR1A	31	54
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	MTNR1B	17	54
COc1ccc2[nH]cc(CCNc3ncnc(F)c3C)c2c1	ZINC000872452765	DG	On-Demand	Anodyne	ABCG2	24	42
CC[C@@H](C)[C@@H](O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872452772	EE	On-Demand	Anodyne	LEF	31	44
CC[C@@H](C)[C@H](O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872452773	EE	On-Demand	Anodyne	LEF	31	44
CC[C@H](C)[C@H](O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872452774	EE	On-Demand	Anodyne	LEF	31	44
Cc1c(F)ncnc1NC1CCN(C(=O)OC(C)C)CC1	ZINC000872452776	CE	On-Demand	Anodyne	GPR119	80	52
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CCO)CC1	ZINC000872452815	DC	On-Demand	Mild	CCR8	77	36
CC(C)(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452833	ED	On-Demand	Anodyne	PKM	40	49
Cc1cccc(C#N)c1S(=O)(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000872452854	GE	On-Demand	Mild	MCHR1	18	42
C#CCSCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872452898	FE	On-Demand	Mild	PKM	33	44
COc1cccc(CNc2nc(N)nc(C(F)F)n2)c1OC1CCCC1	ZINC000872452956	FG	On-Demand	Anodyne	DHFR	17	40
Cn1ncc2c(N3CCC[C@@H](Oc4ccccc4)C3)nc(Cl)nc21	ZINC000872452957	EG	On-Demand	Anodyne	PDE3B	41	35
Cn1ncc2c(N3CCC[C@H](Oc4ccccc4)C3)nc(Cl)nc21	ZINC000872452958	EG	On-Demand	Anodyne	PDE3B	41	35
O=S(=O)(NC[C@@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452969	GF	On-Demand	Anodyne	ADRB2	20	40
O=S(=O)(NC[C@@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452969	GF	On-Demand	Anodyne	ADRB1	23	40
O=S(=O)(NC[C@@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452969	GF	On-Demand	Anodyne	ADRB3	21	40
O=S(=O)(NC[C@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452970	GF	On-Demand	Anodyne	ADRB2	20	40
O=S(=O)(NC[C@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452970	GF	On-Demand	Anodyne	ADRB1	23	40
O=S(=O)(NC[C@H](O)COc1cccc(F)c1)c1ccc(F)c(C(F)F)c1	ZINC000872452970	GF	On-Demand	Anodyne	ADRB3	21	40
Cc1c(F)ncnc1NCc1ccccc1S(=O)(=O)N(C)CCO	ZINC000872452978	FD	On-Demand	Anodyne	PTK2	40	34
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H]1CO	ZINC000872452981	DC	On-Demand	Anodyne	CASP3	46	33
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H]1CO	ZINC000872452981	DC	On-Demand	Anodyne	CASP7	52	33
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H]1CO	ZINC000872452982	DC	On-Demand	Anodyne	CASP3	46	33
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H]1CO	ZINC000872452982	DC	On-Demand	Anodyne	CASP7	52	33
COc1ccc([C@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452985	GG	On-Demand	Anodyne	MMP13	25	41
COc1ccc([C@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452985	GG	On-Demand	Anodyne	MMP8	16	41
COc1ccc([C@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452985	GG	On-Demand	Anodyne	MMP12	18	41
COc1ccc([C@@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452986	GG	On-Demand	Anodyne	MMP13	25	41
COc1ccc([C@@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452986	GG	On-Demand	Anodyne	MMP8	16	41
COc1ccc([C@@H](CCO)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC000872452986	GG	On-Demand	Anodyne	MMP12	18	41
CC[C@@](C)(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872453076	FE	On-Demand	Anodyne	PKM	39	47
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@@H](O)C(F)(F)F	ZINC000872453079	GF	On-Demand	Anodyne	CASP3	41	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@@H](O)C(F)(F)F	ZINC000872453079	GF	On-Demand	Anodyne	CASP7	48	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@H](O)C(F)(F)F	ZINC000872453080	GF	On-Demand	Anodyne	CASP3	41	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@H](O)C(F)(F)F	ZINC000872453080	GF	On-Demand	Anodyne	CASP7	48	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@H](O)C(F)(F)F	ZINC000872453081	GF	On-Demand	Anodyne	CASP3	41	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@H](O)C(F)(F)F	ZINC000872453081	GF	On-Demand	Anodyne	CASP7	48	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@@H](O)C(F)(F)F	ZINC000872453082	GF	On-Demand	Anodyne	CASP3	41	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@@H](O)C(F)(F)F	ZINC000872453082	GF	On-Demand	Anodyne	CASP7	48	34
C[C@@H](O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872453106	EF	On-Demand	Anodyne	PKM	42	38
C#CCNC(=O)CN1CCCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872453114	ED	On-Demand	Mild	SLC27A1	51	35
O=S(=O)(N[C@H](CCO)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872453163	FG	On-Demand	Anodyne	LEF	32	44
CCOC(=O)[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872453221	EC	On-Demand	Mild	TRPV4	43	35
CCOC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872453222	EC	On-Demand	Mild	TRPV4	43	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](O)C1	ZINC000872453273	CD	On-Demand	Anodyne	GCKR	49	32
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3ccccc3O)cc2N1	ZINC000872453276	GF	On-Demand	Anodyne	PKM	39	47
Cc1cccc(C#N)c1S(=O)(=O)NCCCN1CCC(O)CC1	ZINC000872453307	EC	On-Demand	Mild	CCR3	15	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(O)CC3)cc2N1	ZINC000872453319	FD	On-Demand	Anodyne	PKM	25	42
O=S(=O)(NCCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453336	FD	On-Demand	Anodyne	HTR2A	26	47
O=S(=O)(NCCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453336	FD	On-Demand	Anodyne	HTR7	54	50
O=S(=O)(NCCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453336	FD	On-Demand	Anodyne	CCR1	15	48
O=S(=O)(NCCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453336	FD	On-Demand	Anodyne	HTR6	22	47
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CO	ZINC000872453341	CD	On-Demand	Mild	CASP3	58	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CO	ZINC000872453341	CD	On-Demand	Mild	CASP7	65	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CO	ZINC000872453342	CD	On-Demand	Mild	CASP3	58	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CO	ZINC000872453342	CD	On-Demand	Mild	CASP7	65	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(CCO)CC1	ZINC000872453346	FD	On-Demand	Anodyne	PKM	43	40
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)N1CCC[C@H](OCCO)C1	ZINC000872453376	GE	On-Demand	Anodyne	LIPG	35	44
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)N1CCC[C@@H](OCCO)C1	ZINC000872453378	GE	On-Demand	Anodyne	LIPG	35	44
C[C@@H](O)C1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872453412	GE	On-Demand	Anodyne	PKM	28	41
CCOC[C@H](O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872453437	FC	On-Demand	Mild	TRPV4	44	36
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C[C@@H](C)O	ZINC000872453472	FE	On-Demand	Anodyne	PKM	43	50
O=S(=O)(NC[C@@H](O)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453505	DD	On-Demand	Anodyne	LEF	26	40
O=S(=O)(NC[C@H](O)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453507	DD	On-Demand	Anodyne	LEF	26	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CCO)C3CC3)cc2N1	ZINC000872453510	FE	On-Demand	Anodyne	PKM	38	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CCO)C3CC3)cc2N1	ZINC000872453512	FE	On-Demand	Anodyne	PKM	38	44
c1ccc(-c2cc(N3CCN(C4CCC4)CC3)ncn2)cc1	ZINC000872453577	CF	On-Demand	Anodyne	HRH3	25	47
c1ccc(-c2cc(N3CCN(C4CCC4)CC3)ncn2)cc1	ZINC000872453577	CF	On-Demand	Anodyne	EBP	30	44
COC[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872453586	CG	On-Demand	Anodyne	PDE3A	30	41
CC[C@H](C)[C@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872453588	FE	On-Demand	Anodyne	PKM	40	47
CC[C@@H](C)[C@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872453589	FE	On-Demand	Anodyne	PKM	40	47
CC[C@@H](C)[C@@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872453590	FE	On-Demand	Anodyne	PKM	40	47
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872453592	FD	On-Demand	Anodyne	PKM	46	38
O=S(=O)(C(F)F)N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872453640	GF	On-Demand	Anodyne	VCP	59	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2nnc(N(C)C)cc2C1	ZINC000872453660	FD	On-Demand	Mild	AKR1C3	44	37
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	DRD2	15	53
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	ADRA1D	27	40
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	ADRA1A	22	40
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	ADRA1B	23	40
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	HTR7	22	55
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	SFRP1	119	45
O=S(=O)(NC1CCN(CCO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453665	FD	On-Demand	Anodyne	WNT3	80	35
CCS(=O)(=O)C[C@@H](C)Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872453680	EF	On-Demand	Anodyne	ADORA2B	18	43
CCS(=O)(=O)C[C@H](C)Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872453681	EF	On-Demand	Anodyne	ADORA2B	18	43
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872453689	GG	On-Demand	Anodyne	NPY2R	71	44
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872453689	GG	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872453689	GG	On-Demand	Anodyne	TYK2	46	36
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872453689	GG	On-Demand	Anodyne	ERBB4	43	33
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872453689	GG	On-Demand	Anodyne	MCHR1	28	40
C[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cccc(Br)n1	ZINC000872453729	GE	On-Demand	Anodyne	RORC	31	42
COC(=O)C[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453753	GE	On-Demand	Anodyne	MMP13	17	42
COC(=O)C[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453753	GE	On-Demand	Anodyne	MMP3	17	42
COC(=O)C[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453753	GE	On-Demand	Anodyne	CASP7	49	35
COC(=O)C[C@@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453753	GE	On-Demand	Anodyne	MMP1	21	42
COC(=O)C[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453754	GE	On-Demand	Anodyne	MMP13	17	42
COC(=O)C[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453754	GE	On-Demand	Anodyne	MMP3	17	42
COC(=O)C[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453754	GE	On-Demand	Anodyne	CASP7	49	35
COC(=O)C[C@H]1CSCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453754	GE	On-Demand	Anodyne	MMP1	21	42
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	EGFR	43	47
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	MPL	20	40
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	NPY2R	50	39
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	GRM4	35	40
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	EPHX2	29	45
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	TYK2	63	39
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	ERBB4	56	35
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000872453765	FH	On-Demand	Anodyne	LIMK2	38	50
CC[C@H](CCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453766	DE	On-Demand	Anodyne	LEF	37	44
CC[C@@H](CCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872453767	DE	On-Demand	Anodyne	LEF	37	44
c1cnc2nccc(N3CCN(C4CCC4)CC3)c2c1	ZINC000872453776	CE	On-Demand	Anodyne	EBP	29	40
Cc1ccc(S(=O)(=O)N2CCN(CC(C)(C)O)CC2)c(C#N)c1	ZINC000872453787	EC	On-Demand	Mild	TRPV4	47	38
O=S(=O)(NC[C@@H](O)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872453853	FD	On-Demand	Anodyne	LEF	22	46
O=S(=O)(NC[C@H](O)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872453854	FD	On-Demand	Anodyne	LEF	22	46
c1cc(N2CCN(C3CCC3)CC2)c(C2CC2)cn1	ZINC000872453871	CF	On-Demand	Anodyne	EBP	26	40
Cc1ccc(S(=O)(=O)N2CCN(Cc3nnc(C)n3C)CC2)c(C#N)c1	ZINC000872453884	FC	On-Demand	Mild	TRPV4	40	33
CCO[C@@H]1C[C@H](O)C12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872453885	FD	On-Demand	Mild	TRPV4	48	41
CCO[C@@H]1C[C@@H](O)C12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872453886	FD	On-Demand	Mild	TRPV4	48	41
CCO[C@H]1C[C@H](O)C12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872453887	FD	On-Demand	Mild	TRPV4	48	41
CCO[C@H]1C[C@@H](O)C12CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872453888	FD	On-Demand	Mild	TRPV4	48	41
NC(=O)c1cc(N2CCC[C@@H](Oc3ccccc3)C2)nc(Cl)n1	ZINC000872453894	EE	On-Demand	Anodyne	SCD1	17	40
NC(=O)c1cc(N2CCC[C@H](Oc3ccccc3)C2)nc(Cl)n1	ZINC000872453895	EE	On-Demand	Anodyne	SCD1	17	40
Cc1csc([C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C2CC2)n1	ZINC000872453920	GH	On-Demand	Anodyne	LEF	28	41
O=S(=O)(N[C@@H](CCCO)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872453947	FH	On-Demand	Anodyne	LEF	32	42
O=S(=O)(N[C@H](CCCO)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872453948	FH	On-Demand	Anodyne	LEF	32	42
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCC[C@@H](O)C(F)(F)F	ZINC000872453956	GF	On-Demand	Anodyne	CRTM	15	45
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCC[C@H](O)C(F)(F)F	ZINC000872453957	GF	On-Demand	Anodyne	CRTM	15	45
Oc1nnc(Cl)cc1N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000872453964	FG	On-Demand	Anodyne	PIM1	15	43
Oc1nnc(Cl)cc1N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000872453965	FG	On-Demand	Anodyne	PIM1	15	43
O=S(=O)(N[C@H](CCO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453988	DE	On-Demand	Anodyne	LEF	38	47
O=S(=O)(N[C@@H](CCO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872453989	DE	On-Demand	Anodyne	LEF	38	47
OC[C@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872454006	CE	On-Demand	Anodyne	VCP	50	36
OC[C@@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872454007	CE	On-Demand	Anodyne	VCP	50	36
NC(=O)c1cc(NCC2CCSCC2)nc(Cl)n1	ZINC000872454085	CD	On-Demand	Anodyne	VCP	51	37
Cc1ccc(S(=O)(=O)N2CCN(C[C@@H](C)O)CC2)c(C#N)c1	ZINC000872454088	DC	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CCN(C[C@H](C)O)CC2)c(C#N)c1	ZINC000872454089	DC	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CCN(Cc3cccc(O)c3)CC2)c(C#N)c1	ZINC000872454118	FE	On-Demand	Mild	ADORA2B	41	35
Cc1ccc(S(=O)(=O)N2CCN(Cc3cccc(O)c3)CC2)c(C#N)c1	ZINC000872454118	FE	On-Demand	Mild	TRPV4	45	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)C3CC3)cc2N1	ZINC000872454139	FD	On-Demand	Anodyne	PKM	41	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)C3CC3)cc2N1	ZINC000872454140	FD	On-Demand	Anodyne	PKM	41	48
O=C(C1CCCCC1)N1CCN(CCNc2cc(Cl)nnc2O)CC1	ZINC000872454143	FD	On-Demand	Anodyne	HNMT	44	34
C[C@H](CCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872454173	CD	On-Demand	Anodyne	LEF	42	45
C[C@@H](CCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872454174	CD	On-Demand	Anodyne	LEF	42	45
CC[C@H](C#N)Oc1cc(CNc2ccnc3ncccc23)ccc1OC	ZINC000872454185	EH	On-Demand	Mild	PDE5A	25	44
CC[C@H](CCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872454186	FE	On-Demand	Anodyne	PKM	39	45
CC[C@@H](CCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872454187	FE	On-Demand	Anodyne	PKM	39	45
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)N(CCCCO)C1CC1	ZINC000872454188	GG	On-Demand	Anodyne	ERG7	17	40
COc1ccc(OC)c2sc(N[C@H](C)CS(C)(=O)=O)nc12	ZINC000872454194	EE	On-Demand	Anodyne	ADORA2B	16	42
COc1ccc(OC)c2sc(N[C@@H](C)CS(C)(=O)=O)nc12	ZINC000872454195	EE	On-Demand	Anodyne	ADORA2B	16	42
c1ccc(-c2cc(NCCOC[C@@H]3CCCO3)ncn2)cc1	ZINC000872454312	CF	On-Demand	Anodyne	TNK2	62	41
c1ccc(-c2cc(NCCOC[C@H]3CCCO3)ncn2)cc1	ZINC000872454313	CF	On-Demand	Anodyne	TNK2	62	41
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(Br)n1	ZINC000872454316	FC	On-Demand	Anodyne	MMP13	34	40
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(Br)n1	ZINC000872454316	FC	On-Demand	Anodyne	MMP2	15	46
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(Br)n1	ZINC000872454316	FC	On-Demand	Anodyne	MMP3	41	40
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(Br)n1	ZINC000872454316	FC	On-Demand	Anodyne	MMP1	35	40
COC(=O)CCCOc1ccc(CNc2ncnc(F)c2C)cc1	ZINC000872454318	EF	On-Demand	Anodyne	LTA4H	16	42
CCOc1cc(CNc2ncnc(F)c2C)ccc1OC	ZINC000872454339	CF	On-Demand	Anodyne	PDE5A	38	42
CCOc1cc(CNc2ncnc(F)c2C)ccc1OC	ZINC000872454339	CF	On-Demand	Anodyne	EGFR	17	53
CCOc1cc(CNc2ncnc(F)c2C)ccc1OC	ZINC000872454339	CF	On-Demand	Anodyne	PDE6A	51	40
CCOc1cc(CNc2ncnc(F)c2C)ccc1OC	ZINC000872454339	CF	On-Demand	Anodyne	DRTS_TRYCR	51	38
Cc1c(F)ncnc1N[C@@H]1CCC[C@@H](C(=O)N(C)C)C1	ZINC000872454353	CD	On-Demand	Anodyne	CD38	17	40
Cc1c(F)ncnc1N[C@H]1CCC[C@@H](C(=O)N(C)C)C1	ZINC000872454354	CD	On-Demand	Anodyne	CD38	17	40
Cc1c(F)ncnc1N[C@H]1CCC[C@H](C(=O)N(C)C)C1	ZINC000872454355	CD	On-Demand	Anodyne	CD38	17	40
Cc1c(F)ncnc1N[C@@H]1CCC[C@H](C(=O)N(C)C)C1	ZINC000872454356	CD	On-Demand	Anodyne	CD38	17	40
O=S(=O)(NC1CCN(CCO)CC1)c1cccc(Br)n1	ZINC000872454410	FC	On-Demand	Anodyne	SFRP1	29	40
C[C@@](O)(CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C1CC1	ZINC000872454414	FE	On-Demand	Anodyne	PKM	38	45
O=S(=O)(N[C@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872454453	DD	On-Demand	Anodyne	LEF	40	49
O=S(=O)(N[C@@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872454454	DD	On-Demand	Anodyne	LEF	40	49
Cc1ccc(S(=O)(=O)N2CCN(C)C(=O)C2)c(C#N)c1	ZINC000872454504	CC	On-Demand	Mild	TRPV4	44	36
C[C@H](O)CN(Cc1ccccc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872454509	FE	On-Demand	Anodyne	RORC	29	41
C[C@H](O)CN(Cc1ccccc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872454510	FE	On-Demand	Anodyne	RORC	29	41
Cc1nsc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872454556	GE	On-Demand	Anodyne	PKM	40	41
Cc1c(F)ncnc1NCCOC[C@@H]1CCCO1	ZINC000872454609	CD	On-Demand	Anodyne	TNK2	53	35
Cc1c(F)ncnc1NCCOC[C@H]1CCCO1	ZINC000872454610	CD	On-Demand	Anodyne	TNK2	53	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3cscn3)cc2N1	ZINC000872454613	GF	On-Demand	Anodyne	PKM	29	43
CCOc1cc(CNc2cc(Cl)nnc2O)ccc1OC	ZINC000872454617	DF	On-Demand	Anodyne	PDE5A	38	41
CCOc1cc(CNc2cc(Cl)nnc2O)ccc1OC	ZINC000872454617	DF	On-Demand	Anodyne	PDE6A	48	40
CCOc1cc(CNc2cc(Cl)nnc2O)ccc1OC	ZINC000872454617	DF	On-Demand	Anodyne	DRTS_TRYCR	52	37
CCOc1cc(CNc2nc(Cl)nc3c2cnn3C)ccc1OC	ZINC000872454618	EG	On-Demand	Anodyne	PDE5A	45	44
CCOc1cc(CNc2nc(Cl)nc3c2cnn3C)ccc1OC	ZINC000872454618	EG	On-Demand	Anodyne	PDE6A	45	35
CCOc1cc(CNc2nc(Cl)nc3c2cnn3C)ccc1OC	ZINC000872454618	EG	On-Demand	Anodyne	DRTS_TRYCR	48	35
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccncc1	ZINC000872454636	GG	On-Demand	Anodyne	PKM	38	45
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccncc1	ZINC000872454637	GG	On-Demand	Anodyne	PKM	38	45
CCOC[C@H](O)CN1CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872454672	FC	On-Demand	Mild	ABCB1	43	41
C[C@H](CCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872454683	ED	On-Demand	Anodyne	PKM	41	47
C[C@@H](CCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872454685	ED	On-Demand	Anodyne	PKM	41	47
CC(C)(C)[C@@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872454700	FE	On-Demand	Anodyne	PKM	41	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCSCCCO)cc2N1	ZINC000872454717	GE	On-Demand	Anodyne	PKM	36	44
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NC1CCN(CCO)CC1	ZINC000872454727	GE	On-Demand	Anodyne	SLC6A5	33	51
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NC1CCN(CCO)CC1	ZINC000872454727	GE	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)[C@@H](O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872454736	EE	On-Demand	Anodyne	LEF	33	40
O=S(=O)(NCCCCN1CCC[C@@H]1CO)c1ccc(F)c(C(F)F)c1	ZINC000872454741	GE	On-Demand	Anodyne	HTR7	28	41
O=S(=O)(NCCCCN1CCC[C@H]1CO)c1ccc(F)c(C(F)F)c1	ZINC000872454742	GE	On-Demand	Anodyne	HTR7	28	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](CN3CCCC3)C2)c(C#N)c1	ZINC000872454846	ED	On-Demand	Mild	EPHX2	18	42
Cc1ccc(S(=O)(=O)N2CC[C@H](CN3CCCC3)C2)c(C#N)c1	ZINC000872454847	ED	On-Demand	Mild	EPHX2	18	42
O=C1CCC(=O)N1CCNc1cc(-c2cccc(Cl)c2)ncn1	ZINC000872454867	EE	On-Demand	Anodyne	HRP1_PLAFA	40	33
Cc1cccc(C#N)c1S(=O)(=O)N(Cc1ccccc1)C[C@H](C)O	ZINC000872454880	EE	On-Demand	Mild	RORC	24	40
Cc1cccc(C#N)c1S(=O)(=O)N(Cc1ccccc1)C[C@@H](C)O	ZINC000872454881	EE	On-Demand	Mild	RORC	24	40
CC[C@H](CCO)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872454895	CD	On-Demand	Mild	NR3C2	17	43
CC[C@@H](CCO)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872454896	CD	On-Demand	Mild	NR3C2	17	43
NC(=O)c1cc(NC[C@H]2CCCN2Cc2ccccc2)nc(Cl)n1	ZINC000872454902	EE	On-Demand	Anodyne	DRD2	20	42
NC(=O)c1cc(NC[C@H]2CCCN2Cc2ccccc2)nc(Cl)n1	ZINC000872454902	EE	On-Demand	Anodyne	SIGMAR1	15	43
NC(=O)c1cc(NC[C@@H]2CCCN2Cc2ccccc2)nc(Cl)n1	ZINC000872454903	EE	On-Demand	Anodyne	DRD2	20	42
NC(=O)c1cc(NC[C@@H]2CCCN2Cc2ccccc2)nc(Cl)n1	ZINC000872454903	EE	On-Demand	Anodyne	SIGMAR1	15	43
Cc1c(F)ncnc1N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000872454906	DF	On-Demand	Anodyne	GPR119	66	44
Cc1c(F)ncnc1N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000872454907	DF	On-Demand	Anodyne	GPR119	66	44
C[C@@](O)(CNc1nc(N)nc(C(F)F)n1)c1ccccc1	ZINC000872454920	CD	On-Demand	Anodyne	TPH1	40	36
CCOc1cc(CNc2cc(C(N)=O)nc(Cl)n2)ccc1OC	ZINC000872454924	EE	On-Demand	Anodyne	PDE5A	44	39
CCOc1cc(CNc2cc(C(N)=O)nc(Cl)n2)ccc1OC	ZINC000872454924	EE	On-Demand	Anodyne	SSTR5	41	38
CCOc1cc(CNc2cc(C(N)=O)nc(Cl)n2)ccc1OC	ZINC000872454924	EE	On-Demand	Anodyne	PDE6A	47	37
CCOc1cc(CNc2cc(C(N)=O)nc(Cl)n2)ccc1OC	ZINC000872454924	EE	On-Demand	Anodyne	DRTS_TRYCR	56	40
CS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872454993	GE	On-Demand	Anodyne	SLC9A1	19	47
CS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccncc3C3CC3)CC2)c1	ZINC000872454993	GE	On-Demand	Anodyne	SLC6A9	32	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c(C#N)c1	ZINC000872455057	GF	On-Demand	Mild	EPHX2	19	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c(C#N)c1	ZINC000872455058	GF	On-Demand	Mild	EPHX2	19	40
Cc1ccc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c(C#N)c1	ZINC000872455059	GF	On-Demand	Mild	EPHX2	19	40
Cc1ccc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c(C#N)c1	ZINC000872455060	GF	On-Demand	Mild	EPHX2	19	40
NC1(CO)CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872455076	DE	On-Demand	Anodyne	AKT2	33	44
Cc1ccc(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)c(C#N)c1	ZINC000872455105	GE	On-Demand	Mild	TRPV4	41	34
COc1cc(F)c([C@@H](C)Nc2nc(Cl)nc3c2cnn3C)cc1OC	ZINC000872455130	FG	On-Demand	Anodyne	Q9M629_MAIZE	40	38
COc1cc(F)c([C@H](C)Nc2nc(Cl)nc3c2cnn3C)cc1OC	ZINC000872455131	FG	On-Demand	Anodyne	Q9M629_MAIZE	40	38
COC(=O)CCCOc1ccc(CNc2nc(Cl)nc3c2cnn3C)cc1	ZINC000872455174	GF	On-Demand	Anodyne	DNAE	51	33
CS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872455193	GD	On-Demand	Anodyne	SLC6A9	34	40
CC[C@H](C#N)Oc1cc(CNc2ncnc(F)c2C)ccc1OC	ZINC000872455206	EG	On-Demand	Mild	PDE6A	43	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000872455210	DD	On-Demand	Mild	CCR8	68	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000872455212	DD	On-Demand	Mild	CCR8	68	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000872455213	DD	On-Demand	Mild	CCR8	68	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000872455215	DD	On-Demand	Mild	CCR8	68	34
CCOC(=O)[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872455226	FD	On-Demand	Anodyne	GCKR	64	32
CCOC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872455227	FD	On-Demand	Anodyne	GCKR	64	32
Cc1c(F)ncnc1N1CCC[C@H](Oc2ccccc2)C1	ZINC000872455232	CF	On-Demand	Anodyne	PDE3A	48	44
Cc1c(F)ncnc1N1CCC[C@H](Oc2ccccc2)C1	ZINC000872455232	CF	On-Demand	Anodyne	DCK	46	38
Cc1c(F)ncnc1N1CCC[C@H](Oc2ccccc2)C1	ZINC000872455232	CF	On-Demand	Anodyne	PDE3B	52	44
Cc1c(F)ncnc1N1CCC[C@@H](Oc2ccccc2)C1	ZINC000872455233	CF	On-Demand	Anodyne	PDE3A	48	44
Cc1c(F)ncnc1N1CCC[C@@H](Oc2ccccc2)C1	ZINC000872455233	CF	On-Demand	Anodyne	DCK	46	38
Cc1c(F)ncnc1N1CCC[C@@H](Oc2ccccc2)C1	ZINC000872455233	CF	On-Demand	Anodyne	PDE3B	52	44
CC[C@H](C#N)Oc1cc(CNc2nc(Cl)nc3c2cnn3C)ccc1OC	ZINC000872455235	GG	On-Demand	Mild	PDE5A	35	41
COC(=O)CCCOc1ccc(CNc2cc(Cl)nnc2O)cc1	ZINC000872455251	FF	On-Demand	Anodyne	PPO2	20	40
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	DHFR	33	45
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	DRTS_PLAFK	39	42
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	DRTS_TOXGO	47	46
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	DYR_PNECA	29	42
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	AGPAT2	47	37
CCOc1cc(CNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872455289	EE	On-Demand	Anodyne	DRTS_TRYCR	72	45
COCCCOC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872455310	FE	On-Demand	Mild	TRPV4	43	35
CC[C@@H](O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455325	EF	On-Demand	Anodyne	LEF	30	42
CC[C@H](O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455326	EF	On-Demand	Anodyne	LEF	30	42
C[C@@H]1C[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CCN1C	ZINC000872455358	GG	On-Demand	Anodyne	SLC6A5	31	40
C[C@H]1C[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CCN1C	ZINC000872455359	GG	On-Demand	Anodyne	SLC6A5	31	40
Nc1nc(N[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)nc(C(F)F)n1	ZINC000872455378	GF	On-Demand	Anodyne	HRH4	48	34
Nc1nc(N[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)nc(C(F)F)n1	ZINC000872455379	GF	On-Demand	Anodyne	HRH4	48	34
COC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C(C)C	ZINC000872455384	FF	On-Demand	Anodyne	PKM	38	45
COC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C(C)C	ZINC000872455385	FF	On-Demand	Anodyne	PKM	38	45
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)c1ccncc1	ZINC000872455408	EH	On-Demand	Anodyne	LEF	30	40
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)c1ccncc1	ZINC000872455409	EH	On-Demand	Anodyne	LEF	30	40
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872455427	EF	On-Demand	Anodyne	LEF	37	40
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872455428	EF	On-Demand	Anodyne	LEF	37	40
CCOc1cc(CNc2cc(C)nc3c2cnn3C)ccc1OC	ZINC000872455447	EG	On-Demand	Anodyne	DRTS_TRYCR	49	35
Cc1c(F)ncnc1N1CCN(C(=O)c2cccc(S(C)(=O)=O)c2)CC1	ZINC000872455529	GD	On-Demand	Anodyne	SLC6A9	36	41
Oc1nnc(Cl)cc1NC[C@H]1CCCN1Cc1ccccc1	ZINC000872455535	DF	On-Demand	Anodyne	DRD2	24	43
Oc1nnc(Cl)cc1NC[C@@H]1CCCN1Cc1ccccc1	ZINC000872455536	DF	On-Demand	Anodyne	DRD2	24	43
CCC(=O)c1c(Cl)cccc1NCC[C@@H](C)O	ZINC000872455593	CG	On-Demand	Anodyne	CXCL8	45	37
CCC(=O)c1c(Cl)cccc1NCC[C@H](C)O	ZINC000872455594	CG	On-Demand	Anodyne	CXCL8	45	37
C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C	ZINC000872455598	EF	On-Demand	Anodyne	SFRP1	77	34
C[C@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C	ZINC000872455600	EF	On-Demand	Anodyne	SFRP1	77	34
Cc1ccc(S(=O)(=O)N2CCN(c3nc(C)ns3)CC2)c(C#N)c1	ZINC000872455621	FD	On-Demand	Mild	TRPV4	42	34
C[C@@H](CCN(C)C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455636	FE	On-Demand	Anodyne	PKM	38	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC2(CCOCC2)C1	ZINC000872455655	FG	On-Demand	Anodyne	PKM	42	38
CC[C@@H](O)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455656	FE	On-Demand	Anodyne	PKM	39	46
CC[C@H](O)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455657	FE	On-Demand	Anodyne	PKM	39	46
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	MMP13	43	40
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	ADAM17	23	41
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	MMP2	21	47
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	MMP3	55	40
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	MMP7	45	39
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455673	FD	On-Demand	Anodyne	MMP1	44	40
Nc1nc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nc(C(F)F)n1	ZINC000872455704	GG	On-Demand	Anodyne	CCR2	20	45
Nc1nc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nc(C(F)F)n1	ZINC000872455705	GG	On-Demand	Anodyne	CCR2	20	45
C[C@@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCN1C	ZINC000872455713	GE	On-Demand	Anodyne	PKM	31	45
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCN1C	ZINC000872455714	GE	On-Demand	Anodyne	PKM	31	45
C[C@H]1CC(=O)NCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455716	GD	On-Demand	Anodyne	PKM	17	40
C[C@@H]1CC(=O)NCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455717	GD	On-Demand	Anodyne	PKM	17	40
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455725	FH	On-Demand	Anodyne	DRD4	19	47
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455725	FH	On-Demand	Anodyne	MLNR	20	41
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455725	FH	On-Demand	Anodyne	CCR2	35	51
Oc1nnc(Cl)cc1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455725	FH	On-Demand	Anodyne	MCHR1	36	40
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455726	FH	On-Demand	Anodyne	DRD4	19	47
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455726	FH	On-Demand	Anodyne	MLNR	20	41
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455726	FH	On-Demand	Anodyne	CCR2	35	51
Oc1nnc(Cl)cc1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000872455726	FH	On-Demand	Anodyne	MCHR1	36	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCC(F)(F)F)cc2N1	ZINC000872455750	GG	On-Demand	Anodyne	PKM	38	47
CCN1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872455776	FD	On-Demand	Anodyne	PKM	34	45
Cc1ccc(S(=O)(=O)N2CCN(Cc3nccn3C(F)F)CC2)c(C#N)c1	ZINC000872455817	GD	On-Demand	Mild	TRPV4	42	35
C[C@H](C#N)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872455952	EE	On-Demand	Mild	PKM	40	48
CC[C@H](C[C@H](C)CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872455980	EF	On-Demand	Anodyne	LEF	34	42
O=S(=O)(NCC[C@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872456027	FG	On-Demand	Anodyne	TBXA2R	45	38
O=S(=O)(NCC[C@@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872456028	FG	On-Demand	Anodyne	TBXA2R	45	38
NC(=O)C1(c2ccccc2)CCN(c2ccncc2C2CC2)CC1	ZINC000872456048	DF	On-Demand	Anodyne	MLYCD	24	44
Cn1nc2c(cc1=O)CN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)CC2	ZINC000872456065	FD	On-Demand	Anodyne	AKR1C3	53	34
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872456066	EE	On-Demand	Anodyne	Q8WSF8_APLCA	43	43
Oc1nnc(Cl)cc1N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872456066	EE	On-Demand	Anodyne	NACHRBETA2	45	43
Cc1c(F)ncnc1NCc1ccccc1S(=O)(=O)N1CCN(C)CC1	ZINC000872456069	GD	On-Demand	Anodyne	PTK2	40	31
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872456078	DE	On-Demand	Anodyne	ADRA1D	26	40
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872456078	DE	On-Demand	Anodyne	ADRA1A	18	40
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872456078	DE	On-Demand	Anodyne	ADRA1B	20	40
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872456078	DE	On-Demand	Anodyne	HTR7	15	53
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872456078	DE	On-Demand	Anodyne	SFRP1	54	35
CN(Cc1nccn1Cc1ccccc1)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872456128	GF	On-Demand	Anodyne	NR1I2	40	35
CN(Cc1nccn1Cc1ccccc1)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872456130	GF	On-Demand	Anodyne	NR1I2	40	35
CS(=O)(=O)N[C@@H]1CCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872456131	EE	On-Demand	Anodyne	HRH4	36	43
CS(=O)(=O)N[C@H]1CCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872456133	EE	On-Demand	Anodyne	HRH4	36	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCSC3)cc2N1	ZINC000872456148	FE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCSC3)cc2N1	ZINC000872456149	FE	On-Demand	Anodyne	PKM	36	44
CCC1(O)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872456175	DD	On-Demand	Mild	TRPV4	59	52
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872456177	FE	On-Demand	Anodyne	DCK	42	41
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872456177	FE	On-Demand	Anodyne	CHEK2	19	40
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872456177	FE	On-Demand	Anodyne	SCD1	57	56
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872456177	FE	On-Demand	Anodyne	LIPG	17	42
NC(=O)c1cc(N2CCC(Oc3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872456177	FE	On-Demand	Anodyne	SCD	16	40
COc1ccc(OC)c2sc(NCCNC(N)=O)nc12	ZINC000872456191	CD	On-Demand	Anodyne	ADORA2B	18	42
COc1ccc(OC)c2sc(NCCNC(N)=O)nc12	ZINC000872456191	CD	On-Demand	Anodyne	PROKR1	53	32
Cc1c(F)ncnc1N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000872456240	DE	On-Demand	Anodyne	ABCC1	62	41
Cc1cnc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)s1	ZINC000872456256	GF	On-Demand	Anodyne	PKM	36	45
OCCO[C@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872456257	CE	On-Demand	Anodyne	GBA2	48	29
OCCO[C@@H]1CCCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872456260	CE	On-Demand	Anodyne	GBA2	48	29
Cc1ccc(S(=O)(=O)N2CC[C@@H](CN3CCCCC3)C2)c(C#N)c1	ZINC000872456274	EE	On-Demand	Mild	EPHX2	19	43
Cc1ccc(S(=O)(=O)N2CC[C@H](CN3CCCCC3)C2)c(C#N)c1	ZINC000872456276	EE	On-Demand	Mild	EPHX2	19	43
Cc1ccc(S(=O)(=O)N2CCc3cnc(C(C)C)nc3C2)c(C#N)c1	ZINC000872456305	FF	On-Demand	Mild	TRPV4	41	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CN1CCOCC1	ZINC000872456334	ED	On-Demand	Mild	CASP3	27	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CN1CCOCC1	ZINC000872456336	ED	On-Demand	Mild	CASP3	27	44
Cc1cccc(C#N)c1S(=O)(=O)N(C)CC[C@@H]1CCCCN1C	ZINC000872456364	EE	On-Demand	Mild	CHRNA10	42	39
Cc1cccc(C#N)c1S(=O)(=O)N(C)CC[C@@H]1CCCCN1C	ZINC000872456364	EE	On-Demand	Mild	ACKR3	52	33
Cc1cccc(C#N)c1S(=O)(=O)N(C)CC[C@H]1CCCCN1C	ZINC000872456365	EE	On-Demand	Mild	CHRNA10	42	39
Cc1cccc(C#N)c1S(=O)(=O)N(C)CC[C@H]1CCCCN1C	ZINC000872456365	EE	On-Demand	Mild	ACKR3	52	33
Nc1nc(N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)nc(C(F)F)n1	ZINC000872456390	FG	On-Demand	Anodyne	HRH4	56	41
Nc1nc(N[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)nc(C(F)F)n1	ZINC000872456392	FG	On-Demand	Anodyne	HRH4	56	41
CC(C)[C@H](CCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872456396	FE	On-Demand	Anodyne	PKM	39	45
Cc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(C#N)c1	ZINC000872456448	CE	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[C@@H](C)C2)c(C#N)c1	ZINC000872456449	CE	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c(C#N)c1	ZINC000872456450	CE	On-Demand	Mild	TRPV4	45	37
C#CCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872456478	EE	On-Demand	Mild	PKM	36	47
COc1ccc(Nc2cc(Cl)nnc2O)cc1NC(=O)C1CCCCC1	ZINC000872456492	GI	On-Demand	Anodyne	GRM4	15	40
COc1ccc(Nc2cc(Cl)nnc2O)cc1NC(=O)C1CCCCC1	ZINC000872456492	GI	On-Demand	Anodyne	STK17B	48	45
COc1ccc(Nc2cc(Cl)nnc2O)cc1NC(=O)C1CCCCC1	ZINC000872456492	GI	On-Demand	Anodyne	STK17A	17	45
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H]1CN1CCOCC1	ZINC000872456501	GD	On-Demand	Anodyne	CASP3	27	45
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H]1CN1CCOCC1	ZINC000872456504	GD	On-Demand	Anodyne	CASP3	27	45
CCN1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872456515	CD	On-Demand	Mild	CCR8	60	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC(F)(F)F)cc2N1	ZINC000872456524	FF	On-Demand	Anodyne	PKM	39	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCC[C@H]3O)cc2N1	ZINC000872456547	FE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCC[C@@H]3O)cc2N1	ZINC000872456548	FE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCC[C@@H]3O)cc2N1	ZINC000872456549	FE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCC[C@H]3O)cc2N1	ZINC000872456550	FE	On-Demand	Anodyne	PKM	36	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(C(F)(F)F)CC1	ZINC000872456559	FH	On-Demand	Anodyne	PKM	42	39
Nc1nc(C(F)F)nc(N2CCN(Cc3ccc(Cl)nc3)CC2)n1	ZINC000872456564	FD	On-Demand	Anodyne	Q8WSF8_APLCA	35	42
Nc1nc(C(F)F)nc(N2CCN(Cc3ccc(Cl)nc3)CC2)n1	ZINC000872456564	FD	On-Demand	Anodyne	NACHRBETA2	38	42
Cc1c(F)ncnc1N1CCC(C(N)=O)(c2ccccc2)CC1	ZINC000872456577	DD	On-Demand	Anodyne	MLYCD	26	48
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@@H]1CN1CCOCC1	ZINC000872456625	GF	On-Demand	Anodyne	CASP3	82	49
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@@H]1CN1CCOCC1	ZINC000872456625	GF	On-Demand	Anodyne	CASP7	95	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@H]1CN1CCOCC1	ZINC000872456632	GF	On-Demand	Anodyne	CASP3	82	49
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@H]1CN1CCOCC1	ZINC000872456632	GF	On-Demand	Anodyne	CASP7	95	39
O=S(=O)(NCCC(F)(F)F)c1ccc(F)c(C(F)F)c1	ZINC000872456633	DF	On-Demand	Anodyne	PNMT	18	46
NC(=O)c1cc(NCC2Cc3ccccc3C2)nc(Cl)n1	ZINC000872456642	DE	On-Demand	Anodyne	VCP	48	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCOC3CCC3)cc2N1	ZINC000872456682	FE	On-Demand	Anodyne	PKM	34	45
Cn1ncc2c(N3CCC(C(N)=O)(c4ccccc4)CC3)nc(Cl)nc21	ZINC000872456746	FE	On-Demand	Anodyne	MLYCD	25	46
Cc1ccc(S(=O)(=O)N2CCOC3(CCCCC3)C2)c(C#N)c1	ZINC000872456750	EF	On-Demand	Mild	TRPV4	42	34
Cn1nc2c(cc1=O)CN(S(=O)(=O)c1cccc(Br)n1)CC2	ZINC000872456836	GC	On-Demand	Anodyne	AKR1C3	50	34
C[C@@H](CCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872456861	FD	On-Demand	Anodyne	PKM	41	48
C[C@H](CCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872456862	FD	On-Demand	Anodyne	PKM	41	48
CC[C@H](C[C@H](C)CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872456883	GF	On-Demand	Anodyne	PKM	37	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(OCC2CC2)CC1	ZINC000872456890	FG	On-Demand	Anodyne	PKM	42	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2nn(C)c(=O)cc2C1	ZINC000872456926	EC	On-Demand	Mild	AKR1C3	48	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CN1CCOCC1	ZINC000872456935	GE	On-Demand	Anodyne	CASP3	99	52
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CN1CCOCC1	ZINC000872456935	GE	On-Demand	Anodyne	CASP7	108	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CN1CCOCC1	ZINC000872456936	GE	On-Demand	Anodyne	CASP3	99	52
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CN1CCOCC1	ZINC000872456936	GE	On-Demand	Anodyne	CASP7	108	41
O=[N+]([O-])c1ccccc1CCNS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872456953	EF	On-Demand	Bother	COLA	76	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC3CC3)cc2N1	ZINC000872456960	EF	On-Demand	Anodyne	PKM	38	48
Oc1nnc(Cl)cc1N1CCc2ccccc2CC1	ZINC000872457012	CE	On-Demand	Anodyne	DRD5	42	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CCOCC2)C1	ZINC000872457037	EF	On-Demand	Anodyne	PKM	43	37
Cn1cccc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457052	FE	On-Demand	Anodyne	PKM	39	46
CS(=O)(=O)N[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872457080	CC	On-Demand	Anodyne	MAPK8	18	40
CS(=O)(=O)N[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872457081	CC	On-Demand	Anodyne	MAPK8	18	40
CCC[C@@H](CCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457116	GF	On-Demand	Anodyne	PKM	39	45
Cn1ncc2c(N3CCC(Oc4ccc(F)cc4)CC3)nc(Cl)nc21	ZINC000872457143	FG	On-Demand	Anodyne	DCK	40	36
CCC1(O)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872457160	GF	On-Demand	Anodyne	PKM	28	42
O=S(=O)(NCCC1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872457205	CF	On-Demand	Anodyne	LEF	25	40
Cc1ccc(S(=O)(=O)N2C[C@H](C)S[C@@H](C)C2)c(C#N)c1	ZINC000872457233	DE	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)S[C@H](C)C2)c(C#N)c1	ZINC000872457234	DE	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](C)S[C@H](C)C2)c(C#N)c1	ZINC000872457235	DE	On-Demand	Mild	TRPV4	43	35
Cn1ncc2c(N3CC[C@H](Cc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872457252	EG	On-Demand	Anodyne	CCR3	48	31
Cn1ncc2c(N3CC[C@@H](Cc4ccc(F)cc4)C3)nc(Cl)nc21	ZINC000872457253	EG	On-Demand	Anodyne	CCR3	48	31
COc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1OC	ZINC000872457284	FF	On-Demand	Anodyne	ERBB2	21	44
COc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1OC	ZINC000872457284	FF	On-Demand	Anodyne	SSTR5	43	35
COc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1OC	ZINC000872457284	FF	On-Demand	Anodyne	EHMT2	61	35
COc1ccc(C(=O)N2CCC(Nc3ncnc(F)c3C)CC2)cc1OC	ZINC000872457284	FF	On-Demand	Anodyne	L3MBTL3	47	33
NC(=O)c1cc(NCc2ccccc2OC2CCC2)nc(Cl)n1	ZINC000872457335	EF	On-Demand	Anodyne	SCD1	20	42
Cc1ccc(S(=O)(=O)N2CCN(C[C@H](C)O)[C@@H](C)C2)c(C#N)c1	ZINC000872457352	EC	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN(C[C@H](C)O)[C@H](C)C2)c(C#N)c1	ZINC000872457353	EC	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN(C[C@@H](C)O)[C@@H](C)C2)c(C#N)c1	ZINC000872457354	EC	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN(C[C@@H](C)O)[C@H](C)C2)c(C#N)c1	ZINC000872457355	EC	On-Demand	Mild	TRPV4	42	34
COc1cccc(O[C@@H](C)CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872457361	GE	On-Demand	Anodyne	MTNR1A	31	52
COc1cccc(O[C@@H](C)CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872457361	GE	On-Demand	Anodyne	MTNR1B	30	52
COc1cccc(O[C@@H](C)CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872457362	GE	On-Demand	Anodyne	MTNR1A	31	52
COc1cccc(O[C@@H](C)CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872457362	GE	On-Demand	Anodyne	MTNR1B	30	52
COc1cccc(O[C@H](C)CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872457363	GE	On-Demand	Anodyne	MTNR1A	31	52
COc1cccc(O[C@H](C)CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1	ZINC000872457363	GE	On-Demand	Anodyne	MTNR1B	30	52
COc1cccc(O[C@H](C)CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872457364	GE	On-Demand	Anodyne	MTNR1A	31	52
COc1cccc(O[C@H](C)CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1	ZINC000872457364	GE	On-Demand	Anodyne	MTNR1B	30	52
CCC1(O)CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872457384	DD	On-Demand	Mild	TRPV4	47	40
Cn1ncc2c(N3CCN(Cc4ccc(Cl)nc4)CC3)nc(Cl)nc21	ZINC000872457391	GE	On-Demand	Anodyne	Q8WSF8_APLCA	40	39
Cn1ncc2c(N3CCN(Cc4ccc(Cl)nc4)CC3)nc(Cl)nc21	ZINC000872457391	GE	On-Demand	Anodyne	NACHRBETA2	41	39
Oc1nnc(Cl)cc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872457416	DG	On-Demand	Anodyne	SCD1	42	43
Oc1nnc(Cl)cc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872457416	DG	On-Demand	Anodyne	LIPG	18	43
Cc1ccc(S(=O)(=O)N2C[C@H]3[C@@H](C2)C3(C)C)c(C#N)c1	ZINC000872457424	CE	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2C[C@@H]3[C@@H](C2)C3(C)C)c(C#N)c1	ZINC000872457425	CE	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2C[C@H]3[C@H](C2)C3(C)C)c(C#N)c1	ZINC000872457426	CE	On-Demand	Mild	TRPV4	45	38
O=C1[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C1CCOCC1	ZINC000872457479	GD	On-Demand	Anodyne	F10	31	46
O=C1[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C1CCOCC1	ZINC000872457480	GD	On-Demand	Anodyne	F10	31	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccc[nH]3)cc2N1	ZINC000872457488	FE	On-Demand	Anodyne	PKM	39	47
O=S(=O)(Cc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872457497	GG	On-Demand	Anodyne	PTPN2	47	42
O=S(=O)(Cc1ccccc1)N1CCC(Nc2ccnc3ncccc23)CC1	ZINC000872457497	GG	On-Demand	Anodyne	PTPN1	38	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1C[C@@H](O)C[C@@H](O)C1	ZINC000872457502	EC	On-Demand	Anodyne	PKM	40	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O[C@@H]2CCOC2)CC1	ZINC000872457503	GF	On-Demand	Anodyne	PKM	44	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O[C@H]2CCOC2)CC1	ZINC000872457508	GF	On-Demand	Anodyne	PKM	44	38
Oc1nnc(Cl)cc1N1CCC(c2ccccc2F)CC1	ZINC000872457511	DG	On-Demand	Anodyne	GRM2	15	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(C2CCOCC2)CC1	ZINC000872457520	GE	On-Demand	Anodyne	PKM	53	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C[C@@H]4CC[C@H](C3)O4)cc2N1	ZINC000872457542	FE	On-Demand	Anodyne	PKM	20	40
Oc1nnc(Cl)cc1N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872457586	DG	On-Demand	Anodyne	GRIN2B	22	41
Oc1nnc(Cl)cc1N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872457586	DG	On-Demand	Anodyne	CCR3	95	34
Oc1nnc(Cl)cc1N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872457586	DG	On-Demand	Anodyne	LIPG	16	51
Oc1nnc(Cl)cc1N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872457587	DG	On-Demand	Anodyne	GRIN2B	22	41
Oc1nnc(Cl)cc1N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872457587	DG	On-Demand	Anodyne	CCR3	95	34
Oc1nnc(Cl)cc1N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872457587	DG	On-Demand	Anodyne	LIPG	16	51
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1	ZINC000872457608	FE	On-Demand	Mild	EPHX2	24	40
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000872457609	FE	On-Demand	Mild	EPHX2	24	40
CCn1nc2c(cc1=O)CN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)CC2	ZINC000872457615	GE	On-Demand	Anodyne	AKR1C3	56	37
Cc1ccc(S(=O)(=O)N2CCO[C@@H](CO)C2)c(C#N)c1	ZINC000872457624	CC	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCO[C@H](CO)C2)c(C#N)c1	ZINC000872457625	CC	On-Demand	Mild	TRPV4	43	35
COc1ccc(C(=O)N2CCC(Nc3ccnc4ncccc34)CC2)cc1OC	ZINC000872457731	GG	On-Demand	Anodyne	SSTR5	42	38
COc1ccc(C(=O)N2CCC(Nc3ccnc4ncccc34)CC2)cc1OC	ZINC000872457731	GG	On-Demand	Anodyne	L3MBTL3	40	34
CN1CCCC[C@@H]1CCN(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872457778	GE	On-Demand	Anodyne	CHRNA10	52	35
CN1CCCC[C@@H]1CCN(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872457778	GE	On-Demand	Anodyne	ACKR3	43	31
CN1CCCC[C@H]1CCN(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872457779	GE	On-Demand	Anodyne	CHRNA10	52	35
CN1CCCC[C@H]1CCN(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872457779	GE	On-Demand	Anodyne	ACKR3	43	31
CN(C1CCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457783	EF	On-Demand	Anodyne	PKM	35	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](N2CCOCC2)C1	ZINC000872457801	FD	On-Demand	Anodyne	PKM	41	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](N2CCOCC2)C1	ZINC000872457802	FD	On-Demand	Anodyne	PKM	41	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1Cn1ccnc1C	ZINC000872457803	EE	On-Demand	Mild	CASP3	43	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1Cn1ccnc1C	ZINC000872457804	EE	On-Demand	Mild	CASP3	43	37
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@](O)(C(F)(F)F)C1	ZINC000872457829	ED	On-Demand	Mild	TRPV4	42	35
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@](O)(C(F)(F)F)C1	ZINC000872457830	ED	On-Demand	Mild	TRPV4	42	35
OCCO[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872457839	CD	On-Demand	Anodyne	LIPG	20	40
OCCO[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872457840	CD	On-Demand	Anodyne	LIPG	20	40
CC(C)[C@H](CCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872457842	EE	On-Demand	Anodyne	LEF	41	45
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CCOC(C)C)CC1	ZINC000872457858	FE	On-Demand	Mild	ADRA1D	15	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(CCOC(C)C)CC1	ZINC000872457858	FE	On-Demand	Mild	CCR8	52	33
Cc1c(F)ncnc1NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872457875	FE	On-Demand	Anodyne	PTPN2	46	40
Cc1c(F)ncnc1NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000872457875	FE	On-Demand	Anodyne	PTPN1	37	45
COC[C@H](Cc1ccccc1)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872457915	FD	On-Demand	Anodyne	CAPN2	46	33
COC[C@@H](Cc1ccccc1)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872457916	FD	On-Demand	Anodyne	CAPN2	46	33
COC[C@@H](Cc1ccccc1)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872457917	FD	On-Demand	Anodyne	CAPN2	46	33
COC[C@H](Cc1ccccc1)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872457918	FD	On-Demand	Anodyne	CAPN2	46	33
Cc1ccccc1[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872457919	FG	On-Demand	Anodyne	LEF	40	43
Cc1ccccc1[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872457919	FG	On-Demand	Anodyne	CTSA	50	34
Cc1ccccc1[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872457920	FG	On-Demand	Anodyne	LEF	40	43
Cc1ccccc1[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872457920	FG	On-Demand	Anodyne	CTSA	50	34
CCn1nc2c(cc1=O)CN(S(=O)(=O)c1cccc(Br)n1)CC2	ZINC000872457979	GD	On-Demand	Anodyne	AKR1C3	54	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872457981	GF	On-Demand	Mild	CACNA1I	57	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872457982	GF	On-Demand	Mild	CACNA1I	57	35
N#C[C@@H]1CCC[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457989	FF	On-Demand	Mild	PKM	28	43
N#C[C@H]1CCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457990	FF	On-Demand	Mild	PKM	28	43
N#C[C@@H]1CCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457991	FF	On-Demand	Mild	PKM	28	43
N#C[C@H]1CCC[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872457992	FF	On-Demand	Mild	PKM	28	43
c1cnc2nccc(N3CCC[C@H](N4CCCC4)CC3)c2c1	ZINC000872458018	CG	On-Demand	Anodyne	HRH3	24	51
c1cnc2nccc(N3CCC[C@H](N4CCCC4)CC3)c2c1	ZINC000872458018	CG	On-Demand	Anodyne	L3MBTL3	77	43
c1cnc2nccc(N3CCC[C@@H](N4CCCC4)CC3)c2c1	ZINC000872458021	CG	On-Demand	Anodyne	HRH3	24	51
c1cnc2nccc(N3CCC[C@@H](N4CCCC4)CC3)c2c1	ZINC000872458021	CG	On-Demand	Anodyne	L3MBTL3	77	43
COc1cccc(OCCCNc2cc(Cl)nnc2O)c1	ZINC000872458033	DF	On-Demand	Anodyne	MTNR1A	22	49
COc1cccc(OCCCNc2cc(Cl)nnc2O)c1	ZINC000872458033	DF	On-Demand	Anodyne	MTNR1B	26	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCc4[nH]ccc43)cc2N1	ZINC000872458039	GG	On-Demand	Anodyne	PKM	35	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCc4[nH]ccc43)cc2N1	ZINC000872458042	GG	On-Demand	Anodyne	PKM	35	43
COc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1OC	ZINC000872458059	GF	On-Demand	Anodyne	LRRK2	20	43
COc1ccc(C(=O)N2CCC(Nc3cc(Cl)nnc3O)CC2)cc1OC	ZINC000872458059	GF	On-Demand	Anodyne	L3MBTL3	49	33
Oc1nnc(Cl)cc1N1CCC[C@@H](N2CCCC2)CC1	ZINC000872458091	CE	On-Demand	Anodyne	HRH3	20	46
Oc1nnc(Cl)cc1N1CCC[C@@H](N2CCCC2)CC1	ZINC000872458091	CE	On-Demand	Anodyne	L3MBTL3	82	40
Oc1nnc(Cl)cc1N1CCC[C@H](N2CCCC2)CC1	ZINC000872458093	CE	On-Demand	Anodyne	HRH3	20	46
Oc1nnc(Cl)cc1N1CCC[C@H](N2CCCC2)CC1	ZINC000872458093	CE	On-Demand	Anodyne	L3MBTL3	82	40
O=S(=O)(Cc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872458118	GE	On-Demand	Anodyne	PTPN2	48	41
O=S(=O)(Cc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872458118	GE	On-Demand	Anodyne	SIGMAR1	15	47
O=S(=O)(Cc1ccccc1)N1CCC(Nc2cc(Cl)nnc2O)CC1	ZINC000872458118	GE	On-Demand	Anodyne	PTPN1	39	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(c2ncc[nH]2)CC1	ZINC000872458127	FG	On-Demand	Anodyne	HTR2B	21	67
Cc1c(F)ncnc1N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000872458133	ED	On-Demand	Anodyne	DRD4	30	45
Cc1c(F)ncnc1N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000872458133	ED	On-Demand	Anodyne	LPAR2	22	51
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(C[C@H]2CCOC2)CC1	ZINC000872458134	GE	On-Demand	Anodyne	PKM	47	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(C[C@@H]2CCOC2)CC1	ZINC000872458135	GE	On-Demand	Anodyne	PKM	47	37
Cc1c(F)ncnc1N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000872458138	ED	On-Demand	Anodyne	DRD4	30	45
Cc1c(F)ncnc1N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000872458138	ED	On-Demand	Anodyne	LPAR2	22	51
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1C	ZINC000872458247	FD	On-Demand	Anodyne	GCKR	66	31
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1C	ZINC000872458247	FD	On-Demand	Anodyne	NOD2	18	42
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1C	ZINC000872458248	FD	On-Demand	Anodyne	GCKR	66	31
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1C	ZINC000872458248	FD	On-Demand	Anodyne	NOD2	18	42
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C[C@@H](C)O	ZINC000872458249	FD	On-Demand	Anodyne	GCKR	66	31
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C[C@@H](C)O	ZINC000872458249	FD	On-Demand	Anodyne	NOD2	18	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(CO)CC3)cc2N1	ZINC000872458265	FD	On-Demand	Anodyne	PKM	38	45
NC(=O)C1(c2ccccc2)CCN(c2cc(Cl)nnc2O)CC1	ZINC000872458279	ED	On-Demand	Anodyne	TACR2	17	43
NC(=O)C1(c2ccccc2)CCN(c2cc(Cl)nnc2O)CC1	ZINC000872458279	ED	On-Demand	Anodyne	MLYCD	28	48
Cc1ccc(S(=O)(=O)N2CC[C@](O)(C(F)(F)F)C2)c(C#N)c1	ZINC000872458296	ED	On-Demand	Mild	TRPV4	53	45
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(C(F)(F)F)C2)c(C#N)c1	ZINC000872458298	ED	On-Demand	Mild	TRPV4	53	45
NC(=O)C1(c2ccccc2)CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872458315	FG	On-Demand	Anodyne	MLYCD	25	47
CC[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C[C@H](C)O	ZINC000872458341	GE	On-Demand	Anodyne	GCKR	52	32
CC[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1C[C@@H](C)O	ZINC000872458343	GE	On-Demand	Anodyne	GCKR	52	32
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872458366	DG	On-Demand	Anodyne	PDE3A	41	41
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872458366	DG	On-Demand	Anodyne	DCK	53	42
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872458366	DG	On-Demand	Anodyne	PDE3B	48	40
Cc1c(F)ncnc1N1CCC(Oc2ccc(F)cc2)CC1	ZINC000872458366	DG	On-Demand	Anodyne	SCD1	22	46
CC(C)(C(N)=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872458385	GD	On-Demand	Anodyne	PKM	45	40
CC(C)(C(N)=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872458385	GD	On-Demand	Anodyne	GCK	58	34
CC(C)(C(N)=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872458385	GD	On-Demand	Anodyne	GCKR	59	34
CN1CCC[C@H](N2CCN(c3cc(-c4ccccc4)ncn3)CC2)C1	ZINC000872458386	EE	On-Demand	Anodyne	HRH4	20	65
OCCO[C@@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872458388	CC	On-Demand	Anodyne	LIPG	20	40
OCCO[C@H]1CCCN(c2cc(Cl)nnc2O)C1	ZINC000872458389	CC	On-Demand	Anodyne	LIPG	20	40
CC[C@@H](O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872458398	CD	On-Demand	Anodyne	ABCB1	50	38
CC[C@H](O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872458399	CD	On-Demand	Anodyne	ABCB1	50	38
Cc1cccc(C#N)c1S(=O)(=O)NC[C@@H](C)c1ccncc1	ZINC000872458412	DE	On-Demand	Mild	GRIA4	18	43
Cc1cccc(C#N)c1S(=O)(=O)NC[C@H](C)c1ccncc1	ZINC000872458413	DE	On-Demand	Mild	GRIA4	18	43
Cn1ccnc1N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872458430	DE	On-Demand	Anodyne	HRH4	16	69
c1ccc(-c2cc(N3CCN(CC4CCOCC4)CC3)ncn2)cc1	ZINC000872458431	EF	On-Demand	Anodyne	DRD4	17	40
c1ccc(-c2cc(N3CCN(CC4CCOCC4)CC3)ncn2)cc1	ZINC000872458431	EF	On-Demand	Anodyne	TACR2	15	41
C[C@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccncc1	ZINC000872458432	ED	On-Demand	Anodyne	GRIA4	19	43
C[C@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccncc1	ZINC000872458433	ED	On-Demand	Anodyne	GRIA4	19	43
C[C@@H](CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccncc1	ZINC000872458434	ED	On-Demand	Anodyne	GRIA4	19	43
C[C@@H](CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccncc1	ZINC000872458435	ED	On-Demand	Anodyne	GRIA4	19	43
CC[C@H](CN1CCCC1)Nc1ccnc2ncccc12	ZINC000872458448	CF	On-Demand	Anodyne	HNMT	70	38
CC[C@@H](CN1CCCC1)Nc1ccnc2ncccc12	ZINC000872458449	CF	On-Demand	Anodyne	HNMT	70	38
CCc1cnc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)s1	ZINC000872458468	GG	On-Demand	Anodyne	PKM	30	43
NC(=O)c1cc(N2CCN(Cc3ccc(Cl)nc3)CC2)nc(Cl)n1	ZINC000872458474	FD	On-Demand	Anodyne	Q8WSF8_APLCA	41	41
NC(=O)c1cc(N2CCN(Cc3ccc(Cl)nc3)CC2)nc(Cl)n1	ZINC000872458474	FD	On-Demand	Anodyne	NACHRBETA2	43	41
Cc1c(F)ncnc1N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000872458502	CG	On-Demand	Anodyne	CCR3	87	34
Cc1c(F)ncnc1N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000872458504	CG	On-Demand	Anodyne	CCR3	87	34
Cc1cccc(C#N)c1S(=O)(=O)NCCCNC(=O)C1CCC1	ZINC000872458518	ED	On-Demand	Mild	TBK1	61	33
COC(=O)C[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872458531	EC	On-Demand	Mild	EPHX2	15	40
COC(=O)C[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872458531	EC	On-Demand	Mild	TRPV4	42	35
COC(=O)C[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872458534	EC	On-Demand	Mild	EPHX2	15	40
COC(=O)C[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872458534	EC	On-Demand	Mild	TRPV4	42	35
Cc1c(F)ncnc1N1CCC[C@@H](N2CCCC2)CC1	ZINC000872458538	CE	On-Demand	Anodyne	HRH3	15	41
Cc1c(F)ncnc1N1CCC[C@@H](N2CCCC2)CC1	ZINC000872458538	CE	On-Demand	Anodyne	L3MBTL3	58	40
Cc1c(F)ncnc1N1CCC[C@H](N2CCCC2)CC1	ZINC000872458549	CE	On-Demand	Anodyne	HRH3	15	41
Cc1c(F)ncnc1N1CCC[C@H](N2CCCC2)CC1	ZINC000872458549	CE	On-Demand	Anodyne	L3MBTL3	58	40
C[C@H](CN1CCN(c2ccccn2)CC1)Nc1nc(N)nc(C(F)F)n1	ZINC000872458556	FD	On-Demand	Anodyne	DRD4	26	41
Cc1ccc(S(=O)(=O)N2CCN(C3CC3)C(=O)C2)c(C#N)c1	ZINC000872458593	DC	On-Demand	Mild	TRPV4	43	36
COC(=O)[C@@]1(F)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872458607	ED	On-Demand	Mild	TRPV4	50	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(OCCN2CCCC2)CC1	ZINC000872458610	GE	On-Demand	Mild	SLC6A1	57	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@]3(O)CCSC3)cc2N1	ZINC000872458616	GD	On-Demand	Anodyne	PKM	33	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@]3(O)CCSC3)cc2N1	ZINC000872458617	GD	On-Demand	Anodyne	PKM	33	42
CC(=O)NC[C@@H]1CN(c2nc(Cl)nc3c2cnn3C)CCO1	ZINC000872458618	DC	On-Demand	Anodyne	MTOR	45	32
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCOCC1	ZINC000872458622	FG	On-Demand	Anodyne	LEF	34	53
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCOCC1	ZINC000872458623	FG	On-Demand	Anodyne	LEF	34	53
CCn1nc2c(cc1=O)CN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872458636	FD	On-Demand	Mild	AKR1C3	47	37
Cc1ccc(S(=O)(=O)N2CCn3nc(C)nc3C2)c(C#N)c1	ZINC000872458652	DC	On-Demand	Mild	TRPV4	43	35
Cc1c(F)ncnc1N1CCC(NCCOc2ccccc2)CC1	ZINC000872458677	EF	On-Demand	Anodyne	ADRB3	17	46
CCC(=O)c1c(Cl)cccc1N[C@H](C)CCO	ZINC000872458683	CG	On-Demand	Anodyne	CXCL8	41	39
CCC(=O)c1c(Cl)cccc1N[C@@H](C)CCO	ZINC000872458684	CG	On-Demand	Anodyne	CXCL8	41	39
CC[C@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458696	GC	On-Demand	Anodyne	F2	29	44
CC[C@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458696	GC	On-Demand	Anodyne	TRY2_BOVIN	100	45
CC[C@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458696	GC	On-Demand	Anodyne	ST14	53	36
CC[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458697	GC	On-Demand	Anodyne	F2	29	44
CC[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458697	GC	On-Demand	Anodyne	TRY2_BOVIN	100	45
CC[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(=O)N1CCOCC1	ZINC000872458697	GC	On-Demand	Anodyne	ST14	53	36
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccncc1	ZINC000872458715	GG	On-Demand	Anodyne	PKM	41	48
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccncc1	ZINC000872458717	GG	On-Demand	Anodyne	PKM	41	48
CN1CCC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1=O	ZINC000872458744	GD	On-Demand	Anodyne	PKM	36	46
CCOc1cc(CCCNc2cc(Cl)nnc2O)ccc1OC	ZINC000872458745	EG	On-Demand	Anodyne	INHA	44	39
CC(=O)NC[C@@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872458757	DD	On-Demand	Anodyne	TNK2	48	36
COC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccco1	ZINC000872458761	GF	On-Demand	Anodyne	PKM	39	45
COC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccco1	ZINC000872458762	GF	On-Demand	Anodyne	PKM	39	45
COC(=O)[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458799	FD	On-Demand	Anodyne	MMP13	34	52
COC(=O)[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458799	FD	On-Demand	Anodyne	MMP2	18	41
COC(=O)[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458799	FD	On-Demand	Anodyne	MMP3	37	52
COC(=O)[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458799	FD	On-Demand	Anodyne	MMP9	23	41
COC(=O)[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458799	FD	On-Demand	Anodyne	MMP1	36	52
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C=C[C@H](CO)C3)cc2N1	ZINC000872458802	FD	On-Demand	Anodyne	PKM	34	42
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458804	FD	On-Demand	Anodyne	MMP13	34	52
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458804	FD	On-Demand	Anodyne	MMP2	18	41
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458804	FD	On-Demand	Anodyne	MMP3	37	52
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458804	FD	On-Demand	Anodyne	MMP9	23	41
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872458804	FD	On-Demand	Anodyne	MMP1	36	52
C[C@@H](Cc1ccncc1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872458807	GF	On-Demand	Anodyne	PKM	38	45
COCCOC1CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872458885	DC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2CCN(CCOC(C)C)CC2)c(C#N)c1	ZINC000872458894	FD	On-Demand	Mild	TRPV4	44	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2ncnc(N3CCOCC3)c2C1	ZINC000872458905	GD	On-Demand	Mild	LRRK2	15	40
Cc1cccc(C#N)c1S(=O)(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000872458942	EF	On-Demand	Mild	KCNA5	18	40
Cc1cccc(C#N)c1S(=O)(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000872458943	EF	On-Demand	Mild	KCNA5	18	40
Cc1ccc(S(=O)(=O)N2CCc3c(ncn3C)C2)c(C#N)c1	ZINC000872458946	DD	On-Demand	Mild	TRPV4	42	34
CC(C)(C)NC(=O)CN1CCC(CNS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872458967	GE	On-Demand	Anodyne	CACNA1I	45	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCc4cnccc43)cc2N1	ZINC000872458999	GF	On-Demand	Anodyne	PKM	27	42
O=S(=O)(NC1CCN(C2CCCC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872459016	GG	On-Demand	Anodyne	ADRA1D	39	50
O=S(=O)(NC1CCN(C2CCCC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872459016	GG	On-Demand	Anodyne	ADRA1A	27	50
O=S(=O)(NC1CCN(C2CCCC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872459016	GG	On-Demand	Anodyne	ADRA1B	30	50
O=S(=O)(NC1CCN(C2CCCC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872459016	GG	On-Demand	Anodyne	SFRP1	106	34
O=S(=O)(NC1CCN(C2CCCC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872459016	GG	On-Demand	Anodyne	WNT3	74	32
COc1ccc(OC)c2sc(NC3CCN(C[C@H]4CCOC4)CC3)nc12	ZINC000872459018	GG	On-Demand	Anodyne	SSTR5	36	44
COc1ccc(OC)c2sc(NC3CCN(C[C@@H]4CCOC4)CC3)nc12	ZINC000872459020	GG	On-Demand	Anodyne	SSTR5	36	44
O=C(NCCCNS(=O)(=O)c1cccc(Br)n1)C1CCC1	ZINC000872459039	GD	On-Demand	Anodyne	IKBKE	42	41
O=C(NCCCNS(=O)(=O)c1cccc(Br)n1)C1CCC1	ZINC000872459039	GD	On-Demand	Anodyne	TBK1	87	43
C[C@@H](Cc1ccncc1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872459042	EG	On-Demand	Anodyne	LEF	31	40
Cc1cccc(C#N)c1S(=O)(=O)NCC1CCN(C(=O)C(F)(F)F)CC1	ZINC000872459050	GD	On-Demand	Mild	CCR8	46	31
CCOC[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872459061	DD	On-Demand	Mild	TRPV4	43	36
CCC(=O)c1c(Cl)cccc1N1CCN(c2nccn2C)CC1	ZINC000872459065	EF	On-Demand	Anodyne	DRD2	30	40
CCC(=O)c1c(Cl)cccc1N1CCN(c2nccn2C)CC1	ZINC000872459065	EF	On-Demand	Anodyne	DRD3	49	40
COC(=O)C[C@@H](C)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872459126	FD	On-Demand	Mild	TRPV4	45	36
Cc1ccc(S(=O)(=O)N2CCN([C@H](C)C(F)(F)F)CC2)c(C#N)c1	ZINC000872459157	FE	On-Demand	Mild	TRPV4	42	36
Cc1ccc(S(=O)(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)c(C#N)c1	ZINC000872459158	FE	On-Demand	Mild	TRPV4	42	36
CN1CCC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872459161	ED	On-Demand	Anodyne	F10	32	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCSC3)cc2N1	ZINC000872459164	FF	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCSC3)cc2N1	ZINC000872459164	FF	On-Demand	Anodyne	BRD4	16	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCSC3)cc2N1	ZINC000872459165	FF	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCSC3)cc2N1	ZINC000872459165	FF	On-Demand	Anodyne	BRD4	16	40
O=S(=O)(NCCc1nc[nH]n1)c1ccc(F)c(C(F)F)c1	ZINC000872459210	DD	On-Demand	Anodyne	TBXA2R	53	42
NC(=O)c1cc(N2CCC(NCCOc3ccccc3)CC2)nc(Cl)n1	ZINC000872459237	GD	On-Demand	Anodyne	P2RY12	44	32
COc1cccc(OCCCNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872459293	EE	On-Demand	Anodyne	MTNR1A	50	50
COc1cccc(OCCCNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872459293	EE	On-Demand	Anodyne	MTNR1B	49	50
C[C@H](CN1CCN(c2ccccn2)CC1)Nc1cc(Cl)nnc1O	ZINC000872459300	ED	On-Demand	Anodyne	DRD4	28	45
Cc1c(F)ncnc1N1CCN(c2ccc(C(N)=O)cc2)CC1	ZINC000872459327	DD	On-Demand	Anodyne	PRNP	46	34
Cc1c(F)ncnc1N1CCN(c2ccc(C(N)=O)cc2)CC1	ZINC000872459327	DD	On-Demand	Anodyne	SIRT3	55	33
Cc1ccc(S(=O)(=O)N2C[C@@H]3CC[C@H](C2)O3)c(C#N)c1	ZINC000872459338	CD	On-Demand	Mild	TRPV4	42	35
C[C@H](CN1CCN(c2ccccn2)CC1)Nc1ccnc2ncccc12	ZINC000872459343	EF	On-Demand	Anodyne	DRD4	32	41
CCOC(=O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872459346	ED	On-Demand	Anodyne	TBXA2R	49	35
CCOC(=O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872459346	ED	On-Demand	Anodyne	LEF	34	40
COC(=O)[C@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459352	FC	On-Demand	Anodyne	MMP13	21	52
COC(=O)[C@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459352	FC	On-Demand	Anodyne	MMP3	27	52
COC(=O)[C@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459352	FC	On-Demand	Anodyne	MMP1	24	52
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459353	FC	On-Demand	Anodyne	MMP13	21	52
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459353	FC	On-Demand	Anodyne	MMP3	27	52
COC(=O)[C@@H]1COCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872459353	FC	On-Demand	Anodyne	MMP1	24	52
Cc1ccc(S(=O)(=O)N2CCN(c3nccn(C)c3=O)CC2)c(C#N)c1	ZINC000872459362	FC	On-Demand	Mild	TRPV4	43	35
O=C(NCCCNS(=O)(=O)CC1CC2(CCC2)C1)C1CCC1	ZINC000872459377	ED	On-Demand	Anodyne	TBK1	70	34
COC[C@@H](Nc1cc(Cl)nnc1O)c1cccc(C(F)(F)F)c1	ZINC000872459382	EH	On-Demand	Anodyne	PDS	43	35
COC[C@H](Nc1cc(Cl)nnc1O)c1cccc(C(F)(F)F)c1	ZINC000872459402	EH	On-Demand	Anodyne	PDS	43	35
Cc1cccc(C#N)c1S(=O)(=O)NC1CCC(C)(O)CC1	ZINC000872459412	DD	On-Demand	Mild	CCR8	51	32
NC(=O)c1cc(N2CCC(c3ccccc3F)CC2)nc(Cl)n1	ZINC000872459413	EF	On-Demand	Anodyne	SCD1	16	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC(=O)N(C4CC4)C3)cc2N1	ZINC000872459416	GD	On-Demand	Anodyne	PKM	25	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CC(=O)N(C4CC4)C3)cc2N1	ZINC000872459417	GD	On-Demand	Anodyne	PKM	25	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCn3cccc3)cc2N1	ZINC000872459424	FE	On-Demand	Anodyne	PKM	36	47
CNC(=O)[C@@H](C)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872459426	GD	On-Demand	Anodyne	PKM	36	41
O=C(NCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCC1	ZINC000872459485	FE	On-Demand	Anodyne	TBK1	72	38
Cc1ccc(S(=O)(=O)N2CCSC(C)(C)C2)c(C#N)c1	ZINC000872459533	DE	On-Demand	Mild	TRPV4	45	35
CCC(=O)c1c(Cl)cccc1N[C@H]1CCC(=O)N(C)C1	ZINC000872459572	CF	On-Demand	Anodyne	P2RX7	39	44
CCC(=O)c1c(Cl)cccc1N[C@@H]1CCC(=O)N(C)C1	ZINC000872459573	CF	On-Demand	Anodyne	P2RX7	39	44
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccccc2Sc2ccccc2)cc1	ZINC000872459593	HJ	On-Demand	Anodyne	HDAC8	15	46
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccccc2Sc2ccccc2)cc1	ZINC000872459593	HJ	On-Demand	Anodyne	MMP2	15	47
CS(=O)(=O)Nc1ccc(/C=C\C(=O)Nc2ccccc2Sc2ccccc2)cc1	ZINC000872459593	HJ	On-Demand	Anodyne	HDAC1	15	49
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1N1CCOCC1	ZINC000872459594	GE	On-Demand	Anodyne	PKM	40	34
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1N1CCOCC1	ZINC000872459595	GE	On-Demand	Anodyne	PKM	40	34
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1N1CCOCC1	ZINC000872459596	GE	On-Demand	Anodyne	PKM	40	34
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1N1CCOCC1	ZINC000872459597	GE	On-Demand	Anodyne	PKM	40	34
Cc1ccc(S(=O)(=O)N2CCN(c3ncc(C)s3)CC2)c(C#N)c1	ZINC000872459642	FE	On-Demand	Mild	TRPV4	42	34
NC(=O)c1cc(N2CC[C@H](Cc3ccc(F)cc3)C2)nc(Cl)n1	ZINC000872459666	EE	On-Demand	Anodyne	CCR3	130	38
NC(=O)c1cc(N2CC[C@@H](Cc3ccc(F)cc3)C2)nc(Cl)n1	ZINC000872459667	EE	On-Demand	Anodyne	CCR3	130	38
CNC(=O)CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872459720	ED	On-Demand	Mild	EPHX2	31	46
CNC(=O)CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872459720	ED	On-Demand	Mild	TRPV4	47	38
C[C@@H]1CCN(CCNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872459748	GE	On-Demand	Anodyne	PKM	33	46
C[C@H]1CCN(CCNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872459749	GE	On-Demand	Anodyne	PKM	33	46
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCc1nc[nH]n1	ZINC000872459803	FD	On-Demand	Anodyne	ALOX15	17	40
CC[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459852	DE	On-Demand	Anodyne	ACOX1	56	36
CC[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459852	DE	On-Demand	Anodyne	ABCB1	53	37
CC[C@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459852	DE	On-Demand	Anodyne	SORD	41	39
CC[C@@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459854	DE	On-Demand	Anodyne	ACOX1	56	36
CC[C@@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459854	DE	On-Demand	Anodyne	ABCB1	53	37
CC[C@@H](O)CN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872459854	DE	On-Demand	Anodyne	SORD	41	39
NC(=O)NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872459859	FD	On-Demand	Anodyne	EPHX2	30	44
NC(=O)NC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872459859	FD	On-Demand	Anodyne	TGM2	47	39
CCOc1cc(CCCNc2nc(N)nc(C(F)F)n2)ccc1OC	ZINC000872459863	FF	On-Demand	Anodyne	DRTS_TRYCR	60	37
C[C@H]1CCN(CCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872459871	EE	On-Demand	Anodyne	HTR7	34	41
C[C@@H]1CCN(CCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872459872	EE	On-Demand	Anodyne	HTR7	34	41
O=S(=O)(CC1CC2(CCC2)C1)N1CCc2cnccc21	ZINC000872459907	CE	On-Demand	Anodyne	CYP11B2	16	40
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459984	GD	On-Demand	Anodyne	F2	35	46
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459984	GD	On-Demand	Anodyne	TRY2_BOVIN	99	47
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459984	GD	On-Demand	Anodyne	ST14	100	36
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459984	GD	On-Demand	Anodyne	LEF	36	48
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459986	GD	On-Demand	Anodyne	F2	35	46
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459986	GD	On-Demand	Anodyne	TRY2_BOVIN	99	47
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459986	GD	On-Demand	Anodyne	ST14	100	36
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N1CCOCC1	ZINC000872459986	GD	On-Demand	Anodyne	LEF	36	48
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459994	FC	On-Demand	Mild	F2	26	42
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459994	FC	On-Demand	Mild	TRY2_BOVIN	92	43
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459994	FC	On-Demand	Mild	ST14	50	36
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459997	FC	On-Demand	Mild	F2	26	42
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459997	FC	On-Demand	Mild	TRY2_BOVIN	92	43
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)N1CCOCC1	ZINC000872459997	FC	On-Demand	Mild	ST14	50	36
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CCCC2)CC1	ZINC000872460009	EF	On-Demand	Mild	ADRA1D	31	46
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CCCC2)CC1	ZINC000872460009	EF	On-Demand	Mild	ADRA1A	22	46
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CCCC2)CC1	ZINC000872460009	EF	On-Demand	Mild	ADRA1B	25	46
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(C2CCCC2)CC1	ZINC000872460009	EF	On-Demand	Mild	CCR8	71	34
NC(=O)NC1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872460011	GE	On-Demand	Anodyne	SLC6A5	32	40
NC(=O)NC1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872460011	GE	On-Demand	Anodyne	EPHX2	26	59
NC(=O)NC1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872460011	GE	On-Demand	Anodyne	TGM2	23	48
Oc1nnc(Cl)cc1Nc1cccc(NC2CCCC2)c1	ZINC000872460019	DH	On-Demand	Anodyne	CYSP_TRYCR	15	40
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460034	FC	On-Demand	Mild	F2	20	41
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460034	FC	On-Demand	Mild	TRY2_BOVIN	97	46
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460034	FC	On-Demand	Mild	ST14	56	38
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460035	FC	On-Demand	Mild	F2	20	41
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460035	FC	On-Demand	Mild	TRY2_BOVIN	97	46
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)N1CCOCC1	ZINC000872460035	FC	On-Demand	Mild	ST14	56	38
COc1cccc(OCCCNc2nc(N)nc(C(F)F)n2)c1	ZINC000872460039	EE	On-Demand	Anodyne	DHFR	25	40
COc1cccc(OCCCNc2nc(N)nc(C(F)F)n2)c1	ZINC000872460039	EE	On-Demand	Anodyne	DRTS_TOXGO	31	40
c1cc(N2CCC[C@H](N3CCCC3)CC2)c(C2CC2)cn1	ZINC000872460048	CG	On-Demand	Anodyne	HRH3	20	46
c1cc(N2CCC[C@H](N3CCCC3)CC2)c(C2CC2)cn1	ZINC000872460048	CG	On-Demand	Anodyne	L3MBTL3	83	44
c1cc(N2CCC[C@@H](N3CCCC3)CC2)c(C2CC2)cn1	ZINC000872460049	CG	On-Demand	Anodyne	HRH3	20	46
c1cc(N2CCC[C@@H](N3CCCC3)CC2)c(C2CC2)cn1	ZINC000872460049	CG	On-Demand	Anodyne	L3MBTL3	83	44
O=S(=O)(c1cccc(Br)n1)N1CCC(c2ncc[nH]2)CC1	ZINC000872460050	FE	On-Demand	Anodyne	HTR2B	15	58
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872460051	FE	On-Demand	Mild	EPHX2	29	48
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872460051	FE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872460052	FE	On-Demand	Mild	EPHX2	29	48
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872460052	FE	On-Demand	Mild	TRPV4	42	34
NC(=O)[C@H]1CCC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872460070	CF	On-Demand	Anodyne	VCP	60	41
NC(=O)[C@@H]1CCC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872460071	CF	On-Demand	Anodyne	VCP	60	41
NC(=O)[C@H]1CCC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872460072	CF	On-Demand	Anodyne	VCP	60	41
NC(=O)[C@@H]1CCC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872460073	CF	On-Demand	Anodyne	VCP	60	41
Nc1nc(C(F)F)nc(N2CCC[C@H](N3CCCC3)CC2)n1	ZINC000872460079	DD	On-Demand	Anodyne	L3MBTL3	29	40
Nc1nc(C(F)F)nc(N2CCC[C@@H](N3CCCC3)CC2)n1	ZINC000872460080	DD	On-Demand	Anodyne	L3MBTL3	29	40
Cc1c(F)ncnc1N(C)CC(=O)NCc1ccccc1	ZINC000872460096	CD	On-Demand	Anodyne	PDS	41	32
c1ccc(-c2cc(N3CCC[C@@H](N4CCCC4)CC3)ncn2)cc1	ZINC000872460167	DH	On-Demand	Anodyne	HRH3	31	45
c1ccc(-c2cc(N3CCC[C@@H](N4CCCC4)CC3)ncn2)cc1	ZINC000872460167	DH	On-Demand	Anodyne	L3MBTL3	80	41
c1ccc(-c2cc(N3CCC[C@H](N4CCCC4)CC3)ncn2)cc1	ZINC000872460168	DH	On-Demand	Anodyne	HRH3	31	45
c1ccc(-c2cc(N3CCC[C@H](N4CCCC4)CC3)ncn2)cc1	ZINC000872460168	DH	On-Demand	Anodyne	L3MBTL3	80	41
COc1ccc(OC)c2sc(N[C@H](C)CCO)nc12	ZINC000872460170	CE	On-Demand	Anodyne	ADORA2B	17	41
COc1ccc(OC)c2sc(N[C@@H](C)CCO)nc12	ZINC000872460171	CE	On-Demand	Anodyne	ADORA2B	17	41
Cn1cnc2c1CCN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872460183	EE	On-Demand	Anodyne	AKR1C3	51	34
NC(=O)c1cc(N2CCC[C@@H](N3CCCC3)CC2)nc(Cl)n1	ZINC000872460194	DD	On-Demand	Anodyne	HRH3	22	41
NC(=O)c1cc(N2CCC[C@@H](N3CCCC3)CC2)nc(Cl)n1	ZINC000872460194	DD	On-Demand	Anodyne	L3MBTL3	92	38
NC(=O)c1cc(N2CCC[C@H](N3CCCC3)CC2)nc(Cl)n1	ZINC000872460195	DD	On-Demand	Anodyne	HRH3	22	41
NC(=O)c1cc(N2CCC[C@H](N3CCCC3)CC2)nc(Cl)n1	ZINC000872460195	DD	On-Demand	Anodyne	L3MBTL3	92	38
Cc1ccc(S(=O)(=O)N2CCS(=O)(=O)C(C)(C)C2)c(C#N)c1	ZINC000872460243	ED	On-Demand	Mild	TRPV4	43	35
COC(=O)C[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872460249	FE	On-Demand	Anodyne	LEF	41	47
COC(=O)C[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872460250	FE	On-Demand	Anodyne	LEF	41	47
C[S@@](=O)CCN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872460274	GD	On-Demand	Anodyne	PKM	44	38
CN(CCN1CCN(c2ccccc2)CC1)c1nc(N)nc(C(F)F)n1	ZINC000872460292	FD	On-Demand	Anodyne	HTR1A	38	43
CN(CCN1CCN(c2ccccc2)CC1)c1nc(N)nc(C(F)F)n1	ZINC000872460292	FD	On-Demand	Anodyne	DRD2	26	43
CN(CCN1CCN(c2ccccc2)CC1)c1nc(N)nc(C(F)F)n1	ZINC000872460292	FD	On-Demand	Anodyne	HTR2A	31	41
CN(CCN1CCN(c2ccccc2)CC1)c1nc(N)nc(C(F)F)n1	ZINC000872460292	FD	On-Demand	Anodyne	DRD3	31	43
CN(CCN1CCN(c2ccccc2)CC1)c1nc(N)nc(C(F)F)n1	ZINC000872460292	FD	On-Demand	Anodyne	HTR7	54	49
CC[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872460324	CE	On-Demand	Mild	EPHX2	15	40
CC[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872460324	CE	On-Demand	Mild	TRPV4	45	38
Cc1c(F)ncnc1N1CC[C@H](CN2CCCC2)C1	ZINC000872460329	CD	On-Demand	Anodyne	SIRT3	15	42
Cc1c(F)ncnc1N1CC[C@@H](CN2CCCC2)C1	ZINC000872460330	CD	On-Demand	Anodyne	SIRT3	15	42
O=C(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872460337	EF	On-Demand	Anodyne	GRIN2B	59	42
O=C(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872460337	EF	On-Demand	Anodyne	CACNA1I	50	35
O=C(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872460337	EF	On-Demand	Anodyne	VCP	52	34
O=C(c1ccccc1)N1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872460337	EF	On-Demand	Anodyne	L3MBTL3	64	37
C[C@@H](CCCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460340	FE	On-Demand	Anodyne	PKM	39	45
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	HTR1A	53	43
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	DRD2	35	44
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	DRD4	44	39
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	HTR2A	41	43
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	DRD3	44	43
CN(CCN1CCN(c2ccccc2)CC1)c1cc(Cl)nnc1O	ZINC000872460354	EE	On-Demand	Anodyne	HTR7	65	59
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872460480	ED	On-Demand	Anodyne	TRY2_BOVIN	40	32
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872460480	ED	On-Demand	Anodyne	LEF	44	55
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872460482	ED	On-Demand	Anodyne	TRY2_BOVIN	40	32
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872460482	ED	On-Demand	Anodyne	LEF	44	55
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3C[C@H]4CC[C@H]3O4)cc2N1	ZINC000872460527	FE	On-Demand	Anodyne	PKM	33	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)cc2N1	ZINC000872460529	FE	On-Demand	Anodyne	PKM	33	46
CCCN(CCO)c1cc(C)nc2c1cnn2C	ZINC000872460537	BD	On-Demand	Anodyne	CRHR1	33	46
C[C@H](C[C@@H]1CCOC1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460627	GF	On-Demand	Anodyne	PKM	31	43
C[C@@H](C[C@H]1CCOC1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460630	GF	On-Demand	Anodyne	PKM	31	43
C[C@@H](C[C@@H]1CCOC1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460632	GF	On-Demand	Anodyne	PKM	31	43
COC(=O)[C@@]1(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872460644	DD	On-Demand	Mild	TRPV4	49	41
Fc1ccc(N2CCOCC2)c(CNc2ccnc3ncccc23)c1	ZINC000872460651	EG	On-Demand	Anodyne	STAT6	44	37
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460659	FE	On-Demand	Anodyne	CCR8	65	38
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460659	FE	On-Demand	Anodyne	SFRP1	58	38
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460659	FE	On-Demand	Anodyne	L3MBTL3	51	34
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460669	FE	On-Demand	Anodyne	CCR8	65	38
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460669	FE	On-Demand	Anodyne	SFRP1	58	38
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872460669	FE	On-Demand	Anodyne	L3MBTL3	51	34
c1cc(N2CCN(c3cc(N4CCOCC4)ncn3)CC2)c(C2CC2)cn1	ZINC000872460704	FD	On-Demand	Anodyne	ADK	40	42
Cc1c(F)ncnc1N(C)Cc1ccc(S(C)(=O)=O)cc1	ZINC000872460719	DD	On-Demand	Anodyne	PTGS2	29	40
NC(=O)c1cc(N2CC[C@@H](CN3CCCC3)C2)nc(Cl)n1	ZINC000872460720	DD	On-Demand	Anodyne	SIRT3	15	44
NC(=O)c1cc(N2CC[C@H](CN3CCCC3)C2)nc(Cl)n1	ZINC000872460721	DD	On-Demand	Anodyne	SIRT3	15	44
Cc1ccc(S(=O)(=O)N2CCN(CC[S@@](C)=O)CC2)c(C#N)c1	ZINC000872460738	FC	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2CCN(CC[S@](C)=O)CC2)c(C#N)c1	ZINC000872460740	FC	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2CC[C@]3(CCOC3)C2)c(C#N)c1	ZINC000872460783	DD	On-Demand	Mild	TRPV4	46	39
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CCOC3)C2)c(C#N)c1	ZINC000872460785	DD	On-Demand	Mild	TRPV4	46	39
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H]1N(C)C	ZINC000872460787	GE	On-Demand	Anodyne	PKM	22	40
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H]1N(C)C	ZINC000872460789	GE	On-Demand	Anodyne	PKM	22	40
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H]1N(C)C	ZINC000872460791	GE	On-Demand	Anodyne	PKM	22	40
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H]1N(C)C	ZINC000872460817	GE	On-Demand	Anodyne	PKM	22	40
C[C@@]1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCO1	ZINC000872460852	FE	On-Demand	Anodyne	PKM	37	44
C[C@]1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCO1	ZINC000872460853	FE	On-Demand	Anodyne	PKM	37	44
C[C@@H](CCCO)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872460860	FF	On-Demand	Anodyne	CRTM	15	44
CC[C@H](CCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460861	FE	On-Demand	Anodyne	PKM	40	47
CC[C@@H](CCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872460862	FE	On-Demand	Anodyne	PKM	40	47
NC(=O)c1cc(NCc2ccccc2OCC2CC2)nc(Cl)n1	ZINC000872460867	EF	On-Demand	Anodyne	VCP	46	38
COc1ccccc1[C@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872460875	CH	On-Demand	Anodyne	EBP	21	50
COc1ccccc1[C@@H]1CCN(c2ccncc2C2CC2)C1	ZINC000872460876	CH	On-Demand	Anodyne	EBP	21	50
C[C@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460897	EF	On-Demand	Anodyne	ADRA1D	24	41
C[C@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460897	EF	On-Demand	Anodyne	ADRA1A	17	41
C[C@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460897	EF	On-Demand	Anodyne	ADRA1B	19	41
C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460902	EF	On-Demand	Anodyne	ADRA1D	24	41
C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460902	EF	On-Demand	Anodyne	ADRA1A	17	41
C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CN1C1CC1	ZINC000872460902	EF	On-Demand	Anodyne	ADRA1B	19	41
COC(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872460909	FE	On-Demand	Mild	EPHX2	31	46
COC(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872460909	FE	On-Demand	Mild	TRPV4	48	39
COc1ccccc1[C@@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460912	CF	On-Demand	Anodyne	PDE3A	47	44
COc1ccccc1[C@@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460912	CF	On-Demand	Anodyne	DCK	52	43
COc1ccccc1[C@@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460912	CF	On-Demand	Anodyne	PDE3B	50	44
COc1ccccc1[C@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460913	CF	On-Demand	Anodyne	PDE3A	47	44
COc1ccccc1[C@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460913	CF	On-Demand	Anodyne	DCK	52	43
COc1ccccc1[C@H]1CCN(c2ncnc(F)c2C)C1	ZINC000872460913	CF	On-Demand	Anodyne	PDE3B	50	44
Cn1ncc2c(NC3CCC(NC(=O)OC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872460930	GG	On-Demand	Anodyne	Q4VQ11_PIG	53	38
COC(=O)[C@@]1(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCOC1	ZINC000872460971	FD	On-Demand	Anodyne	MMP13	23	51
NC(=O)c1cc(NCc2cc(F)ccc2N2CCOCC2)nc(Cl)n1	ZINC000872460995	FD	On-Demand	Anodyne	PIK3CD	20	42
NC(=O)c1cc(NCc2cc(F)ccc2N2CCOCC2)nc(Cl)n1	ZINC000872460995	FD	On-Demand	Anodyne	PIK3CB	34	42
NC(=O)c1cc(NCc2cc(F)ccc2N2CCOCC2)nc(Cl)n1	ZINC000872460995	FD	On-Demand	Anodyne	STAT6	63	45
Cc1ccc(S(=O)(=O)N2CCS(=O)(=O)C3(CCCCC3)C2)c(C#N)c1	ZINC000872461027	GD	On-Demand	Mild	TRPV4	42	35
OC[C@@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872461058	CD	On-Demand	Anodyne	DCK	19	40
OC[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872461060	CD	On-Demand	Anodyne	DCK	19	40
O=C(c1ccccc1)N1CCC(CNc2ccnc3ncccc23)CC1	ZINC000872461075	EH	On-Demand	Anodyne	GRIN2B	54	47
O=C(c1ccccc1)N1CCC(CNc2ccnc3ncccc23)CC1	ZINC000872461075	EH	On-Demand	Anodyne	L3MBTL3	54	35
COc1ccccc1[C@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872461090	DH	On-Demand	Anodyne	EBP	24	48
COc1ccccc1[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872461092	DH	On-Demand	Anodyne	EBP	24	48
CCCN(CCO)c1nc(N)nc(C(F)F)n1	ZINC000872461120	BC	On-Demand	Anodyne	SLC29A1	24	43
O=C(c1ccccc1)N1CCC(CN=c2cc[nH]cc2C2CC2)CC1	ZINC000872461130	EG	On-Demand	Anodyne	L3MBTL3	57	35
Cc1ccc(S(=O)(=O)N2CCN(c3cccs3)CC2)c(C#N)c1	ZINC000872461140	EE	On-Demand	Mild	TRPV4	42	35
Cn1ncc2c(NCC3CCN(C(=O)c4ccccc4)CC3)nc(Cl)nc21	ZINC000872461156	GF	On-Demand	Anodyne	GRIN2B	42	38
Cc1ccc(S(=O)(=O)N2CC[C@H](OCC(C)C)C2)c(C#N)c1	ZINC000872461185	DE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](OCC(C)C)C2)c(C#N)c1	ZINC000872461186	DE	On-Demand	Mild	TRPV4	42	35
Oc1nnc(Cl)cc1Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC000872461199	EG	On-Demand	Anodyne	TNK2	30	48
Oc1nnc(Cl)cc1Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC000872461200	EG	On-Demand	Anodyne	TNK2	30	48
Cc1ccc(S(=O)(=O)N2C[C@H](C)[C@H](N(C)C)C2)c(C#N)c1	ZINC000872461226	DD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](N(C)C)C2)c(C#N)c1	ZINC000872461227	DD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[C@@H](N(C)C)C2)c(C#N)c1	ZINC000872461228	DD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](N(C)C)[C@H](C)C2)c(C#N)c1	ZINC000872461229	DD	On-Demand	Mild	TRPV4	43	35
C[C@@H](CCCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461245	DE	On-Demand	Anodyne	LEF	40	43
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872461275	CD	On-Demand	Mild	ITGAV	47	36
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872461276	CD	On-Demand	Mild	ITGAV	47	36
COCCCOC1CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461277	DD	On-Demand	Mild	TRPV4	43	36
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)OC	ZINC000872461300	CD	On-Demand	Mild	ITGAV	47	33
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)OC	ZINC000872461301	CD	On-Demand	Mild	ITGAV	47	33
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(c2cccs2)CC1	ZINC000872461302	FF	On-Demand	Mild	CCR8	48	31
COc1ccccc1[C@H]1CCN(c2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872461310	EE	On-Demand	Anodyne	SCD1	20	41
COc1ccccc1[C@@H]1CCN(c2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872461311	EE	On-Demand	Anodyne	SCD1	20	41
Cc1ccc(S(=O)(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872461314	GD	On-Demand	Mild	TRPV4	41	34
Cc1ccc(S(=O)(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)c(C#N)c1	ZINC000872461315	GD	On-Demand	Mild	TRPV4	41	34
Oc1nnc(Cl)cc1NCc1cc(F)ccc1N1CCOCC1	ZINC000872461341	EE	On-Demand	Anodyne	STAT6	57	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461446	GE	On-Demand	Mild	CCR8	99	45
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461446	GE	On-Demand	Mild	SFRP1	71	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461446	GE	On-Demand	Mild	WNT3	43	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461447	GE	On-Demand	Mild	CCR8	99	45
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461447	GE	On-Demand	Mild	SFRP1	71	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872461447	GE	On-Demand	Mild	WNT3	43	33
CN1CC[C@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1=O	ZINC000872461453	DE	On-Demand	Anodyne	GRM5	15	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCS3)cc2N1	ZINC000872461461	FF	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCS3)cc2N1	ZINC000872461462	FF	On-Demand	Anodyne	PKM	35	44
Nc1nc(NCC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872461485	FE	On-Demand	Anodyne	GRIN2B	58	44
Nc1nc(NCC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872461485	FE	On-Demand	Anodyne	TPH1	37	43
Nc1nc(NCC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872461485	FE	On-Demand	Anodyne	PTR1	49	37
Nc1nc(NCC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872461485	FE	On-Demand	Anodyne	VCP	65	41
Nc1nc(NCC2CCN(C(=O)c3ccccc3)CC2)nc(C(F)F)n1	ZINC000872461485	FE	On-Demand	Anodyne	L3MBTL3	58	34
C[C@@H]1COCCN1c1ccc(Nc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872461500	EE	On-Demand	Anodyne	MTOR	48	41
C[C@@H]1COCCN1c1ccc(Nc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872461500	EE	On-Demand	Anodyne	STAT6	56	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461528	FE	On-Demand	Mild	CCR8	95	47
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461528	FE	On-Demand	Mild	SFRP1	105	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461528	FE	On-Demand	Mild	WNT3	67	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461528	FE	On-Demand	Mild	MAP3K12	29	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461529	FE	On-Demand	Mild	CCR8	95	47
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461529	FE	On-Demand	Mild	SFRP1	105	41
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461529	FE	On-Demand	Mild	WNT3	67	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000872461529	FE	On-Demand	Mild	MAP3K12	29	40
Nc1nc(NCc2cc(F)ccc2N2CCOCC2)nc(C(F)F)n1	ZINC000872461550	FD	On-Demand	Anodyne	STAT6	51	42
COc1ccc(OC)c2sc(N3CCN(CC[S@](C)=O)CC3)nc12	ZINC000872461587	FD	On-Demand	Anodyne	HTR1A	46	37
COc1ccc(OC)c2sc(N3CCN(CC[S@](C)=O)CC3)nc12	ZINC000872461587	FD	On-Demand	Anodyne	ADRA1D	29	42
COc1ccc(OC)c2sc(N3CCN(CC[S@](C)=O)CC3)nc12	ZINC000872461587	FD	On-Demand	Anodyne	ADRA1A	26	42
COc1ccc(OC)c2sc(N3CCN(CC[S@@](C)=O)CC3)nc12	ZINC000872461588	FD	On-Demand	Anodyne	HTR1A	46	37
COc1ccc(OC)c2sc(N3CCN(CC[S@@](C)=O)CC3)nc12	ZINC000872461588	FD	On-Demand	Anodyne	ADRA1D	29	42
COc1ccc(OC)c2sc(N3CCN(CC[S@@](C)=O)CC3)nc12	ZINC000872461588	FD	On-Demand	Anodyne	ADRA1A	26	42
C[S@@](=O)CCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872461593	FE	On-Demand	Anodyne	HTR1A	22	43
C[S@@](=O)CCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872461593	FE	On-Demand	Anodyne	HTR2A	16	41
COCCCOC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872461617	EG	On-Demand	Anodyne	P2RY12	30	42
C[C@@H]1CN(C2CC2)C[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461622	EF	On-Demand	Anodyne	ADRA1D	25	41
C[C@@H]1CN(C2CC2)C[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461622	EF	On-Demand	Anodyne	ADRA1A	18	41
C[C@@H]1CN(C2CC2)C[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461622	EF	On-Demand	Anodyne	ADRA1B	19	41
C[C@@H]1CN(C2CC2)C[C@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461626	EF	On-Demand	Anodyne	ADRA1D	25	41
C[C@@H]1CN(C2CC2)C[C@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461626	EF	On-Demand	Anodyne	ADRA1A	18	41
C[C@@H]1CN(C2CC2)C[C@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872461626	EF	On-Demand	Anodyne	ADRA1B	19	41
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461655	DD	On-Demand	Mild	EPHX2	23	43
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461655	DD	On-Demand	Mild	CCR8	105	45
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461655	DD	On-Demand	Mild	SFRP1	110	36
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461655	DD	On-Demand	Mild	WNT3	74	36
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461656	DD	On-Demand	Mild	EPHX2	23	43
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461656	DD	On-Demand	Mild	CCR8	105	45
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461656	DD	On-Demand	Mild	SFRP1	110	36
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872461656	DD	On-Demand	Mild	WNT3	74	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CC=CC3)cc2N1	ZINC000872461675	EF	On-Demand	Anodyne	PKM	38	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cc2N1	ZINC000872461677	GF	On-Demand	Anodyne	PKM	28	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)cc2N1	ZINC000872461678	GF	On-Demand	Anodyne	PKM	28	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)cc2N1	ZINC000872461679	GF	On-Demand	Anodyne	PKM	28	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc2N1	ZINC000872461680	GF	On-Demand	Anodyne	PKM	28	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CN(C)C	ZINC000872461708	DD	On-Demand	Mild	CASP3	62	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CN(C)C	ZINC000872461708	DD	On-Demand	Mild	CASP7	63	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CN(C)C	ZINC000872461709	DD	On-Demand	Mild	CASP3	62	37
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CN(C)C	ZINC000872461709	DD	On-Demand	Mild	CASP7	63	35
C=C[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872461735	EE	On-Demand	Mild	PKM	40	49
C=C[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872461736	EE	On-Demand	Mild	PKM	40	49
COC(=O)CCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872461746	GG	On-Demand	Anodyne	CASP3	17	41
COC(=O)CCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872461746	GG	On-Demand	Anodyne	CACNA1I	44	33
O=S(=O)(NC1CCN(c2cccs2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872461776	GH	On-Demand	Anodyne	ADRA1D	29	40
O=S(=O)(NC1CCN(c2cccs2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872461776	GH	On-Demand	Anodyne	ADRA1A	20	40
O=S(=O)(NC1CCN(c2cccs2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872461776	GH	On-Demand	Anodyne	ADRA1B	23	40
O=S(=O)(NC1CCN(c2cccs2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872461776	GH	On-Demand	Anodyne	SFRP1	89	36
O=S(=O)(NC1CCN(c2cccs2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872461776	GH	On-Demand	Anodyne	WNT3	42	31
CC[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872461791	DG	On-Demand	Anodyne	GCKR	42	31
C[C@H](CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[S@@](C)=O	ZINC000872461805	GE	On-Demand	Anodyne	PKM	39	48
C[C@@H](CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[S@@](C)=O	ZINC000872461807	GE	On-Demand	Anodyne	PKM	39	48
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	HTR1A	44	43
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	DRD2	29	45
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	DRD4	39	42
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	HTR2A	35	43
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	DRD3	32	42
Cc1c(F)ncnc1N(C)CCN1CCN(c2ccccc2)CC1	ZINC000872461809	EE	On-Demand	Anodyne	HTR7	50	51
C[C@@H](CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[S@](C)=O	ZINC000872461810	GE	On-Demand	Anodyne	PKM	39	48
C[C@H](CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[S@](C)=O	ZINC000872461811	GE	On-Demand	Anodyne	PKM	39	48
C[C@@H]1CN(C2CC2)C[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872461845	GE	On-Demand	Anodyne	PKM	31	43
C[C@@H]1CN(C2CC2)C[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872461847	GE	On-Demand	Anodyne	PKM	31	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCC[C@H]3CO)cc2N1	ZINC000872461865	GE	On-Demand	Anodyne	PKM	34	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCC[C@H]3CO)cc2N1	ZINC000872461868	GE	On-Demand	Anodyne	PKM	34	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCC[C@@H]3CO)cc2N1	ZINC000872461872	GE	On-Demand	Anodyne	PKM	34	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCC[C@@H]3CO)cc2N1	ZINC000872461875	GE	On-Demand	Anodyne	PKM	34	43
NC(=O)c1cc(N2CC[C@H](Cc3ccccc3)C2)nc(Cl)n1	ZINC000872461887	DE	On-Demand	Anodyne	GRIN2B	65	39
NC(=O)c1cc(N2CC[C@@H](Cc3ccccc3)C2)nc(Cl)n1	ZINC000872461889	DE	On-Demand	Anodyne	GRIN2B	65	39
C[C@H]1[C@H](C)CCCN1c1cc(C(N)=O)nc(Cl)n1	ZINC000872461900	CD	On-Demand	Anodyne	TRPC6	49	34
CCCN(CC(=O)NC)c1nc2c(OC)ccc(OC)c2s1	ZINC000872461911	DE	On-Demand	Anodyne	ADORA2B	17	42
C=C(C)COCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872461971	FE	On-Demand	Mild	PKM	37	46
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000872461972	GD	On-Demand	Mild	SLC18A3	39	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000872461972	GD	On-Demand	Mild	CCR8	74	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000872461975	GD	On-Demand	Mild	SLC18A3	39	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000872461975	GD	On-Demand	Mild	CCR8	74	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000872461977	GD	On-Demand	Mild	SLC18A3	39	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000872461977	GD	On-Demand	Mild	CCR8	74	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000872461979	GD	On-Demand	Mild	SLC18A3	39	41
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000872461979	GD	On-Demand	Mild	CCR8	74	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCC(F)(F)C3)cc2N1	ZINC000872461990	GG	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCC(F)(F)C3)cc2N1	ZINC000872461993	GG	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ccc(F)cn3)cc2N1	ZINC000872461997	GF	On-Demand	Anodyne	PKM	37	43
c1cnc2nccc(NCCCOC3CCOCC3)c2c1	ZINC000872462017	CF	On-Demand	Anodyne	HNMT	50	36
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462024	FD	On-Demand	Mild	CCR8	82	46
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462024	FD	On-Demand	Mild	SFRP1	91	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462024	FD	On-Demand	Mild	WNT3	71	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462027	FD	On-Demand	Mild	CCR8	82	46
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462027	FD	On-Demand	Mild	SFRP1	91	35
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000872462027	FD	On-Demand	Mild	WNT3	71	35
C[S@@](=O)CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872462085	ED	On-Demand	Anodyne	DRD4	36	43
C=C[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462118	CF	On-Demand	Mild	LEF	36	42
C=C[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462119	CF	On-Demand	Mild	LEF	36	42
Cc1c(F)ncnc1NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872462134	EF	On-Demand	Anodyne	GRIN2B	58	44
Cc1c(F)ncnc1NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872462134	EF	On-Demand	Anodyne	TNK2	43	41
Cc1c(F)ncnc1NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872462134	EF	On-Demand	Anodyne	GPR119	37	40
Cc1c(F)ncnc1NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000872462134	EF	On-Demand	Anodyne	L3MBTL3	58	35
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CN1C1CC1	ZINC000872462170	GF	On-Demand	Anodyne	PKM	28	42
C[C@@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CN1C1CC1	ZINC000872462173	GF	On-Demand	Anodyne	PKM	28	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCF)cc2N1	ZINC000872462195	EE	On-Demand	Anodyne	PKM	41	49
COc1ccc(OC)c2sc(Nc3ccn(CC(=O)N(C)C)n3)nc12	ZINC000872462213	FE	On-Demand	Anodyne	ADORA2B	17	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462218	GE	On-Demand	Anodyne	HTR1A	48	38
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462218	GE	On-Demand	Anodyne	DRD2	37	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462218	GE	On-Demand	Anodyne	ADRA1D	62	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462218	GE	On-Demand	Anodyne	ADRA1A	50	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462218	GE	On-Demand	Anodyne	ADRA1B	48	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462219	GE	On-Demand	Anodyne	HTR1A	48	38
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462219	GE	On-Demand	Anodyne	DRD2	37	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462219	GE	On-Demand	Anodyne	ADRA1D	62	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462219	GE	On-Demand	Anodyne	ADRA1A	50	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462219	GE	On-Demand	Anodyne	ADRA1B	48	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462223	GE	On-Demand	Anodyne	HTR1A	48	38
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462223	GE	On-Demand	Anodyne	DRD2	37	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462223	GE	On-Demand	Anodyne	ADRA1D	62	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462223	GE	On-Demand	Anodyne	ADRA1A	50	40
COc1ccccc1N1CC[C@H](NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)C1	ZINC000872462223	GE	On-Demand	Anodyne	ADRA1B	48	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462225	GE	On-Demand	Anodyne	HTR1A	48	38
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462225	GE	On-Demand	Anodyne	DRD2	37	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462225	GE	On-Demand	Anodyne	ADRA1D	62	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462225	GE	On-Demand	Anodyne	ADRA1A	50	40
COc1ccccc1N1CC[C@@H](NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)C1	ZINC000872462225	GE	On-Demand	Anodyne	ADRA1B	48	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOC2(CCOCC2)C1	ZINC000872462243	FE	On-Demand	Anodyne	PKM	41	37
CNC(=O)[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(C)C	ZINC000872462244	DC	On-Demand	Mild	MMP13	16	45
Cn1ccnc1N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872462261	FE	On-Demand	Anodyne	PKM	42	41
Cn1ccnc1N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872462261	FE	On-Demand	Anodyne	GCK	41	34
CC[C@]1(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872462344	CF	On-Demand	Mild	TRPV4	51	44
C[C@@H](C[C@@H]1CCOC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462364	EF	On-Demand	Anodyne	LEF	28	45
C[C@@H](C[C@H]1CCOC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462367	EF	On-Demand	Anodyne	LEF	28	45
C[C@H](C[C@@H]1CCOC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462371	EF	On-Demand	Anodyne	LEF	28	45
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462439	EE	On-Demand	Anodyne	CASP3	111	44
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462439	EE	On-Demand	Anodyne	CASP7	121	44
OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872462445	EE	On-Demand	Anodyne	SIGMAR1	30	40
OC[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872462450	EE	On-Demand	Anodyne	SIGMAR1	30	40
OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872462454	EE	On-Demand	Anodyne	SIGMAR1	30	40
OC[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872462457	EE	On-Demand	Anodyne	SIGMAR1	30	40
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR1A	171	49
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	ADRA2A	15	40
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	DRD2	135	56
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	DRD1	42	44
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	DRD4	75	47
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	ADRA1D	64	46
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR1D	41	38
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR1B	41	39
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR2A	101	49
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR2C	54	49
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	SLC6A4	39	49
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	ADRA1A	65	46
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HRH1	16	40
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	ADRA1B	49	46
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	DRD3	141	56
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR4	18	41
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	HTR7	135	44
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	SIGMAR1	22	46
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	ABCB1	28	40
CCC(=O)c1c(Cl)cccc1N1CCN(CCCCO)CC1	ZINC000872462480	DF	On-Demand	Anodyne	CYP2J2	42	30
COCC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872462503	FE	On-Demand	Anodyne	PKM	38	47
Cn1ncc2c(NCc3cc(F)ccc3N3CCOCC3)nc(Cl)nc21	ZINC000872462551	GF	On-Demand	Anodyne	ABL1	21	41
Cn1ncc2c(NCc3cc(F)ccc3N3CCOCC3)nc(Cl)nc21	ZINC000872462551	GF	On-Demand	Anodyne	STAT6	45	38
COC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C1CC1	ZINC000872462586	FE	On-Demand	Anodyne	PKM	37	44
COC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C1CC1	ZINC000872462587	FE	On-Demand	Anodyne	PKM	37	44
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462599	FE	On-Demand	Anodyne	CASP3	113	46
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462599	FE	On-Demand	Anodyne	CASP7	125	45
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462599	FE	On-Demand	Anodyne	MMP1	31	40
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462600	FE	On-Demand	Anodyne	CASP3	113	46
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462600	FE	On-Demand	Anodyne	CASP7	125	45
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462600	FE	On-Demand	Anodyne	MMP1	31	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3ncccc3F)cc2N1	ZINC000872462603	GF	On-Demand	Anodyne	PKM	38	42
CCOC(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872462645	FF	On-Demand	Mild	EPHX2	25	43
CCOC(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872462645	FF	On-Demand	Mild	TRPV4	47	38
O=S(=O)(c1cccc(Br)n1)N1CCc2c[nH]nc2C1	ZINC000872462646	ED	On-Demand	Anodyne	AKR1C3	48	34
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	MMP13	37	49
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	MMP2	19	49
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	CAPN1	15	48
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	MMP12	86	43
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	MMP7	15	45
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872462649	ED	On-Demand	Anodyne	LEF	49	60
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(C)C	ZINC000872462651	DC	On-Demand	Mild	MMP13	24	45
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(C)C	ZINC000872462651	DC	On-Demand	Mild	MMP12	69	35
CNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(C)C	ZINC000872462651	DC	On-Demand	Mild	LEF	18	48
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872462656	DE	On-Demand	Anodyne	LEF	34	45
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872462657	DE	On-Demand	Anodyne	LEF	34	45
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000872462722	ED	On-Demand	Bother	SLC6A9	17	42
Cc1c(F)ncnc1NCc1cc(F)ccc1N1CCOCC1	ZINC000872462767	DF	On-Demand	Anodyne	STAT6	52	41
C#CCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872462786	FF	On-Demand	Mild	PKM	36	46
Cc1c(F)ncnc1N1CCN(CC[S@](C)=O)CC1	ZINC000872462842	CC	On-Demand	Anodyne	ABCC1	62	34
Cc1c(F)ncnc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872462861	CC	On-Demand	Anodyne	ABCC1	62	34
C[C@@H](Nc1nc(N)nc(C(F)F)n1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872462916	FE	On-Demand	Anodyne	DRD4	18	40
C[C@@H](Nc1nc(N)nc(C(F)F)n1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872462919	FE	On-Demand	Anodyne	DRD4	18	40
COC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462927	DD	On-Demand	Anodyne	MMP2	16	43
COC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462927	DD	On-Demand	Anodyne	MMP12	45	35
COC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462927	DD	On-Demand	Anodyne	LEF	44	52
CCOC(=O)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872462930	DD	On-Demand	Anodyne	P2RY12	55	37
CCOC(=O)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872462930	DD	On-Demand	Anodyne	DGAT1	32	41
CCOC(=O)[C@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872462931	DD	On-Demand	Anodyne	P2RY12	55	37
CCOC(=O)[C@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872462931	DD	On-Demand	Anodyne	DGAT1	32	41
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462957	FD	On-Demand	Anodyne	CCR8	92	42
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462957	FD	On-Demand	Anodyne	SFRP1	71	34
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462957	FD	On-Demand	Anodyne	WNT3	42	34
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462958	FD	On-Demand	Anodyne	CCR8	92	42
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462958	FD	On-Demand	Anodyne	SFRP1	71	34
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872462958	FD	On-Demand	Anodyne	WNT3	42	34
CC[C@@H](O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462959	DE	On-Demand	Anodyne	LEF	32	40
CC[C@H](O)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872462960	DE	On-Demand	Anodyne	LEF	32	40
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462986	GF	On-Demand	Anodyne	CCR8	71	39
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462986	GF	On-Demand	Anodyne	SFRP1	146	50
O=C(c1ccccc1)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462986	GF	On-Demand	Anodyne	WNT3	95	43
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462987	GF	On-Demand	Anodyne	CCR8	71	39
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462987	GF	On-Demand	Anodyne	SFRP1	146	50
O=C(c1ccccc1)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872462987	GF	On-Demand	Anodyne	WNT3	95	43
CCOC(=O)CC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872462997	FF	On-Demand	Mild	TRPV4	43	35
CCOC(=O)CC[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872462999	FF	On-Demand	Mild	TRPV4	43	35
O=S(=O)(NCCN1CCC1)c1cccc(Br)n1	ZINC000872463066	DC	On-Demand	Anodyne	HTR7	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCc3cccc(F)n3)cc2N1	ZINC000872463098	GF	On-Demand	Anodyne	PKM	38	43
CN(C)C(=O)c1cccc(CCNc2nc(N)nc(C(F)F)n2)c1	ZINC000872463132	ED	On-Demand	Anodyne	TPH1	49	36
NC(=O)C1(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCOCC1	ZINC000872463143	FD	On-Demand	Anodyne	MMP13	20	49
Oc1nnc(Cl)cc1N1CCN(c2ncnc3ccsc23)CC1	ZINC000872463160	EE	On-Demand	Anodyne	SIRT3	87	38
Oc1nnc(Cl)cc1N1CCN(c2ncnc3ccsc23)CC1	ZINC000872463160	EE	On-Demand	Anodyne	SIRT2	73	38
Oc1nnc(Cl)cc1N1CCN(c2ncnc3ccsc23)CC1	ZINC000872463160	EE	On-Demand	Anodyne	SIRT1	64	38
Oc1nnc(Cl)cc1N1CC[C@H](Cc2ccccc2)C1	ZINC000872463183	CF	On-Demand	Anodyne	GRIN2B	57	39
Oc1nnc(Cl)cc1N1CC[C@H](Cc2ccccc2)C1	ZINC000872463183	CF	On-Demand	Anodyne	LIPG	17	40
Oc1nnc(Cl)cc1N1CC[C@@H](Cc2ccccc2)C1	ZINC000872463184	CF	On-Demand	Anodyne	GRIN2B	57	39
Oc1nnc(Cl)cc1N1CC[C@@H](Cc2ccccc2)C1	ZINC000872463184	CF	On-Demand	Anodyne	LIPG	17	40
Cc1ccc(S(=O)(=O)N2CC[C@H](CCO)C2)c(C#N)c1	ZINC000872463215	CD	On-Demand	Mild	EPHX2	16	41
Cc1ccc(S(=O)(=O)N2CC[C@H](CCO)C2)c(C#N)c1	ZINC000872463215	CD	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](CCO)C2)c(C#N)c1	ZINC000872463216	CD	On-Demand	Mild	EPHX2	16	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](CCO)C2)c(C#N)c1	ZINC000872463216	CD	On-Demand	Mild	TRPV4	44	36
OCC[C@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872463220	CF	On-Demand	Anodyne	VCP	42	34
OCC[C@@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872463222	CF	On-Demand	Anodyne	VCP	42	34
CC[C@@H](O)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872463233	FE	On-Demand	Anodyne	PKM	42	50
CC[C@H](O)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872463235	FE	On-Demand	Anodyne	PKM	42	50
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(C4CC4)CC3)cc2N1	ZINC000872463258	FF	On-Demand	Anodyne	PKM	36	47
C[C@@H](Nc1cc(Cl)nnc1O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000872463276	EF	On-Demand	Anodyne	DRD4	29	42
C[C@@H](Nc1cc(Cl)nnc1O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000872463277	EF	On-Demand	Anodyne	DRD4	29	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2c[nH]nc2C1	ZINC000872463363	EE	On-Demand	Anodyne	AKR1C3	59	38
NC(=O)c1cc(Nc2ccc(N3CCSCC3)cc2)nc(Cl)n1	ZINC000872463368	EF	On-Demand	Anodyne	MAPK10	43	39
NC(=O)c1cc(Nc2ccc(N3CCSCC3)cc2)nc(Cl)n1	ZINC000872463368	EF	On-Demand	Anodyne	STAT6	72	36
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463375	FD	On-Demand	Anodyne	CASP3	68	36
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463375	FD	On-Demand	Anodyne	CASP7	78	37
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463375	FD	On-Demand	Anodyne	MMP1	23	40
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463376	FD	On-Demand	Anodyne	CASP3	68	36
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463376	FD	On-Demand	Anodyne	CASP7	78	37
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872463376	FD	On-Demand	Anodyne	MMP1	23	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(C(F)F)CC3)cc2N1	ZINC000872463442	GG	On-Demand	Anodyne	PKM	21	40
O=S(=O)(CC1CC2(CCC2)C1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000872463505	FE	On-Demand	Anodyne	SLC18A3	29	42
O=S(=O)(CC1CC2(CCC2)C1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000872463506	FE	On-Demand	Anodyne	SLC18A3	29	42
O=S(=O)(CC1CC2(CCC2)C1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000872463507	FE	On-Demand	Anodyne	SLC18A3	29	42
O=C(C1CCCC1)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872463525	GF	On-Demand	Anodyne	SFRP1	132	41
O=C(C1CCCC1)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872463525	GF	On-Demand	Anodyne	WNT3	91	41
O=C(C1CCCC1)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872463526	GF	On-Demand	Anodyne	SFRP1	132	41
O=C(C1CCCC1)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872463526	GF	On-Demand	Anodyne	WNT3	91	41
C[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872463527	FD	On-Demand	Anodyne	LEF	36	40
C[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872463528	FD	On-Demand	Anodyne	LEF	36	40
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872463550	DD	On-Demand	Mild	CASP3	65	40
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872463550	DD	On-Demand	Mild	CASP7	80	40
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872463552	DD	On-Demand	Mild	CASP3	65	40
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872463552	DD	On-Demand	Mild	CASP7	80	40
COCCCOC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872463595	ED	On-Demand	Anodyne	SCD1	18	41
CCOC(=O)[C@@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872463597	EF	On-Demand	Anodyne	DGAT1	18	43
CCOC(=O)[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872463599	EF	On-Demand	Anodyne	DGAT1	18	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CN4CCN3CC4)cc2N1	ZINC000872463656	GC	On-Demand	Anodyne	PKM	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CN4CCN3CC4)cc2N1	ZINC000872463658	GC	On-Demand	Anodyne	PKM	32	44
C[C@@H]1CN(Cc2ccccc2)CCCN1c1cc(Cl)nnc1O	ZINC000872463663	EF	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCCN1c1cc(Cl)nnc1O	ZINC000872463663	EF	On-Demand	Anodyne	SIGMAR1	28	43
C[C@H]1CN(Cc2ccccc2)CCCN1c1cc(Cl)nnc1O	ZINC000872463665	EF	On-Demand	Anodyne	DRD4	41	38
C[C@H]1CN(Cc2ccccc2)CCCN1c1cc(Cl)nnc1O	ZINC000872463665	EF	On-Demand	Anodyne	SIGMAR1	28	43
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463676	GD	On-Demand	Anodyne	PKM	28	42
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463676	GD	On-Demand	Anodyne	CCR8	66	37
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463676	GD	On-Demand	Anodyne	SFRP1	48	33
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463676	GD	On-Demand	Anodyne	WNT3	44	33
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463677	GD	On-Demand	Anodyne	PKM	28	42
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463677	GD	On-Demand	Anodyne	CCR8	66	37
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463677	GD	On-Demand	Anodyne	SFRP1	48	33
CCC(=O)N1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872463677	GD	On-Demand	Anodyne	WNT3	44	33
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@H](C)C1	ZINC000872463699	FE	On-Demand	Anodyne	HSD11B1	22	40
CC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@@H](C)C1	ZINC000872463701	FE	On-Demand	Anodyne	HSD11B1	22	40
COc1ccc(CN(C)S(=O)(=O)c2c(C)cccc2C#N)cn1	ZINC000872463718	EE	On-Demand	Mild	OXTR	18	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@@H](O)C(F)(F)F)CC1	ZINC000872463733	GG	On-Demand	Anodyne	GCK	49	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@H](O)C(F)(F)F)CC1	ZINC000872463746	GG	On-Demand	Anodyne	GCK	49	34
O=C1OC[C@H]2CN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CCN12	ZINC000872463777	FD	On-Demand	Anodyne	PKM	44	39
O=C1OC[C@@H]2CN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CCN12	ZINC000872463780	FD	On-Demand	Anodyne	PKM	44	39
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)c(C#N)c1	ZINC000872463805	GC	On-Demand	Mild	EPHX2	17	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c(C#N)c1	ZINC000872463807	GC	On-Demand	Mild	EPHX2	17	40
CN(C)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872463927	FG	On-Demand	Anodyne	ADRA1D	24	40
CN(C)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872463927	FG	On-Demand	Anodyne	ADRA1A	17	40
CN(C)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872463927	FG	On-Demand	Anodyne	ADRA1B	19	40
Cc1c(F)ncnc1N1CCN(c2ncnc3ccsc23)CC1	ZINC000872463997	EE	On-Demand	Anodyne	SIRT3	54	32
Cc1c(F)ncnc1N1CCN(c2ncnc3ccsc23)CC1	ZINC000872463997	EE	On-Demand	Anodyne	SIRT2	46	32
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(C(F)F)CC1	ZINC000872464044	EG	On-Demand	Anodyne	PKM	48	40
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	HTR1A	87	42
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	DRD2	61	40
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	DRD4	40	39
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	ADRA1D	52	38
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	HTR2A	30	40
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	ADRA1A	46	39
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	DRD3	68	40
COc1ccc(OC)c2sc(N3CCN(CCCCO)CC3)nc12	ZINC000872464083	FE	On-Demand	Anodyne	HTR7	57	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCN3CCC3)cc2N1	ZINC000872464086	FD	On-Demand	Anodyne	PKM	39	50
COc1ccc(OC)c2sc(N[C@H](C)CC(N)=O)nc12	ZINC000872464143	CD	On-Demand	Anodyne	ADORA2B	18	46
COc1ccc(OC)c2sc(N[C@H](C)CC(N)=O)nc12	ZINC000872464143	CD	On-Demand	Anodyne	ENPP1	45	31
COc1ccc(OC)c2sc(N[C@@H](C)CC(N)=O)nc12	ZINC000872464145	CD	On-Demand	Anodyne	ADORA2B	18	46
COc1ccc(OC)c2sc(N[C@@H](C)CC(N)=O)nc12	ZINC000872464145	CD	On-Demand	Anodyne	ENPP1	45	31
Nc1nsc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872464205	GD	On-Demand	Anodyne	PKM	40	38
Nc1nsc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872464205	GD	On-Demand	Anodyne	GCK	42	36
CS(=O)(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872464228	FD	On-Demand	Anodyne	PKM	50	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC(F)(F)C3)cc2N1	ZINC000872464248	GG	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC(F)(F)C3)cc2N1	ZINC000872464252	GG	On-Demand	Anodyne	PKM	37	44
CNC(=O)[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(C)C	ZINC000872464274	FC	On-Demand	Anodyne	MMP13	21	47
CNC(=O)[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(C)C	ZINC000872464274	FC	On-Demand	Anodyne	ADAM17	15	40
CNC(=O)[C@@H](NS(=O)(=O)c1cccc(Br)n1)C(C)C	ZINC000872464274	FC	On-Demand	Anodyne	MMP12	40	37
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872464317	GE	On-Demand	Anodyne	CASP3	54	36
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872464317	GE	On-Demand	Anodyne	CASP7	57	37
Oc1nnc(Cl)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872464325	ED	On-Demand	Anodyne	NPFFR2	35	41
Oc1nnc(Cl)cc1NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000872464325	ED	On-Demand	Anodyne	NPFFR1	47	41
Oc1nnc(Cl)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872464326	ED	On-Demand	Anodyne	NPFFR2	35	41
Oc1nnc(Cl)cc1NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000872464326	ED	On-Demand	Anodyne	NPFFR1	47	41
Cc1ccc(S(=O)(=O)N2CC[C@]3(O)CCCC[C@H]3C2)c(C#N)c1	ZINC000872464403	EE	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)c(C#N)c1	ZINC000872464405	EE	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)c(C#N)c1	ZINC000872464408	EE	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)c(C#N)c1	ZINC000872464411	EE	On-Demand	Mild	TRPV4	46	38
O=S(=O)(NCCN1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872464412	DD	On-Demand	Anodyne	HTR2A	16	41
O=S(=O)(NCCN1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872464412	DD	On-Demand	Anodyne	HTR7	37	44
O=S(=O)(NCCN1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872464412	DD	On-Demand	Anodyne	HTR6	17	41
Cc1ccc(S(=O)(=O)N2CCN(c3nccn3C)CC2)c(C#N)c1	ZINC000872464415	ED	On-Demand	Mild	TRPV4	42	34
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872464423	ED	On-Demand	Anodyne	CASP3	68	36
CN(C)C[C@@H]1CCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872464423	ED	On-Demand	Anodyne	CASP7	69	35
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464429	FE	On-Demand	Anodyne	CCR8	70	38
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464429	FE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464429	FE	On-Demand	Anodyne	WNT3	84	40
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464431	FE	On-Demand	Anodyne	CCR8	70	38
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464431	FE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872464431	FE	On-Demand	Anodyne	WNT3	84	40
Cc1ncc(CCNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)s1	ZINC000872464439	GF	On-Demand	Anodyne	PKM	36	46
CC(C)(C)C[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872464449	EF	On-Demand	Anodyne	LEF	37	42
CC(C)(C)C[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872464452	EF	On-Demand	Anodyne	LEF	37	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCOC4(CCC4)C3)cc2N1	ZINC000872464456	GF	On-Demand	Anodyne	PKM	25	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCOC4(CCC4)C3)cc2N1	ZINC000872464460	GF	On-Demand	Anodyne	PKM	25	41
CC(=O)N(Cc1noc(C)n1)[C@H]1CCN(S(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872464493	GD	On-Demand	Anodyne	ADAMTS4	41	36
CC(=O)N(Cc1noc(C)n1)[C@@H]1CCN(S(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872464501	GD	On-Demand	Anodyne	ADAMTS4	41	36
Cc1ccc(S(=O)(=O)N2CCOC3(CCOCC3)C2)c(C#N)c1	ZINC000872464589	ED	On-Demand	Mild	TRPV4	42	35
C[S@@](=O)CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872464597	DD	On-Demand	Anodyne	HTR1A	60	44
C[S@@](=O)CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872464597	DD	On-Demand	Anodyne	DRD2	36	44
C[S@@](=O)CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872464597	DD	On-Demand	Anodyne	HTR1B	45	39
C[S@@](=O)CCN1CCN(c2ccnc3ncccc23)CC1	ZINC000872464597	DD	On-Demand	Anodyne	HTR2A	21	44
CCOC(=O)[C@H](C)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872464602	EE	On-Demand	Anodyne	LEF	36	42
Cc1ccc(S(=O)(=O)N2CCOC3(CCCC3)C2)c(C#N)c1	ZINC000872464614	DE	On-Demand	Mild	TRPV4	42	35
CCC(=O)N1CC[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464629	GF	On-Demand	Anodyne	MLNR	21	42
CCC(=O)N1CC[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464629	GF	On-Demand	Anodyne	EPHX2	27	51
CCC(=O)N1CC[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464629	GF	On-Demand	Anodyne	MCHR1	27	43
CCC(=O)N1CC[C@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464629	GF	On-Demand	Anodyne	SFRP1	59	36
CCC(=O)N1CC[C@@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464630	GF	On-Demand	Anodyne	MLNR	21	42
CCC(=O)N1CC[C@@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464630	GF	On-Demand	Anodyne	EPHX2	27	51
CCC(=O)N1CC[C@@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464630	GF	On-Demand	Anodyne	MCHR1	27	43
CCC(=O)N1CC[C@@H](NS(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872464630	GF	On-Demand	Anodyne	SFRP1	59	36
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	HTR1A	96	51
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	DRD2	77	49
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	DRD4	53	45
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	ADRA1D	37	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	HTR2A	57	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	HTR2C	38	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	SLC6A4	27	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	ADRA1A	34	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	ADRA1B	28	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	DRD3	96	49
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@@](C)=O)CC1	ZINC000872464646	EE	On-Demand	Anodyne	HTR7	64	39
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	HTR1A	96	51
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	DRD2	77	49
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	DRD4	53	45
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	ADRA1D	37	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	HTR2A	57	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	HTR2C	38	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	SLC6A4	27	42
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	ADRA1A	34	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	ADRA1B	28	41
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	DRD3	96	49
CCC(=O)c1c(Cl)cccc1N1CCN(CC[S@](C)=O)CC1	ZINC000872464647	EE	On-Demand	Anodyne	HTR7	64	39
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872464656	DD	On-Demand	Mild	CCR8	99	46
CCC(=O)N1CC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872464656	DD	On-Demand	Mild	SFRP1	47	33
CCC(=O)N1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872464657	DD	On-Demand	Mild	CCR8	99	46
CCC(=O)N1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872464657	DD	On-Demand	Mild	SFRP1	47	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3ccncc3)cc2N1	ZINC000872464690	GF	On-Demand	Anodyne	PKM	38	48
C[S@@](=O)CCN1CCN(c2cc(C(C)(C)C)nc(Cl)n2)CC1	ZINC000872464703	ED	On-Demand	Anodyne	DRD3	16	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2c[nH]nc2C1	ZINC000872464716	DD	On-Demand	Mild	AKR1C3	42	38
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872464782	DD	On-Demand	Mild	CASP3	68	36
COC(=O)C[C@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872464782	DD	On-Demand	Mild	CASP7	77	36
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872464783	DD	On-Demand	Mild	CASP3	68	36
COC(=O)C[C@@H]1CCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872464783	DD	On-Demand	Mild	CASP7	77	36
O=S(=O)(NCCCF)c1ccc(F)c(C(F)F)c1	ZINC000872464784	CE	On-Demand	Anodyne	LEF	26	42
C[C@H]1C[C@H](Nc2cc(-c3ccccc3)ncn2)CCN1C	ZINC000872464872	CG	On-Demand	Anodyne	PKNB	19	41
C[C@@H]1C[C@H](Nc2cc(-c3ccccc3)ncn2)CCN1C	ZINC000872464878	CG	On-Demand	Anodyne	PKNB	19	41
Cc1c(F)ncnc1N1CCN(CCCCO)CC1	ZINC000872464890	CC	On-Demand	Anodyne	ABCC1	61	34
Cn1ncc2c(N3CCN(c4ncnc5ccsc45)CC3)nc(Cl)nc21	ZINC000872464945	GE	On-Demand	Anodyne	HRH4	18	40
Cc1ccc(S(=O)(=O)N2CCc3c[nH]nc3C2)c(C#N)c1	ZINC000872464958	DD	On-Demand	Mild	TRPV4	41	34
CS[C@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872464992	FF	On-Demand	Anodyne	PKM	41	49
Cc1ccc(S(=O)(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)c(C#N)c1	ZINC000872465029	GE	On-Demand	Mild	DRD4	17	58
Cc1ccc(S(=O)(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)c(C#N)c1	ZINC000872465029	GE	On-Demand	Mild	ALKBH3	42	31
C#CCN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872465034	DC	On-Demand	Mild	TRPV4	47	39
C=CCCOCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872465061	FE	On-Demand	Mild	PKM	31	44
CC(=O)c1ccc2c(c1)CCN(S(=O)(=O)c1c(C)cccc1C#N)CC2	ZINC000872465094	FF	On-Demand	Mild	AKR1C3	59	44
COCC1(O)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872465100	DD	On-Demand	Mild	TRPV4	64	55
NC(=O)c1cc(N2CC[C@H](CN3CCCCC3)C2)nc(Cl)n1	ZINC000872465113	DD	On-Demand	Anodyne	SIRT3	15	43
NC(=O)c1cc(N2CC[C@@H](CN3CCCCC3)C2)nc(Cl)n1	ZINC000872465114	DD	On-Demand	Anodyne	SIRT3	15	43
O=S(=O)(NCCc1cnc(C2CC2)nc1)c1ccc(F)c(C(F)F)c1	ZINC000872465142	FF	On-Demand	Anodyne	TBXA2R	43	35
Cc1ccc(S(=O)(=O)N2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c(C#N)c1	ZINC000872465143	GD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c(C#N)c1	ZINC000872465143	GD	On-Demand	Mild	TRPV4	41	34
CC(=O)c1ccc2c(c1)CCN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC2	ZINC000872465149	GE	On-Demand	Anodyne	AKR1C3	50	36
CC(=O)c1ccc2c(c1)CCN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC2	ZINC000872465150	GE	On-Demand	Anodyne	AKR1C3	50	36
C[C@@H](CO)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872465183	EE	On-Demand	Anodyne	LEF	30	42
C[C@H](CO)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872465184	EE	On-Demand	Anodyne	LEF	30	42
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872465185	GD	On-Demand	Anodyne	CCR8	50	33
CC[C@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872465186	GD	On-Demand	Anodyne	CCR8	50	33
CC[C@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872465187	GD	On-Demand	Anodyne	CCR8	50	33
CC[C@@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1cccc(Br)n1	ZINC000872465188	GD	On-Demand	Anodyne	CCR8	50	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000872465294	GE	On-Demand	Mild	DRD4	16	61
C#CCN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872465350	ED	On-Demand	Mild	PKM	46	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC[C@@H](CO)CC3)cc2N1	ZINC000872465404	GE	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC[C@H](CO)CC3)cc2N1	ZINC000872465405	GE	On-Demand	Anodyne	PKM	37	44
COCC1(O)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872465410	FD	On-Demand	Anodyne	TRPV4	41	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465421	ED	On-Demand	Mild	CCR8	69	36
CC[C@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465422	ED	On-Demand	Mild	CCR8	69	36
CC[C@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465423	ED	On-Demand	Mild	CCR8	69	36
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465424	ED	On-Demand	Mild	CCR8	69	36
O=S(=O)(N[C@@H]1CC[C@H](CO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872465426	EF	On-Demand	Anodyne	ADRA1D	19	40
O=S(=O)(N[C@@H]1CC[C@H](CO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872465426	EF	On-Demand	Anodyne	LEF	22	40
O=S(=O)(N[C@@H]1CC[C@@H](CO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872465427	EF	On-Demand	Anodyne	ADRA1D	19	40
O=S(=O)(N[C@@H]1CC[C@@H](CO)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872465427	EF	On-Demand	Anodyne	LEF	22	40
COCC1(O)CCN(S(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872465440	DD	On-Demand	Mild	TRPV4	51	43
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872465491	EC	On-Demand	Anodyne	TRY2_BOVIN	52	33
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872465491	EC	On-Demand	Anodyne	LEF	44	48
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872465492	EC	On-Demand	Anodyne	TRY2_BOVIN	52	33
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872465492	EC	On-Demand	Anodyne	LEF	44	48
Cc1n[nH]c(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872465553	FH	On-Demand	Anodyne	CASP3	43	34
Cc1n[nH]c(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872465553	FH	On-Demand	Anodyne	CASP7	57	33
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](C2CCOCC2)C1	ZINC000872465652	FG	On-Demand	Anodyne	PKM	44	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](C2CCOCC2)C1	ZINC000872465653	FG	On-Demand	Anodyne	PKM	44	40
CC(=O)OC1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)CC1	ZINC000872465715	GF	On-Demand	Anodyne	LIPG	46	36
C[C@@H](CO)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872465731	FE	On-Demand	Anodyne	PKM	38	46
C[C@H](CO)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872465732	FE	On-Demand	Anodyne	PKM	38	46
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000872465752	CD	On-Demand	Mild	CCR8	46	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(c2ccccn2)CC1	ZINC000872465754	FH	On-Demand	Anodyne	PKM	38	40
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H]1CCCO1	ZINC000872465756	EF	On-Demand	Anodyne	LEF	30	41
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H]1CCCO1	ZINC000872465758	EF	On-Demand	Anodyne	LEF	30	41
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H]1CCCO1	ZINC000872465759	EF	On-Demand	Anodyne	LEF	30	41
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H]1CCCO1	ZINC000872465761	EF	On-Demand	Anodyne	LEF	30	41
Cc1cncc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1	ZINC000872465804	GF	On-Demand	Anodyne	PKM	36	46
CC(=O)c1ccc2c(c1)CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872465817	FF	On-Demand	Mild	TRPV4	42	35
CC(=O)c1ccc2c(c1)CCN(S(=O)(=O)c1ccc(C)cc1C#N)CC2	ZINC000872465817	FF	On-Demand	Mild	AKR1C3	42	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(C(F)(F)F)CC1	ZINC000872465824	ED	On-Demand	Mild	TRPV4	44	38
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465840	GE	On-Demand	Mild	CCR8	49	35
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872465845	GE	On-Demand	Mild	CCR8	49	35
Cc1c(F)ncnc1N(C)CC[C@H]1CCCCN1C	ZINC000872465911	CE	On-Demand	Anodyne	CHRNA10	56	36
Cc1c(F)ncnc1N(C)CC[C@H]1CCCCN1C	ZINC000872465911	CE	On-Demand	Anodyne	ACKR3	62	31
Cc1c(F)ncnc1N(C)CC[C@@H]1CCCCN1C	ZINC000872465915	CE	On-Demand	Anodyne	CHRNA10	56	36
Cc1c(F)ncnc1N(C)CC[C@@H]1CCCCN1C	ZINC000872465915	CE	On-Demand	Anodyne	ACKR3	62	31
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC[C@@H](O)CC3)cc2N1	ZINC000872465933	FE	On-Demand	Anodyne	PKM	38	46
CC(=O)OC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872465971	DD	On-Demand	Mild	EPHX2	27	45
CC(=O)OC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872465971	DD	On-Demand	Mild	TRPV4	48	41
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)N1CCC(OCCO)CC1	ZINC000872466015	GE	On-Demand	Anodyne	LIPG	37	44
C[C@]1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCOC1	ZINC000872466097	FE	On-Demand	Anodyne	PKM	39	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)CC3CC3)cc2N1	ZINC000872466161	FE	On-Demand	Anodyne	PKM	35	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)CC3CC3)cc2N1	ZINC000872466162	FE	On-Demand	Anodyne	PKM	35	42
CNC(=O)CCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872466172	GD	On-Demand	Anodyne	PKM	32	41
COc1cccc(O[C@H](C)CNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872466240	EE	On-Demand	Anodyne	MTNR1A	32	51
COc1cccc(O[C@H](C)CNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872466240	EE	On-Demand	Anodyne	MTNR1B	29	51
COc1cccc(O[C@@H](C)CNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872466245	EE	On-Demand	Anodyne	MTNR1A	32	51
COc1cccc(O[C@@H](C)CNc2cc(C(N)=O)nc(Cl)n2)c1	ZINC000872466245	EE	On-Demand	Anodyne	MTNR1B	29	51
C[C@@](O)(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(F)(F)F	ZINC000872466250	FE	On-Demand	Anodyne	PNMT	17	41
O=C1OCC[C@@H]2CN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CCN12	ZINC000872466253	FD	On-Demand	Anodyne	PKM	45	41
O=C1OCC[C@H]2CN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CCN12	ZINC000872466256	FD	On-Demand	Anodyne	PKM	45	41
Cc1ccc(S(=O)(=O)N2CCOC3(CCC3)C2)c(C#N)c1	ZINC000872466281	DD	On-Demand	Mild	TRPV4	42	35
CCS(=O)(=O)C[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872466304	FD	On-Demand	Anodyne	LEF	38	43
CCS(=O)(=O)C[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872466305	FD	On-Demand	Anodyne	LEF	38	43
CCOC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCOCC1	ZINC000872466325	GE	On-Demand	Anodyne	MMP13	23	41
CCOC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CCOCC1	ZINC000872466325	GE	On-Demand	Anodyne	LEF	40	61
C[C@H](CS(C)(=O)=O)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872466328	ED	On-Demand	Anodyne	LEF	36	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)(C(F)(F)F)CC1	ZINC000872466375	GF	On-Demand	Anodyne	GCK	48	35
COc1cccc(O[C@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466391	EE	On-Demand	Anodyne	DHFR	19	40
COc1cccc(O[C@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466391	EE	On-Demand	Anodyne	DRTS_TOXGO	29	40
COc1cccc(O[C@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466391	EE	On-Demand	Anodyne	MTNR1A	15	47
COc1cccc(O[C@@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466392	EE	On-Demand	Anodyne	DHFR	19	40
COc1cccc(O[C@@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466392	EE	On-Demand	Anodyne	DRTS_TOXGO	29	40
COc1cccc(O[C@@H](C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872466392	EE	On-Demand	Anodyne	MTNR1A	15	47
O=S(=O)(NC1CCC(F)(F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466393	EH	On-Demand	Anodyne	ADRA1D	20	41
O=S(=O)(NC1CCC(F)(F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466393	EH	On-Demand	Anodyne	ADRA1B	15	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	CASP3	44	34
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	MMP13	17	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	MMP3	21	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	CASP7	55	34
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	MMP7	27	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466413	GD	On-Demand	Anodyne	MMP1	23	41
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	CASP3	44	34
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	MMP13	17	41
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	MMP3	21	41
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	CASP7	55	34
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	MMP7	27	41
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872466414	GD	On-Demand	Anodyne	MMP1	23	41
C#CCN1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872466439	GD	On-Demand	Mild	PKM	18	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872466449	ED	On-Demand	Mild	CCR8	49	35
CC[C@H]1CN(C(C)=O)CC[C@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872466450	ED	On-Demand	Mild	CCR8	49	35
CC[C@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872466451	ED	On-Demand	Mild	CCR8	49	35
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872466452	ED	On-Demand	Mild	CCR8	49	35
Cc1c(F)ncnc1N1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000872466536	DE	On-Demand	Anodyne	GPR119	35	48
Cc1c(F)ncnc1N1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000872466536	DE	On-Demand	Anodyne	LIMK2	74	41
Cc1c(F)ncnc1N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1	ZINC000872466537	DE	On-Demand	Anodyne	GPR119	35	48
Cc1c(F)ncnc1N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1	ZINC000872466537	DE	On-Demand	Anodyne	LIMK2	74	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872466590	ED	On-Demand	Mild	CASP3	42	34
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872466590	ED	On-Demand	Mild	CASP7	54	34
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872466591	ED	On-Demand	Mild	CASP3	42	34
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872466591	ED	On-Demand	Mild	CASP7	54	34
COc1cccc(O[C@H](C)CNc2cc(Cl)nnc2O)c1	ZINC000872466597	DF	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@H](C)CNc2cc(Cl)nnc2O)c1	ZINC000872466597	DF	On-Demand	Anodyne	MTNR1B	25	52
COc1cccc(O[C@@H](C)CNc2cc(Cl)nnc2O)c1	ZINC000872466598	DF	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@@H](C)CNc2cc(Cl)nnc2O)c1	ZINC000872466598	DF	On-Demand	Anodyne	MTNR1B	25	52
NC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872466688	ED	On-Demand	Anodyne	GCKR	53	33
NC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872466689	ED	On-Demand	Anodyne	GCKR	53	33
C[C@@H](O)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872466694	FC	On-Demand	Anodyne	PKM	46	38
C[C@@H](O)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872466694	FC	On-Demand	Anodyne	TGM2	43	34
C[C@@H](O)C(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872466694	FC	On-Demand	Anodyne	F13A1	45	34
Cc1ccncc1[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872466743	GG	On-Demand	Anodyne	PKM	40	49
Cc1ccncc1[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872466744	GG	On-Demand	Anodyne	PKM	40	49
O=S(=O)(N[C@@H]1CC[C@@H](O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466778	DE	On-Demand	Anodyne	ADRA1D	24	44
O=S(=O)(N[C@@H]1CC[C@@H](O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466778	DE	On-Demand	Anodyne	ADRA1A	17	44
O=S(=O)(N[C@@H]1CC[C@@H](O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466778	DE	On-Demand	Anodyne	ADRA1B	18	44
O=S(=O)(N[C@@H]1CC[C@@H](O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466778	DE	On-Demand	Anodyne	SFRP1	45	33
O=S(=O)(N[C@@H](CO)CC1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466852	DE	On-Demand	Anodyne	LEF	33	49
O=S(=O)(N[C@H](CO)CC1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872466853	DE	On-Demand	Anodyne	LEF	33	49
COC1(C)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872466897	CD	On-Demand	Mild	TRPV4	52	41
CCN(CC(C)(C)O)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872466919	FE	On-Demand	Anodyne	PKM	31	40
CCC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCOCC1	ZINC000872466933	GF	On-Demand	Anodyne	PKM	37	45
C[C@@H]1CC(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H](C)O1	ZINC000872466950	GF	On-Demand	Anodyne	PKM	37	47
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H](C)O1	ZINC000872466952	GF	On-Demand	Anodyne	PKM	37	47
O=S(=O)(CC1CC2(CCC2)C1)N1CCC(Cc2cccnc2)CC1	ZINC000872466957	EG	On-Demand	Anodyne	CHRNA7	43	35
O=S(=O)(CC1CC2(CCC2)C1)N1CCC(Cc2cccnc2)CC1	ZINC000872466957	EG	On-Demand	Anodyne	ACHP_LYMST	25	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(c2ncccc2F)CC1	ZINC000872466995	FD	On-Demand	Mild	PKM	22	44
CS(=O)(=O)N1CCC[C@@H]1CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872467081	GD	On-Demand	Anodyne	CASP7	44	33
O=S(=O)(N[C@@H]1CCN(c2ccccn2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872467091	FF	On-Demand	Anodyne	SFRP1	68	36
O=S(=O)(N[C@H]1CCN(c2ccccn2)C1)c1ccc(F)c(C(F)F)c1	ZINC000872467092	FF	On-Demand	Anodyne	SFRP1	68	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCOC3)cc2N1	ZINC000872467106	ED	On-Demand	Anodyne	PKM	37	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCOC3)cc2N1	ZINC000872467107	ED	On-Demand	Anodyne	PKM	37	47
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467110	GE	On-Demand	Mild	CCR8	63	36
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467111	GE	On-Demand	Mild	CCR8	63	36
NS(=O)(=O)[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872467119	FC	On-Demand	Anodyne	PKM	34	40
NS(=O)(=O)[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872467120	FC	On-Demand	Anodyne	PKM	34	40
CN(CC1(O)CCCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872467165	GF	On-Demand	Anodyne	PKM	27	40
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)[C@@H](O)C(F)(F)F	ZINC000872467193	ED	On-Demand	Mild	NR3C2	19	46
CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)[C@H](O)C(F)(F)F	ZINC000872467198	ED	On-Demand	Mild	NR3C2	19	46
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)[C@H](O)C(F)(F)F	ZINC000872467200	ED	On-Demand	Mild	NR3C2	19	46
CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)[C@@H](O)C(F)(F)F	ZINC000872467201	ED	On-Demand	Mild	NR3C2	19	46
Cc1ccncc1[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872467225	EH	On-Demand	Anodyne	LEF	35	43
Cc1ccncc1[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872467229	EH	On-Demand	Anodyne	LEF	35	43
COc1ccc(O[C@@H](C)CNc2cc(C(N)=O)nc(Cl)n2)cc1	ZINC000872467261	EE	On-Demand	Anodyne	MTNR1A	15	41
COC1(C)CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872467267	FE	On-Demand	Anodyne	PKM	27	42
CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC12CCCCC2	ZINC000872467269	GE	On-Demand	Mild	TRPV4	45	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1	ZINC000872467271	FE	On-Demand	Mild	CASP3	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1	ZINC000872467271	FE	On-Demand	Mild	CASP7	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cnn(C)c1	ZINC000872467272	FE	On-Demand	Mild	CASP3	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cnn(C)c1	ZINC000872467272	FE	On-Demand	Mild	CASP7	41	34
CN(C)CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872467297	FF	On-Demand	Anodyne	PKM	47	39
CNC(=O)[C@@H]1CCC[C@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872467322	FD	On-Demand	Anodyne	LEF	22	40
CNC(=O)[C@@H]1CCC[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872467328	FD	On-Demand	Anodyne	LEF	22	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@@H]2CCOC2)CC1	ZINC000872467398	FD	On-Demand	Anodyne	PKM	50	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@H]2CCOC2)CC1	ZINC000872467399	FD	On-Demand	Anodyne	PKM	50	41
O=S(=O)(N[C@H](CO)C[C@@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872467400	GF	On-Demand	Anodyne	LEF	27	42
O=S(=O)(N[C@H](CO)C[C@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872467401	GF	On-Demand	Anodyne	LEF	27	42
O=S(=O)(N[C@@H](CO)C[C@@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872467402	GF	On-Demand	Anodyne	LEF	27	42
O=S(=O)(N[C@@H](CO)C[C@H](O)c1ccccc1)c1ccc(F)c(C(F)F)c1	ZINC000872467403	GF	On-Demand	Anodyne	LEF	27	42
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)c(C#N)c1	ZINC000872467529	FE	On-Demand	Mild	TRPV4	41	33
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)c(C#N)c1	ZINC000872467532	FE	On-Demand	Mild	TRPV4	41	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(Cc2cccnc2)CC1	ZINC000872467557	FF	On-Demand	Mild	CHRNA7	44	37
NC(=O)CCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872467621	FE	On-Demand	Anodyne	GCK	47	33
Cc1ccc(S(=O)(=O)N2CCN(c3ncccc3F)CC2)c(C#N)c1	ZINC000872467652	FD	On-Demand	Mild	TRPV4	49	41
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872467670	GE	On-Demand	Mild	CCR8	45	36
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872467671	GE	On-Demand	Mild	CCR8	45	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(c2cccnc2)CC1	ZINC000872467686	FH	On-Demand	Anodyne	NAMPT	45	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C3CC3)C2)c(C#N)c1	ZINC000872467700	CE	On-Demand	Mild	EPHX2	15	45
Cc1ccc(S(=O)(=O)N2CC[C@@H](C3CC3)C2)c(C#N)c1	ZINC000872467700	CE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@H](C3CC3)C2)c(C#N)c1	ZINC000872467701	CE	On-Demand	Mild	EPHX2	15	45
Cc1ccc(S(=O)(=O)N2CC[C@H](C3CC3)C2)c(C#N)c1	ZINC000872467701	CE	On-Demand	Mild	TRPV4	42	35
O[C@@H]1CCC[C@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872467784	CF	On-Demand	Anodyne	VCP	58	38
O[C@H]1CCC[C@@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872467786	CF	On-Demand	Anodyne	VCP	58	38
O[C@@H]1CCC[C@@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872467787	CF	On-Demand	Anodyne	VCP	58	38
O[C@H]1CCC[C@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872467789	CF	On-Demand	Anodyne	VCP	58	38
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467821	ED	On-Demand	Mild	CASP3	48	39
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467821	ED	On-Demand	Mild	EPHX2	18	41
COC(=O)C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467821	ED	On-Demand	Mild	CASP7	64	39
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467823	ED	On-Demand	Mild	CASP3	48	39
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467823	ED	On-Demand	Mild	EPHX2	18	41
COC(=O)C[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872467823	ED	On-Demand	Mild	CASP7	64	39
Cc1c(F)ncnc1NCc1ccccc1CN1CCC(O)CC1	ZINC000872467906	EE	On-Demand	Anodyne	SCN5A	53	34
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H]1O	ZINC000872467918	FD	On-Demand	Anodyne	PKM	28	41
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H]1O	ZINC000872467920	FD	On-Demand	Anodyne	PKM	28	41
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H]1O	ZINC000872467922	FD	On-Demand	Anodyne	PKM	28	41
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@@H]1O	ZINC000872467924	FD	On-Demand	Anodyne	PKM	28	41
O=S(=O)(c1cccc(Br)n1)N1CCC(Cc2cccnc2)CC1	ZINC000872467944	GF	On-Demand	Anodyne	CHRNA7	48	39
O=S(=O)(c1cccc(Br)n1)N1CCC(Cc2cccnc2)CC1	ZINC000872467944	GF	On-Demand	Anodyne	ACHP_LYMST	26	41
O=S(=O)(c1cccc(Br)n1)N1CCC(Cc2cccnc2)CC1	ZINC000872467944	GF	On-Demand	Anodyne	NAMPT	30	40
C[C@H]1CN(c2cc(Cl)nnc2O)CCN1C(=O)OC(C)(C)C	ZINC000872467997	EE	On-Demand	Anodyne	GPR119	15	44
CC(=O)OC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872468009	FE	On-Demand	Anodyne	PKM	43	38
CC(=O)OC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872468009	FE	On-Demand	Anodyne	TGM2	51	38
CC(=O)OC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872468009	FE	On-Demand	Anodyne	F13A1	50	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncccc2F)CC1	ZINC000872468017	GF	On-Demand	Anodyne	PKM	50	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncccc2F)CC1	ZINC000872468017	GF	On-Demand	Anodyne	TGM2	19	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncccc2F)CC1	ZINC000872468017	GF	On-Demand	Anodyne	GCK	49	44
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(F)(F)F	ZINC000872468041	FF	On-Demand	Anodyne	LEF	33	43
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(F)(F)F	ZINC000872468042	FF	On-Demand	Anodyne	LEF	33	43
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(F)(F)F	ZINC000872468043	FF	On-Demand	Anodyne	LEF	33	43
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(F)(F)F	ZINC000872468044	FF	On-Demand	Anodyne	LEF	33	43
COc1cccc(O[C@@H](C)CNc2ncnc(F)c2C)c1	ZINC000872468059	CF	On-Demand	Anodyne	MTNR1A	15	50
COc1cccc(O[C@@H](C)CNc2ncnc(F)c2C)c1	ZINC000872468059	CF	On-Demand	Anodyne	MTNR1B	18	50
COc1cccc(O[C@H](C)CNc2ncnc(F)c2C)c1	ZINC000872468060	CF	On-Demand	Anodyne	MTNR1A	15	50
COc1cccc(O[C@H](C)CNc2ncnc(F)c2C)c1	ZINC000872468060	CF	On-Demand	Anodyne	MTNR1B	18	50
CCC1(CO)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872468071	DE	On-Demand	Mild	TRPV4	51	43
NC(=O)N[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872468073	GD	On-Demand	Anodyne	EPHX2	18	52
NC(=O)N[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872468074	GD	On-Demand	Anodyne	EPHX2	18	52
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCc4nccn4C3)cc2N1	ZINC000872468075	GE	On-Demand	Anodyne	PKM	19	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCc4nccn4C3)cc2N1	ZINC000872468076	GE	On-Demand	Anodyne	PKM	19	40
Cc1ccc(S(=O)(=O)N2CC[C@@](C)(O)C2)c(C#N)c1	ZINC000872468096	CD	On-Demand	Mild	TRPV4	53	44
Cc1ccc(S(=O)(=O)N2CC[C@](C)(O)C2)c(C#N)c1	ZINC000872468098	CD	On-Demand	Mild	TRPV4	53	44
C[C@]1(O)CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872468143	FE	On-Demand	Anodyne	PKM	27	42
NS(=O)(=O)CCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872468152	GD	On-Demand	Anodyne	HTR1A	20	41
NS(=O)(=O)CCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872468152	GD	On-Demand	Anodyne	HTR2A	20	41
NS(=O)(=O)CCN1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872468152	GD	On-Demand	Anodyne	ADK	15	41
O=S(=O)(CC1CC2(CCC2)C1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000872468164	GE	On-Demand	Anodyne	SIGMAR1	33	40
O=S(=O)(CC1CC2(CCC2)C1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000872468165	GE	On-Demand	Anodyne	SIGMAR1	33	40
O=S(=O)(CC1CC2(CCC2)C1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000872468166	GE	On-Demand	Anodyne	SIGMAR1	33	40
O=S(=O)(CC1CC2(CCC2)C1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000872468167	GE	On-Demand	Anodyne	SIGMAR1	33	40
Cn1cnnc1[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468175	FE	On-Demand	Anodyne	CASP7	48	34
Cn1cnnc1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468176	FE	On-Demand	Anodyne	CASP7	48	34
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872468196	FE	On-Demand	Anodyne	PKM	33	44
C[C@@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872468199	FE	On-Demand	Anodyne	PKM	33	44
COC(=O)c1ccc2c(c1)CN(S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC2	ZINC000872468200	GD	On-Demand	Anodyne	AKR1C3	56	43
COC(=O)c1ccc2c(c1)CN(S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC2	ZINC000872468201	GD	On-Demand	Anodyne	AKR1C3	56	43
O=S(=O)(N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872468216	GH	On-Demand	Anodyne	LEF	18	48
O=S(=O)(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872468217	GH	On-Demand	Anodyne	LEF	18	48
O=S(=O)(N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872468218	GH	On-Demand	Anodyne	LEF	18	48
O=S(=O)(N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872468219	GH	On-Demand	Anodyne	LEF	18	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@H](CO)C3)cc2N1	ZINC000872468230	FD	On-Demand	Anodyne	PKM	27	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@@H](CO)C3)cc2N1	ZINC000872468231	FD	On-Demand	Anodyne	PKM	27	40
O=S(=O)(NCCCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872468259	EF	On-Demand	Anodyne	TBXAS1	65	57
O=S(=O)(NCCCCn1ccnc1)c1ccc(F)c(C(F)F)c1	ZINC000872468259	EF	On-Demand	Anodyne	HMOX2	48	34
O=S(=O)(NCC1CCN(c2ccncc2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872468284	GG	On-Demand	Anodyne	HTR7	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@H](C)C2)c(C#N)c1	ZINC000872468347	CF	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)c(C#N)c1	ZINC000872468348	CF	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[C@H](C)C2)c(C#N)c1	ZINC000872468349	CF	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)c(C#N)c1	ZINC000872468350	CF	On-Demand	Mild	EPHX2	15	41
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)[C@@H](O)C(F)(F)F	ZINC000872468363	ED	On-Demand	Mild	NR3C2	17	40
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)[C@H](O)C(F)(F)F	ZINC000872468364	ED	On-Demand	Mild	NR3C2	17	40
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)[C@H](O)C(F)(F)F	ZINC000872468365	ED	On-Demand	Mild	NR3C2	17	40
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)[C@@H](O)C(F)(F)F	ZINC000872468366	ED	On-Demand	Mild	NR3C2	17	40
COC(=O)[C@@H](CC(F)F)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468396	FE	On-Demand	Anodyne	TRY2_BOVIN	62	34
COC(=O)[C@@H](CC(F)F)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468396	FE	On-Demand	Anodyne	LEF	42	45
NS(=O)(=O)CCN1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872468446	EC	On-Demand	Anodyne	DRD4	26	43
Cc1c(F)ncnc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000872468447	EF	On-Demand	Bother	DCK	43	40
Cc1c(F)ncnc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000872468447	EF	On-Demand	Bother	GPR119	40	40
COC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468528	EC	On-Demand	Anodyne	MMP13	24	46
COC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468528	EC	On-Demand	Anodyne	MMP12	33	46
COC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468528	EC	On-Demand	Anodyne	LEF	44	46
COC(=O)[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468529	EC	On-Demand	Anodyne	MMP13	24	46
COC(=O)[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468529	EC	On-Demand	Anodyne	MMP12	33	46
COC(=O)[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872468529	EC	On-Demand	Anodyne	LEF	44	46
O=C(NCCCO)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872468542	GD	On-Demand	Anodyne	EPHX2	38	46
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](C2CC2)C1	ZINC000872468627	DG	On-Demand	Anodyne	PKM	46	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](C2CC2)C1	ZINC000872468628	DG	On-Demand	Anodyne	PKM	46	40
C=CC[C@H](CO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872468653	FE	On-Demand	Mild	PKM	37	43
CN(C)CC1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872468659	GF	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCC(F)(F)CC3)cc2N1	ZINC000872468695	GG	On-Demand	Anodyne	PKM	38	45
C[C@]1(O)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872468718	FD	On-Demand	Anodyne	PKM	28	43
CN(CC(C)(C)O)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872468732	FE	On-Demand	Anodyne	PKM	32	41
COc1ccc(OC)c2sc(N3CCN(CCS(N)(=O)=O)CC3)nc12	ZINC000872468760	GC	On-Demand	Anodyne	HTR1A	46	37
COc1ccc(OC)c2sc(N3CCN(CCS(N)(=O)=O)CC3)nc12	ZINC000872468760	GC	On-Demand	Anodyne	ADRA1D	41	39
Cc1ccc(S(=O)(=O)N2C[C@H](C)[C@H](O)C2)c(C#N)c1	ZINC000872468794	CC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](O)C2)c(C#N)c1	ZINC000872468795	CC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[C@@H](O)C2)c(C#N)c1	ZINC000872468796	CC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2C[C@@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872468797	CC	On-Demand	Mild	TRPV4	45	37
C[C@H]1C[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872468826	GF	On-Demand	Anodyne	PKM	30	42
Cn1ncc2c(NCC[C@@H](O)c3ccccc3)nc(Cl)nc21	ZINC000872468831	DF	On-Demand	Anodyne	ABL1	28	40
Cn1ncc2c(NCC[C@H](O)c3ccccc3)nc(Cl)nc21	ZINC000872468832	DF	On-Demand	Anodyne	ABL1	28	40
C[C@]1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCOC1	ZINC000872468841	FE	On-Demand	Anodyne	PKM	37	45
CN(C)CCCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872468920	EF	On-Demand	Anodyne	ADAMTS4	40	33
CC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)C[C@H]1O	ZINC000872468929	CD	On-Demand	Mild	TRPV4	49	42
CC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)C[C@@H]1O	ZINC000872468932	CD	On-Demand	Mild	TRPV4	49	42
CCC1(O)CCC(NS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469001	DE	On-Demand	Mild	CCR8	48	36
CCC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872469015	EE	On-Demand	Anodyne	LEF	43	49
COC1(C)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872469095	GF	On-Demand	Anodyne	PKM	26	43
Cc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cn3)CC2)c(C#N)c1	ZINC000872469096	FD	On-Demand	Mild	TRPV4	44	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(CCCO)CC1	ZINC000872469097	FD	On-Demand	Anodyne	PKM	45	38
CO[C@H]1CCC[C@@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872469118	GF	On-Demand	Anodyne	PKM	33	43
Cc1ccc(S(=O)(=O)N2CCN(CCCO)CC2)c(C#N)c1	ZINC000872469135	DC	On-Demand	Mild	TRPV4	46	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(CO)CCC3)cc2N1	ZINC000872469136	FD	On-Demand	Anodyne	PKM	38	46
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCn3ccnc3)cc2N1	ZINC000872469139	GF	On-Demand	Anodyne	TBXAS1	29	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCn3ccnc3)cc2N1	ZINC000872469139	GF	On-Demand	Anodyne	PKM	30	43
CCC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872469155	DD	On-Demand	Mild	ITGAV	41	35
CCC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872469156	DD	On-Demand	Mild	ITGAV	41	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccc(F)cn2)CC1	ZINC000872469234	GF	On-Demand	Anodyne	PKM	41	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccc(F)cn2)CC1	ZINC000872469234	GF	On-Demand	Anodyne	TGM2	16	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccc(F)cn2)CC1	ZINC000872469234	GF	On-Demand	Anodyne	GCK	44	37
O=C(CO)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469243	FC	On-Demand	Anodyne	PKM	46	39
O=C(CO)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469243	FC	On-Demand	Anodyne	TGM2	54	36
O=C(CO)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469243	FC	On-Demand	Anodyne	F13A1	57	36
O=C(CO)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469243	FC	On-Demand	Anodyne	AKR1C3	22	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(CO)CC3)cc2N1	ZINC000872469244	ED	On-Demand	Anodyne	PKM	39	47
Cc1cccc(C#N)c1S(=O)(=O)NCCCCn1ccnc1	ZINC000872469277	DD	On-Demand	Mild	TBXAS1	43	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2COCC[C@@H]21	ZINC000872469303	EF	On-Demand	Anodyne	CASP7	40	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2COCC[C@H]21	ZINC000872469304	EF	On-Demand	Anodyne	CASP7	40	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2COCC[C@H]21	ZINC000872469305	EF	On-Demand	Anodyne	CASP7	40	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2COCC[C@@H]21	ZINC000872469306	EF	On-Demand	Anodyne	CASP7	40	36
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCCn1ccnc1	ZINC000872469313	GG	On-Demand	Anodyne	TBXAS1	46	57
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCCn1ccnc1	ZINC000872469313	GG	On-Demand	Anodyne	HMOX2	45	33
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCCCn1ccnc1	ZINC000872469313	GG	On-Demand	Anodyne	QPCT	33	49
Cc1ccc(S(=O)(=O)N2CC[C@@H](CO)C2)c(C#N)c1	ZINC000872469373	CC	On-Demand	Mild	EPHX2	19	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](CO)C2)c(C#N)c1	ZINC000872469373	CC	On-Demand	Mild	TRPV4	45	37
Cc1ccc(S(=O)(=O)N2CC[C@H](CO)C2)c(C#N)c1	ZINC000872469374	CC	On-Demand	Mild	EPHX2	19	42
Cc1ccc(S(=O)(=O)N2CC[C@H](CO)C2)c(C#N)c1	ZINC000872469374	CC	On-Demand	Mild	TRPV4	45	37
COC1(C)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469375	EF	On-Demand	Anodyne	PKM	42	39
CC[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469391	FD	On-Demand	Anodyne	PKM	44	38
CC[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469391	FD	On-Demand	Anodyne	NOD2	17	40
CC[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469392	FD	On-Demand	Anodyne	PKM	44	38
CC[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469392	FD	On-Demand	Anodyne	NOD2	17	40
COC1(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469416	DE	On-Demand	Mild	TRPV4	50	43
NC(=O)CCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469424	DD	On-Demand	Anodyne	TBXA2R	45	37
NC(=O)CCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469424	DD	On-Demand	Anodyne	LEF	30	43
C[C@H](O)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872469456	ED	On-Demand	Anodyne	PKM	33	41
C[C@@H](O)CC(C)(C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872469462	GF	On-Demand	Anodyne	PKM	38	44
O=S(=O)(CC1CC2(CCC2)C1)NCCCCn1ccnc1	ZINC000872469470	DE	On-Demand	Anodyne	TBXAS1	27	40
CCOCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872469564	FE	On-Demand	Anodyne	PKM	26	40
O=S(=O)(NCCCCn1ccnc1)c1cccc(Br)n1	ZINC000872469565	FD	On-Demand	Anodyne	TBXAS1	56	46
O=S(=O)(NCCCCn1ccnc1)c1cccc(Br)n1	ZINC000872469565	FD	On-Demand	Anodyne	HMOX2	51	43
O=S(=O)(NCCCCn1ccnc1)c1cccc(Br)n1	ZINC000872469565	FD	On-Demand	Anodyne	QPCT	35	41
CC[C@H](O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469612	EC	On-Demand	Mild	TRPV4	46	39
CC[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469613	EC	On-Demand	Mild	TRPV4	46	39
O=C(NCCO)C1CCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872469614	GC	On-Demand	Anodyne	EPHX2	40	44
O=C(NCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccn1	ZINC000872469626	GE	On-Demand	Anodyne	HTR4	41	35
O=C(NCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccn1	ZINC000872469626	GE	On-Demand	Anodyne	GRM4	43	43
O=C(NCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccn1	ZINC000872469626	GE	On-Demand	Anodyne	SLC6A9	31	40
O=C(NCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1)c1ccccn1	ZINC000872469626	GE	On-Demand	Anodyne	CACNA1I	41	33
O=C(NCCO)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872469643	GD	On-Demand	Anodyne	EPHX2	41	47
CCN(CC)C(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469711	GF	On-Demand	Mild	EPHX2	22	42
CCN(CC)C(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872469711	GF	On-Demand	Mild	TRPV4	44	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(CO)CCC3)cc2N1	ZINC000872469717	FE	On-Demand	Anodyne	PKM	38	44
Cc1ccc(CNC(=O)C2CCN(c3nc(N)nc(C(F)F)n3)CC2)cc1	ZINC000872469735	GE	On-Demand	Anodyne	EPHX2	18	53
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCO1	ZINC000872469738	CE	On-Demand	Anodyne	PKM	41	38
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	CA2	19	48
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	TBXA2R	56	44
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	CA1	19	47
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	CA12	16	43
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	CA9	16	47
O=S(=O)(NCCc1ccc(CO)cc1)c1ccc(F)c(C(F)F)c1	ZINC000872469790	FF	On-Demand	Anodyne	A6YCJ1_9METZ	22	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC=CCC3)cc2N1	ZINC000872469810	EF	On-Demand	Anodyne	PKM	21	42
c1ccc(-c2cc(N3CCC(OCCN4CCCC4)CC3)ncn2)cc1	ZINC000872469820	FG	On-Demand	Anodyne	SLC6A1	44	34
c1ccc(-c2cc(N3CCC(OCCN4CCCC4)CC3)ncn2)cc1	ZINC000872469820	FG	On-Demand	Anodyne	LTA4H	37	45
c1ccc(-c2cc(N3CCC(OCCN4CCCC4)CC3)ncn2)cc1	ZINC000872469820	FG	On-Demand	Anodyne	HRH3	22	41
c1ccc(-c2cc(N3CCC(OCCN4CCCC4)CC3)ncn2)cc1	ZINC000872469820	FG	On-Demand	Anodyne	SIGMAR1	17	43
COC(=O)[C@H]1C[C@H](OC)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469838	GE	On-Demand	Anodyne	MMP1	33	43
COC(=O)[C@@H]1C[C@H](OC)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469841	GE	On-Demand	Anodyne	MMP1	33	43
COC(=O)[C@H]1C[C@@H](OC)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469842	GE	On-Demand	Anodyne	MMP1	33	43
COC(=O)[C@@H]1C[C@@H](OC)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872469844	GE	On-Demand	Anodyne	MMP1	33	43
COCC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872469846	EC	On-Demand	Anodyne	LEF	41	49
COCC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872469848	EC	On-Demand	Anodyne	LEF	41	49
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872469894	ED	On-Demand	Mild	FKBP1A	37	41
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872469894	ED	On-Demand	Mild	MMP7	16	42
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872469894	ED	On-Demand	Mild	MMP1	15	42
COC[C@H](Cc1ccccc1)Nc1nc(N)nc(C(F)F)n1	ZINC000872469970	DE	On-Demand	Anodyne	TPH1	45	36
COC[C@@H](Cc1ccccc1)Nc1nc(N)nc(C(F)F)n1	ZINC000872469971	DE	On-Demand	Anodyne	TPH1	45	36
Cc1ccc(CNC(=O)C2CCN(c3ccnc4ncccc34)CC2)cc1	ZINC000872470018	FG	On-Demand	Anodyne	EPHX2	25	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCO3)cc2N1	ZINC000872470039	ED	On-Demand	Anodyne	PKM	28	42
c1ccc(-c2cc(N3CCC(OCC4CC4)CC3)ncn2)cc1	ZINC000872470049	DH	On-Demand	Anodyne	DCK	37	41
CC(C)(C)NC(=O)N1CCC(NS(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872470050	FE	On-Demand	Anodyne	WNT3	45	35
C[C@@H]1CCOCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872470096	FE	On-Demand	Anodyne	PKM	17	40
C[C@H]1CCOCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872470097	FE	On-Demand	Anodyne	PKM	17	40
NC(=O)c1cc(N2CCC(OCC3CC3)CC2)nc(Cl)n1	ZINC000872470122	DD	On-Demand	Anodyne	SCD1	19	44
CC(C)(C)OC(=O)CCCNc1ccnc2ncccc12	ZINC000872470125	CG	On-Demand	Anodyne	HNMT	45	36
CC#CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872470159	EE	On-Demand	Mild	PKM	39	49
O=C(CNS(=O)(=O)c1ccc(F)c(C(F)F)c1)NCC1CC1	ZINC000872470186	ED	On-Demand	Anodyne	LEF	29	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@H]3CCCCO3)cc2N1	ZINC000872470228	GF	On-Demand	Anodyne	PKM	33	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@@H]3CCCCO3)cc2N1	ZINC000872470229	GF	On-Demand	Anodyne	PKM	33	45
NC(=O)c1cc(NCC2CCC(C(F)(F)F)CC2)nc(Cl)n1	ZINC000872470242	EG	On-Demand	Anodyne	VCP	48	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@@H]2CCOC2)CC1	ZINC000872470246	FG	On-Demand	Anodyne	PKM	48	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@H]2CCOC2)CC1	ZINC000872470249	FG	On-Demand	Anodyne	PKM	48	41
Cc1ccc(S(=O)(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c(C#N)c1	ZINC000872470251	FD	On-Demand	Mild	TRPV4	41	34
CO[C@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872470261	GF	On-Demand	Anodyne	PKM	21	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2c(O)ncnc2C1	ZINC000872470269	FE	On-Demand	Anodyne	AKR1C3	58	39
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	F2	17	46
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	IL2RA	51	31
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	GRIN2B	91	44
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	CCR3	43	41
O=C(CNc1cc(Cl)nnc1O)N1CCC(Cc2ccccc2)CC1	ZINC000872470335	FF	On-Demand	Anodyne	SCD	20	42
Cc1nn(C)cc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872470336	GE	On-Demand	Anodyne	PKM	36	45
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1nccs1	ZINC000872470431	GG	On-Demand	Anodyne	PKM	38	46
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1nccs1	ZINC000872470433	GG	On-Demand	Anodyne	PKM	38	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1nc(N)nc(C(F)F)n1	ZINC000872470466	EE	On-Demand	Anodyne	DRD4	24	40
CC(C)[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872470485	EF	On-Demand	Anodyne	PKM	41	35
NC(=O)N1CCC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872470505	CE	On-Demand	Anodyne	P2RY12	78	33
NC(=O)N1CCC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872470505	CE	On-Demand	Anodyne	PRKD1	47	40
NC(=O)N1CCC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872470508	CE	On-Demand	Anodyne	P2RY12	78	33
NC(=O)N1CCC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872470508	CE	On-Demand	Anodyne	PRKD1	47	40
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	FKBP1A	49	42
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	MMP13	30	50
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	MMP3	37	50
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	MMP7	40	50
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872470610	GD	On-Demand	Anodyne	MMP1	38	50
CNC(=O)CC1CCN(c2ncnc(F)c2C)CC1	ZINC000872470630	CD	On-Demand	Anodyne	SIRT3	67	41
CNC(=O)CC1CCN(c2ncnc(F)c2C)CC1	ZINC000872470630	CD	On-Demand	Anodyne	SIRT2	56	36
CNC(=O)CC1CCN(c2ncnc(F)c2C)CC1	ZINC000872470630	CD	On-Demand	Anodyne	SIRT1	54	35
CO[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872470639	DE	On-Demand	Mild	EPHX2	17	42
CO[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872470639	DE	On-Demand	Mild	TRPV4	43	35
O=S(=O)(c1cccc(Br)n1)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872470662	GD	On-Demand	Anodyne	SLC18A3	44	39
O=S(=O)(c1cccc(Br)n1)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872470664	GD	On-Demand	Anodyne	SLC18A3	44	39
O=S(=O)(c1cccc(Br)n1)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872470666	GD	On-Demand	Anodyne	SLC18A3	44	39
O=S(=O)(c1cccc(Br)n1)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872470668	GD	On-Demand	Anodyne	SLC18A3	44	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@@H]3CCOC3)cc2N1	ZINC000872470686	FE	On-Demand	Anodyne	PKM	30	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@H]3CCOC3)cc2N1	ZINC000872470687	FE	On-Demand	Anodyne	PKM	30	43
C[C@@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470724	EF	On-Demand	Anodyne	DRD2	30	43
C[C@@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470724	EF	On-Demand	Anodyne	DRD4	82	44
C[C@@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470724	EF	On-Demand	Anodyne	ACHE	46	48
C[C@@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470724	EF	On-Demand	Anodyne	DRD3	21	43
C[C@@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470724	EF	On-Demand	Anodyne	SIGMAR1	69	43
C[C@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470725	EF	On-Demand	Anodyne	DRD2	30	43
C[C@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470725	EF	On-Demand	Anodyne	DRD4	82	44
C[C@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470725	EF	On-Demand	Anodyne	ACHE	46	48
C[C@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470725	EF	On-Demand	Anodyne	DRD3	21	43
C[C@H]1CCN(Cc2ccccc2)CCN1c1cc(Cl)nnc1O	ZINC000872470725	EF	On-Demand	Anodyne	SIGMAR1	69	43
O=S(=O)(NCC1(c2ccccn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872470740	FG	On-Demand	Anodyne	SLC6A9	18	40
CC1(CO)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872470770	EF	On-Demand	Anodyne	PKM	41	39
COc1ccc(C(=O)N2CCN(c3ncnc(F)c3C)CC2)c(OC)c1OC	ZINC000872470776	GD	On-Demand	Anodyne	PDGFRB	66	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncc(F)cn2)CC1	ZINC000872470831	GE	On-Demand	Anodyne	PKM	48	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ncc(F)cn2)CC1	ZINC000872470831	GE	On-Demand	Anodyne	GCK	54	39
N#Cc1cccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872470848	GF	On-Demand	Mild	PKM	47	42
N#Cc1cccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872470848	GF	On-Demand	Mild	GCK	42	36
CN1CC=C(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872470866	GE	On-Demand	Anodyne	PKM	35	45
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872470875	FE	On-Demand	Anodyne	DRD4	40	41
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872470875	FE	On-Demand	Anodyne	ACHE	47	43
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872470875	FE	On-Demand	Anodyne	SIGMAR1	36	42
O=S(=O)(NCCCCCCO)c1ccc(F)c(C(F)F)c1	ZINC000872470894	EF	On-Demand	Anodyne	LEF	27	42
Cc1nc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n[nH]1	ZINC000872470912	GD	On-Demand	Anodyne	ADORA2B	53	35
Cc1nc(CN2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n[nH]1	ZINC000872470912	GD	On-Demand	Anodyne	PKM	34	40
CN(C)CCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872470913	FG	On-Demand	Anodyne	PKM	42	38
CN(C)CCC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872470913	FG	On-Demand	Anodyne	ADAMTS4	62	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC=C(F)C1	ZINC000872470914	DG	On-Demand	Anodyne	PKM	40	37
O=S(=O)(CC1CC2(CCC2)C1)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872470960	ED	On-Demand	Anodyne	SLC18A3	27	41
O=S(=O)(CC1CC2(CCC2)C1)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872470963	ED	On-Demand	Anodyne	SLC18A3	27	41
O=S(=O)(CC1CC2(CCC2)C1)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872470966	ED	On-Demand	Anodyne	SLC18A3	27	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[C@@H](F)C2)c(C#N)c1	ZINC000872470967	CE	On-Demand	Mild	TRPV4	41	33
O=S(=O)(CC1CC2(CCC2)C1)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872470968	ED	On-Demand	Anodyne	SLC18A3	27	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@H](F)C2)c(C#N)c1	ZINC000872470969	CE	On-Demand	Mild	TRPV4	41	33
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[C@H](F)C2)c(C#N)c1	ZINC000872470970	CE	On-Demand	Mild	TRPV4	41	33
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@@H](F)C2)c(C#N)c1	ZINC000872470972	CE	On-Demand	Mild	TRPV4	41	33
CCOC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H]1CCCOC1	ZINC000872471000	GE	On-Demand	Anodyne	LEF	35	55
CCOC(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H]1CCCOC1	ZINC000872471003	GE	On-Demand	Anodyne	LEF	35	55
Cc1ccc(S(=O)(=O)N2CCOCC3(CC3)C2)c(C#N)c1	ZINC000872471053	DD	On-Demand	Mild	TRPV4	45	37
Cc1ccc(CNC(=O)C2CCN(c3cc(Cl)nnc3O)CC2)cc1	ZINC000872471060	FF	On-Demand	Anodyne	EPHX2	27	48
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	AKT2	15	40
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	EPHX2	22	45
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	SIRT3	55	33
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	SIRT2	49	31
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	SIRT1	48	30
Cc1ccc(CNC(=O)C2CCN(c3ncnc(F)c3C)CC2)cc1	ZINC000872471070	EF	On-Demand	Anodyne	LIMK2	21	44
Cc1ccc(S(=O)(=O)N2CCN(C(C)C)C(=O)C2)c(C#N)c1	ZINC000872471077	DD	On-Demand	Mild	TRPV4	42	34
c1ccc(-c2cc(N3CCN(C4CCOCC4)CC3)ncn2)cc1	ZINC000872471152	DE	On-Demand	Anodyne	EBP	27	42
C[C@]1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO[C@@H]1C1CC1	ZINC000872471187	GF	On-Demand	Anodyne	PKM	28	42
C[C@]1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO[C@H]1C1CC1	ZINC000872471189	GF	On-Demand	Anodyne	PKM	28	42
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Cl)nnc1O	ZINC000872471269	EF	On-Demand	Anodyne	DRD4	38	42
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Cl)nnc1O	ZINC000872471269	EF	On-Demand	Anodyne	ACHE	45	42
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Cl)nnc1O	ZINC000872471269	EF	On-Demand	Anodyne	SIGMAR1	39	41
O=C(CNS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1)N1CCOCC1	ZINC000872471279	GD	On-Demand	Anodyne	EPHX2	23	53
O=C1NC(=O)N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C[C@@H]12	ZINC000872471281	FC	On-Demand	Anodyne	PKM	40	38
O=C1NC(=O)N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C[C@@H]12	ZINC000872471281	FC	On-Demand	Anodyne	GCKR	50	32
O=C1NC(=O)N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C[C@H]12	ZINC000872471282	FC	On-Demand	Anodyne	PKM	40	38
O=C1NC(=O)N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C[C@H]12	ZINC000872471282	FC	On-Demand	Anodyne	GCKR	50	32
Cc1ccc(S(=O)(=O)N2CC[C@H]([C@@H](C)O)C2)c(C#N)c1	ZINC000872471337	CD	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H]([C@H](C)O)C2)c(C#N)c1	ZINC000872471338	CD	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H]([C@H](C)O)C2)c(C#N)c1	ZINC000872471339	CD	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H]([C@@H](C)O)C2)c(C#N)c1	ZINC000872471340	CD	On-Demand	Mild	EPHX2	15	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872471380	GD	On-Demand	Anodyne	PKM	45	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872471383	GD	On-Demand	Anodyne	PKM	45	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872471384	GD	On-Demand	Anodyne	PKM	45	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872471387	GD	On-Demand	Anodyne	PKM	45	38
CO[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872471392	EF	On-Demand	Anodyne	PKM	40	39
CO[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872471392	EF	On-Demand	Anodyne	CASP7	50	37
C[C@@]1(C#N)CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872471412	GF	On-Demand	Mild	PKM	17	40
c1cnc2nccc(N3CCC(OCCN4CCCC4)CC3)c2c1	ZINC000872471421	EF	On-Demand	Anodyne	HNMT	47	34
N#CCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872471422	EE	On-Demand	Mild	PKM	38	47
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471432	ED	On-Demand	Mild	SLC18A3	30	44
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471432	ED	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471432	ED	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471433	ED	On-Demand	Mild	SLC18A3	30	44
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471433	ED	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c(C#N)c1	ZINC000872471433	ED	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471434	ED	On-Demand	Mild	SLC18A3	30	44
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471434	ED	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471434	ED	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471435	ED	On-Demand	Mild	SLC18A3	30	44
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471435	ED	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C#N)c1	ZINC000872471435	ED	On-Demand	Mild	TRPV4	43	35
Cc1c(F)ncnc1N1CCC[C@H](CC(N)=O)C1	ZINC000872471530	CD	On-Demand	Anodyne	SIRT3	54	34
Cc1c(F)ncnc1N1CCC[C@@H](CC(N)=O)C1	ZINC000872471531	CD	On-Demand	Anodyne	SIRT3	54	34
NC(=O)C[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872471532	CE	On-Demand	Anodyne	PIM1	19	40
NC(=O)C[C@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872471532	CE	On-Demand	Anodyne	PIM3	15	47
NC(=O)C[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872471533	CE	On-Demand	Anodyne	PIM1	19	40
NC(=O)C[C@@H]1CCCN(c2ccncc2C2CC2)C1	ZINC000872471533	CE	On-Demand	Anodyne	PIM3	15	47
C#CCOCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872471545	FD	On-Demand	Mild	PKM	34	44
Cc1ccc(S(=O)(=O)N2CCOCC3(CCC3)C2)c(C#N)c1	ZINC000872471548	DE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CCN(c3ccnc(C)n3)CC2)c(C#N)c1	ZINC000872471582	FD	On-Demand	Mild	TRPV4	43	36
CN(C)CCC1CCN(S(=O)(=O)CC2CC3(CCC3)C2)CC1	ZINC000872471661	EF	On-Demand	Anodyne	ADAMTS4	44	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC=C(F)C3)cc2N1	ZINC000872471692	FF	On-Demand	Anodyne	PKM	24	41
Cc1ccc(S(=O)(=O)N2CCOCC3(CCOCC3)C2)c(C#N)c1	ZINC000872471697	FD	On-Demand	Mild	TRPV4	44	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCOCC3)cc2N1	ZINC000872471701	FE	On-Demand	Anodyne	PKM	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCOCC3)cc2N1	ZINC000872471703	FE	On-Demand	Anodyne	PKM	32	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C1CCOCC1	ZINC000872471731	FG	On-Demand	Anodyne	CASP3	44	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1C1CCOCC1	ZINC000872471731	FG	On-Demand	Anodyne	CASP7	59	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C1CCOCC1	ZINC000872471732	FG	On-Demand	Anodyne	CASP3	44	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1C1CCOCC1	ZINC000872471732	FG	On-Demand	Anodyne	CASP7	59	38
CN(C)C(=O)CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872471754	GF	On-Demand	Anodyne	PKM	41	37
CN(C)C(=O)CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872471754	GF	On-Demand	Anodyne	ADAMTS4	50	33
Cc1noc(C2(C)CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)n1	ZINC000872471757	GG	On-Demand	Anodyne	PKM	44	36
Cc1ccc(CNC(=O)C2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872471769	EH	On-Demand	Anodyne	EPHX2	17	46
Cc1ccc(CNC(=O)C2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872471769	EH	On-Demand	Anodyne	TBK1	44	33
Cc1ccc(CNC(=O)C2CCN(c3ccncc3C3CC3)CC2)cc1	ZINC000872471769	EH	On-Demand	Anodyne	NAMPT	71	38
NC(=O)c1cc(N2CCC(OCCN3CCCC3)CC2)nc(Cl)n1	ZINC000872471789	FD	On-Demand	Anodyne	SCD1	18	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(CCCO)CC1	ZINC000872471797	FF	On-Demand	Anodyne	GCK	40	34
N#CC1=CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872471812	FE	On-Demand	Reactive	TRPV4	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000872471815	ED	On-Demand	Mild	SLC18A3	35	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000872471819	ED	On-Demand	Mild	SLC18A3	35	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000872471822	ED	On-Demand	Mild	SLC18A3	35	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000872471824	ED	On-Demand	Mild	SLC18A3	35	43
C=CCOCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872471877	FE	On-Demand	Mild	PKM	36	46
CNC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872471881	EG	On-Demand	Anodyne	GRM5	17	40
CNC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872471881	EG	On-Demand	Anodyne	SIRT3	43	31
CNC(=O)CC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872471881	EG	On-Demand	Anodyne	SIRT2	43	31
O=C1NC2(CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)CO1	ZINC000872471896	FE	On-Demand	Anodyne	PKM	46	39
Cn1ncc2c(NC3CCN(C4CCCCC4)CC3)nc(Cl)nc21	ZINC000872471962	EG	On-Demand	Anodyne	CCR4	18	44
Cn1ncc2c(NC3CCN(C4CCCCC4)CC3)nc(Cl)nc21	ZINC000872471962	EG	On-Demand	Anodyne	EHMT2	42	38
CN(CC1(O)CCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872471989	FE	On-Demand	Anodyne	PKM	27	40
COc1cc(CN2CCN(c3ncnc(F)c3C)CC2)cc(OC)c1	ZINC000872472004	EE	On-Demand	Anodyne	ABCC1	47	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOc2ncccc2C1	ZINC000872472008	FF	On-Demand	Anodyne	PKM	41	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOc2ncccc2C1	ZINC000872472008	FF	On-Demand	Anodyne	AKR1C3	48	35
C=CC[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472019	FD	On-Demand	Mild	PKM	35	43
Cc1c(F)ncnc1N1CCC(OCC2CC2)CC1	ZINC000872472039	CE	On-Demand	Anodyne	PDE3B	41	32
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c(C#N)c1	ZINC000872472051	EE	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c(C#N)c1	ZINC000872472051	EE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@H](C(C)(C)C)[C@@H](O)C2)c(C#N)c1	ZINC000872472052	EE	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@H](C(C)(C)C)[C@@H](O)C2)c(C#N)c1	ZINC000872472052	EE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(C)(C)C)[C@H](O)C2)c(C#N)c1	ZINC000872472053	EE	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(C)(C)C)[C@H](O)C2)c(C#N)c1	ZINC000872472053	EE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@H](C(C)(C)C)[C@H](O)C2)c(C#N)c1	ZINC000872472054	EE	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@H](C(C)(C)C)[C@H](O)C2)c(C#N)c1	ZINC000872472054	EE	On-Demand	Mild	TRPV4	42	35
CCCN(CC)c1cc(C)nc2c1cnn2C	ZINC000872472056	BF	On-Demand	Anodyne	CRHR1	49	43
CN(C1CC(O)C1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472063	FD	On-Demand	Anodyne	PKM	30	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CC(=O)c1ccco1	ZINC000872472076	FF	On-Demand	Mild	CASP7	42	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccco1	ZINC000872472077	FF	On-Demand	Mild	CASP7	42	32
COc1ccc(OC)c2sc(N[C@@H]3CCCN(C(N)=O)C3)nc12	ZINC000872472142	EE	On-Demand	Anodyne	ADORA2B	17	42
COc1ccc(OC)c2sc(N[C@H]3CCCN(C(N)=O)C3)nc12	ZINC000872472143	EE	On-Demand	Anodyne	ADORA2B	17	42
C=C(C)CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472144	EF	On-Demand	Mild	PKM	30	40
C[C@@H]1OCC[C@]1(C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472159	FE	On-Demand	Anodyne	PKM	38	47
O=C(NC[C@H]1CCCCN1c1cc(Cl)nnc1O)c1ccccc1	ZINC000872472198	EF	On-Demand	Anodyne	CACNA1I	49	34
CNC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872472223	CD	On-Demand	Anodyne	SIRT3	48	30
CNC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872472223	CD	On-Demand	Anodyne	SIRT2	43	30
CNC(=O)CC1CCN(c2ccnc3ncccc23)CC1	ZINC000872472223	CD	On-Demand	Anodyne	SIRT1	48	30
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC(CO)C3)cc2N1	ZINC000872472238	ED	On-Demand	Anodyne	PKM	29	42
Cc1c(F)ncnc1NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872472243	EF	On-Demand	Anodyne	GRIN2B	90	43
Cc1c(F)ncnc1NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872472243	EF	On-Demand	Anodyne	CCR3	54	45
Cc1c(F)ncnc1NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000872472243	EF	On-Demand	Anodyne	SCD	21	41
CNC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872472285	DE	On-Demand	Anodyne	P2RY12	71	42
CNC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872472285	DE	On-Demand	Anodyne	SIRT3	47	31
CNC(=O)CC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872472285	DE	On-Demand	Anodyne	SIRT2	43	30
Nc1nc(C(F)F)nc(N2CCC(OCCN3CCCC3)CC2)n1	ZINC000872472288	ED	On-Demand	Anodyne	EHMT2	41	30
CC[C@@H](CC(F)(F)F)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872472345	DF	On-Demand	Mild	NR3C2	18	45
O=S(=O)(NCCC[C@H]1CCCCO1)c1ccc(F)c(C(F)F)c1	ZINC000872472358	FG	On-Demand	Anodyne	HTR7	26	40
O=S(=O)(NCCC[C@@H]1CCCCO1)c1ccc(F)c(C(F)F)c1	ZINC000872472359	FG	On-Demand	Anodyne	HTR7	26	40
Cc1nnc([C@@H](C)NS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872472416	FF	On-Demand	Anodyne	LEF	33	40
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1S(C)(=O)=O	ZINC000872472445	GD	On-Demand	Anodyne	GCKR	65	33
CNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472448	EC	On-Demand	Anodyne	MMP13	21	46
CNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472448	EC	On-Demand	Anodyne	MMP12	47	46
CNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472448	EC	On-Demand	Anodyne	LEF	48	49
Cc1cccc(C#N)c1S(=O)(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000872472453	FD	On-Demand	Mild	ADK	40	40
NC(=O)N1CCC[C@@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872472468	EF	On-Demand	Anodyne	PRKD1	44	39
NC(=O)N1CCC[C@@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872472468	EF	On-Demand	Anodyne	GRM5	19	41
NC(=O)N1CCC[C@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872472469	EF	On-Demand	Anodyne	PRKD1	44	39
NC(=O)N1CCC[C@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872472469	EF	On-Demand	Anodyne	GRM5	19	41
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472470	ED	On-Demand	Anodyne	MMP13	17	40
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472470	ED	On-Demand	Anodyne	MMP12	24	40
COC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472470	ED	On-Demand	Anodyne	LEF	45	49
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472471	ED	On-Demand	Anodyne	MMP13	17	40
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472471	ED	On-Demand	Anodyne	MMP12	24	40
COC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872472471	ED	On-Demand	Anodyne	LEF	45	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(F)(F)C3)cc2N1	ZINC000872472489	FF	On-Demand	Anodyne	PKM	36	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCCCO)cc2N1	ZINC000872472496	FE	On-Demand	Anodyne	PKM	39	47
CN1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872472532	FD	On-Demand	Anodyne	PKM	32	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC=CCC1	ZINC000872472541	CF	On-Demand	Anodyne	PKM	40	37
O=C1CCCC[C@@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472546	GH	On-Demand	Anodyne	CASP3	47	37
O=C1CCCC[C@@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472546	GH	On-Demand	Anodyne	CASP7	66	37
O=C1CCCC[C@@H]1[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472547	GH	On-Demand	Anodyne	CASP3	47	37
O=C1CCCC[C@@H]1[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472547	GH	On-Demand	Anodyne	CASP7	66	37
CC(C)(C#N)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472550	FE	On-Demand	Mild	PKM	38	47
Cc1ccc(CNC(=O)C2CCN(c3nc(Cl)nc4c3cnn4C)CC2)cc1	ZINC000872472566	GF	On-Demand	Anodyne	MTOR	44	34
Cc1ccc(CNC(=O)C2CCN(c3nc(Cl)nc4c3cnn4C)CC2)cc1	ZINC000872472566	GF	On-Demand	Anodyne	EPHX2	19	42
Cc1ccc(CNC(=O)C2CCN(c3cc(C)nc4c3cnn4C)CC2)cc1	ZINC000872472573	GG	On-Demand	Anodyne	EPHX2	17	43
Nc1nc(NCC(=O)N2CCC(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872472596	GE	On-Demand	Anodyne	GRIN2B	92	43
Nc1nc(NCC(=O)N2CCC(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872472596	GE	On-Demand	Anodyne	VCP	40	32
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCc3ccco3)cc2N1	ZINC000872472624	FF	On-Demand	Anodyne	PKM	38	46
CN(c1nc(N)nc(C(F)F)n1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000872472647	EE	On-Demand	Anodyne	SIGMAR1	15	42
CN(c1nc(N)nc(C(F)F)n1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000872472649	EE	On-Demand	Anodyne	SIGMAR1	15	42
CC[C@@H](CC#N)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472722	FF	On-Demand	Mild	PKM	37	44
Cc1c(F)ncnc1N1CCN(CCOC(C)C)CC1	ZINC000872472734	CD	On-Demand	Anodyne	ABCC1	49	36
COC[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)OC	ZINC000872472778	GD	On-Demand	Anodyne	PKM	39	47
Cc1c(F)ncnc1NC1CCN(CCOC(C)C)CC1	ZINC000872472798	CE	On-Demand	Anodyne	EHMT2	61	32
CCN(CC(F)F)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872472825	FF	On-Demand	Anodyne	PKM	34	40
CN1CCC[C@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1=O	ZINC000872472850	DF	On-Demand	Anodyne	GRM5	15	41
O=C(NC1CC1)N[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872472872	GD	On-Demand	Anodyne	EPHX2	32	40
O=C(NC1CC1)N[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872472872	GD	On-Demand	Anodyne	TGM2	34	41
O=C(NC1CC1)N[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872472877	GD	On-Demand	Anodyne	EPHX2	32	40
O=C(NC1CC1)N[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872472877	GD	On-Demand	Anodyne	TGM2	34	41
O=C1CCCC[C@H]1[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472883	GH	On-Demand	Anodyne	CASP3	47	37
O=C1CCCC[C@H]1[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472883	GH	On-Demand	Anodyne	CASP7	66	37
O=C1CCCC[C@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472885	GH	On-Demand	Anodyne	CASP3	47	37
O=C1CCCC[C@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872472885	GH	On-Demand	Anodyne	CASP7	66	37
C[C@H]1CN(S(=O)(=O)c2cccc(Br)n2)CCN1S(C)(=O)=O	ZINC000872472891	GC	On-Demand	Anodyne	HSD11B1	16	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000872472913	EG	On-Demand	Anodyne	CASP3	50	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000872472913	EG	On-Demand	Anodyne	CASP7	59	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ncc[nH]1	ZINC000872472915	EG	On-Demand	Anodyne	CASP3	50	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1c1ncc[nH]1	ZINC000872472915	EG	On-Demand	Anodyne	CASP7	59	34
Cc1ccc(S(=O)(=O)N2CCN(c3ncc(F)cn3)CC2)c(C#N)c1	ZINC000872472930	FD	On-Demand	Mild	TRPV4	45	39
CCOCCOC1CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872472990	DD	On-Demand	Mild	TRPV4	43	36
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872473047	ED	On-Demand	Mild	FKBP1A	30	43
COC(=O)[C@@H]1CCCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872473047	ED	On-Demand	Mild	EPHX2	24	42
C[C@H]1c2ccccc2CCN1c1cc(Cl)nnc1O	ZINC000872473073	CF	On-Demand	Anodyne	DRD5	42	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN2CCOC[C@@H]2C1	ZINC000872473199	FD	On-Demand	Anodyne	PKM	43	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN2CCOC[C@H]2C1	ZINC000872473202	FD	On-Demand	Anodyne	PKM	43	37
CCC(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872473203	CE	On-Demand	Anodyne	LEF	34	41
O=S(=O)(N[C@@H](CCO)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872473205	FE	On-Demand	Anodyne	LEF	37	53
O=S(=O)(N[C@H](CCO)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872473207	FE	On-Demand	Anodyne	LEF	37	53
Cc1c(F)ncnc1NC1CCN(C2CCCCC2)CC1	ZINC000872473251	CG	On-Demand	Anodyne	CCR4	15	42
NC(=O)c1cc(NC2CCN(C3CCCCC3)CC2)nc(Cl)n1	ZINC000872473264	EE	On-Demand	Anodyne	HRH3	16	40
NC(=O)c1cc(NC2CCN(C3CCCCC3)CC2)nc(Cl)n1	ZINC000872473264	EE	On-Demand	Anodyne	PRKD1	42	39
CC[C@@H](CC(F)(F)F)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872473279	EH	On-Demand	Anodyne	LEF	32	42
CC[C@@H](CC#N)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872473383	DF	On-Demand	Mild	LEF	31	41
O=S(=O)(CC1CC2(CCC2)C1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473396	EF	On-Demand	Anodyne	OPRL1	18	40
CNC(=O)[C@@H](C)CN(C)c1nc2c(OC)ccc(OC)c2s1	ZINC000872473462	DE	On-Demand	Anodyne	ADORA2B	15	41
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000872473490	FF	On-Demand	Mild	OPRL1	16	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000872473490	FF	On-Demand	Mild	CCR1	36	49
CC[C@@H](CC#N)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872473535	CD	On-Demand	Mild	NR3C2	17	47
CC(C)(C)C(=O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872473536	FF	On-Demand	Anodyne	PKM	39	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCO[C@H](C4CC4)C3)cc2N1	ZINC000872473549	GF	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCO[C@H](C4CC4)C3)cc2N1	ZINC000872473550	GF	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)cc2N1	ZINC000872473551	GF	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCO[C@@H](C4CC4)C3)cc2N1	ZINC000872473552	GF	On-Demand	Anodyne	PKM	24	41
O=S(=O)(c1cccc(Br)n1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473587	GF	On-Demand	Anodyne	OPRL1	19	43
O=S(=O)(c1cccc(Br)n1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473587	GF	On-Demand	Anodyne	CCR1	22	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473618	GG	On-Demand	Anodyne	OPRL1	24	50
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473618	GG	On-Demand	Anodyne	CCR1	43	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)(c2ccccc2)CC1	ZINC000872473618	GG	On-Demand	Anodyne	PKM	42	40
CC(C)(C)C(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872473619	DF	On-Demand	Anodyne	LEF	35	40
Cc1ccc(S(=O)(=O)N2CCN([C@@H](C)c3nccs3)CC2)c(C#N)c1	ZINC000872473644	GE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN([C@H](C)c3nccs3)CC2)c(C#N)c1	ZINC000872473645	GE	On-Demand	Mild	TRPV4	42	34
Oc1nnc(Cl)cc1N1CCCN(Cc2cn3cc(Cl)ccc3n2)CC1	ZINC000872473654	GF	On-Demand	Anodyne	DRD4	15	46
Cn1nccc1CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872473655	GD	On-Demand	Anodyne	PKM	38	46
COC[C@@H]1CCCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872473665	DE	On-Demand	Mild	EPHX2	15	45
COC[C@@H]1CCCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872473665	DE	On-Demand	Mild	TRPV4	43	35
COC[C@@H]1CCCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872473685	FG	On-Demand	Anodyne	CASP7	46	38
COc1cc(N2CCN(S(=O)(=O)c3ccc(C)cc3C#N)CC2)ncn1	ZINC000872473725	FD	On-Demand	Mild	TRPV4	44	36
CC1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872473741	EE	On-Demand	Anodyne	PKM	35	44
NC(=O)NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872473756	EE	On-Demand	Anodyne	GRM5	17	40
NC(=O)NC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872473756	EE	On-Demand	Anodyne	SIRT3	46	30
CC1(CO)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872473794	GE	On-Demand	Anodyne	PKM	29	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC(F)(F)CO)cc2N1	ZINC000872473806	FD	On-Demand	Anodyne	PKM	38	44
CCOC[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872473892	CG	On-Demand	Anodyne	PDE3B	41	37
NC(=O)NC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872473935	CD	On-Demand	Anodyne	SIRT3	46	31
COC(=O)[C@@H](CC(F)(F)F)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872473947	GF	On-Demand	Anodyne	LEF	40	44
Cc1c(F)ncnc1N1CCC(NC(N)=O)CC1	ZINC000872473988	CC	On-Demand	Anodyne	SIRT3	85	38
Cc1c(F)ncnc1N1CCC(NC(N)=O)CC1	ZINC000872473988	CC	On-Demand	Anodyne	SIRT2	69	37
Cc1c(F)ncnc1N1CCC(NC(N)=O)CC1	ZINC000872473988	CC	On-Demand	Anodyne	SIRT1	59	36
CCC(=O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872473996	ED	On-Demand	Anodyne	PKM	39	47
C=CCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872474030	EE	On-Demand	Mild	PKM	30	41
O=C(NC1CN(S(=O)(=O)c2cccc(Br)n2)C1)C1CCC1	ZINC000872474073	FD	On-Demand	Anodyne	EPHX2	21	44
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CCO	ZINC000872474088	FD	On-Demand	Anodyne	GCKR	62	31
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CCO	ZINC000872474089	FD	On-Demand	Anodyne	GCKR	62	31
CN(C)C1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872474159	GE	On-Demand	Anodyne	PKM	39	47
CO[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCO1	ZINC000872474184	ED	On-Demand	Anodyne	PKM	41	38
CCC(=O)c1c(Cl)cccc1NCc1ccccc1CS(C)(=O)=O	ZINC000872474260	FI	On-Demand	Anodyne	CXCL8	47	37
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCCC[C@@H]3O)cc2N1	ZINC000872474264	FE	On-Demand	Anodyne	PKM	38	46
O=C(CCc1ccccc1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872474296	FF	On-Demand	Anodyne	MC4R	18	40
CC[C@@H](CNc1cc(Cl)nnc1O)Oc1cccc(C)c1	ZINC000872474335	DG	On-Demand	Anodyne	PDS	53	40
Cn1ncc2c(NC3CCC(C)(O)CC3)nc(Cl)nc21	ZINC000872474421	CE	On-Demand	Anodyne	Q4VQ11_PIG	62	39
COc1cc(CN2CCN(c3ncnc(F)c3C)CC2)cc(OC)c1OC	ZINC000872474501	GE	On-Demand	Anodyne	PDGFRB	55	34
COc1cc(CN2CCN(c3ncnc(F)c3C)CC2)cc(OC)c1OC	ZINC000872474501	GE	On-Demand	Anodyne	ABCC1	52	35
C[C@@H]1CN(CC(C)(C)O)CCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872474544	GD	On-Demand	Anodyne	HSD11B1	22	48
CCCCCOC1CN(c2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872474563	CD	On-Demand	Anodyne	P2RY12	59	40
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H]1CCO	ZINC000872474581	ED	On-Demand	Anodyne	CASP3	48	36
O=S(=O)(c1cccc(Br)n1)N1CCC[C@@H]1CCO	ZINC000872474581	ED	On-Demand	Anodyne	CASP7	56	36
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H]1CCO	ZINC000872474585	ED	On-Demand	Anodyne	CASP3	48	36
O=S(=O)(c1cccc(Br)n1)N1CCC[C@H]1CCO	ZINC000872474585	ED	On-Demand	Anodyne	CASP7	56	36
Oc1nnc(Cl)cc1N1CC[C@H](OCCCc2ccccc2)C1	ZINC000872474606	EG	On-Demand	Anodyne	LIPG	44	41
Oc1nnc(Cl)cc1N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000872474608	EG	On-Demand	Anodyne	LIPG	44	41
NC(=O)c1cc(N2CC[C@H](OCCCc3ccccc3)C2)nc(Cl)n1	ZINC000872474629	FE	On-Demand	Anodyne	P2RY12	44	35
NC(=O)c1cc(N2CC[C@@H](OCCCc3ccccc3)C2)nc(Cl)n1	ZINC000872474631	FE	On-Demand	Anodyne	P2RY12	44	35
Cn1ncc2c(NCC3CCN(CC(=O)NC(C)(C)C)CC3)nc(Cl)nc21	ZINC000872474643	GE	On-Demand	Anodyne	CACNA1I	51	49
COc1cc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc(OC)c1OC	ZINC000872474658	GE	On-Demand	Anodyne	HTR1A	26	41
COc1cc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc(OC)c1OC	ZINC000872474658	GE	On-Demand	Anodyne	DRD2	28	41
COc1cc(CN2CCN(c3cc(Cl)nnc3O)CC2)cc(OC)c1OC	ZINC000872474658	GE	On-Demand	Anodyne	DRD4	27	41
Cc1c(F)ncnc1NC[C@H]1CCCO[C@H]1C(C)C	ZINC000872474693	CF	On-Demand	Anodyne	TNK2	40	34
Cc1c(F)ncnc1NC[C@@H]1CCCO[C@@H]1C(C)C	ZINC000872474694	CF	On-Demand	Anodyne	TNK2	40	34
Cc1c(F)ncnc1NC[C@@H]1CCCO[C@H]1C(C)C	ZINC000872474695	CF	On-Demand	Anodyne	TNK2	40	34
Cc1c(F)ncnc1NC[C@H]1CCCO[C@@H]1C(C)C	ZINC000872474696	CF	On-Demand	Anodyne	TNK2	40	34
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474754	CD	On-Demand	Mild	AR	24	40
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474754	CD	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474754	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474756	CD	On-Demand	Mild	AR	24	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474756	CD	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474756	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474758	CD	On-Demand	Mild	AR	24	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474758	CD	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@@H](C)C2)c(C#N)c1	ZINC000872474758	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474759	CD	On-Demand	Mild	AR	24	40
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474759	CD	On-Demand	Mild	EPHX2	17	42
Cc1ccc(S(=O)(=O)N2CC[C@H](O)[C@H](C)C2)c(C#N)c1	ZINC000872474759	CD	On-Demand	Mild	TRPV4	43	35
COc1cc(NC2CCN(c3nc(N)nc(C(F)F)n3)CC2)cc(OC)c1	ZINC000872474806	GE	On-Demand	Anodyne	EHMT2	48	37
COCC(=O)NC1CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872474852	DC	On-Demand	Mild	TRPV4	47	38
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1=O	ZINC000872474855	FE	On-Demand	Anodyne	PKM	27	42
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1=O	ZINC000872474857	FE	On-Demand	Anodyne	PKM	27	42
C[C@H]1C(=O)N(C)CCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872474859	GD	On-Demand	Anodyne	PKM	21	41
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	HTR1A	76	44
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	DRD2	66	49
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	DRD4	65	49
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	HTR2A	20	42
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	DRD3	58	49
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	HTR7	42	49
COc1cc(CN2CCN(c3ccnc4ncccc34)CC2)cc(OC)c1OC	ZINC000872474924	GF	On-Demand	Anodyne	SIGMAR1	15	45
Cc1c(F)ncnc1N1CC[C@H](C(=O)OC(C)(C)C)C1	ZINC000872474947	CE	On-Demand	Anodyne	SIRT3	43	37
Cc1c(F)ncnc1N1CC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000872474949	CE	On-Demand	Anodyne	SIRT3	43	37
Nc1nc(N[C@@H]2CCN(c3cccc(Cl)c3)C2)nc(C(F)F)n1	ZINC000872474993	EF	On-Demand	Anodyne	HRH4	58	37
Nc1nc(N[C@H]2CCN(c3cccc(Cl)c3)C2)nc(C(F)F)n1	ZINC000872474994	EF	On-Demand	Anodyne	HRH4	58	37
O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872475006	GE	On-Demand	Anodyne	CNR1	16	52
O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872475006	GE	On-Demand	Anodyne	PKM	43	39
O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872475006	GE	On-Demand	Anodyne	TGM2	44	47
O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872475006	GE	On-Demand	Anodyne	GCK	42	32
O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872475006	GE	On-Demand	Anodyne	F13A1	53	48
Cc1ccc(S(=O)(=O)N2C[C@@H]3C[C@]3(CO)C2)c(C#N)c1	ZINC000872475009	CC	On-Demand	Mild	TRPV4	48	39
Cc1ccc(S(=O)(=O)N2C[C@@H]3C[C@@]3(CO)C2)c(C#N)c1	ZINC000872475011	CC	On-Demand	Mild	TRPV4	48	39
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@@]3(CO)C2)c(C#N)c1	ZINC000872475013	CC	On-Demand	Mild	TRPV4	48	39
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@]3(CO)C2)c(C#N)c1	ZINC000872475015	CC	On-Demand	Mild	TRPV4	48	39
C[C@@H]1CN(CC(C)(C)O)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872475021	GE	On-Demand	Anodyne	HSD11B1	27	52
CCC(=O)c1c(Cl)cccc1N1CCC(N(C)CC(F)F)CC1	ZINC000872475026	EI	On-Demand	Anodyne	KCNQ2	51	34
COCCO[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872475065	GF	On-Demand	Anodyne	LIPG	45	46
COCCO[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872475068	GF	On-Demand	Anodyne	LIPG	45	46
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CC(C)(C)O	ZINC000872475076	GE	On-Demand	Anodyne	GCKR	75	35
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCN1CC(C)(C)O	ZINC000872475078	GE	On-Demand	Anodyne	GCKR	75	35
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@](O)(Cc2ccc(F)cc2)C1	ZINC000872475094	FE	On-Demand	Mild	TRPV4	45	37
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@](O)(Cc2ccc(F)cc2)C1	ZINC000872475096	FE	On-Demand	Mild	TRPV4	45	37
Cc1c(F)ncnc1N1CC[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C	ZINC000872475124	EF	On-Demand	Anodyne	GPR119	47	43
c1ccc(-c2cc(N3CCCC[C@H]3c3cn[nH]c3)ncn2)cc1	ZINC000872475152	DH	On-Demand	Anodyne	CPT1A	40	37
c1ccc(-c2cc(N3CCCC[C@@H]3c3cn[nH]c3)ncn2)cc1	ZINC000872475155	DH	On-Demand	Anodyne	CPT1A	40	37
O=C(C1CC1)N1CCCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872475187	GD	On-Demand	Anodyne	TGM2	22	42
O=C(C1CC1)N1CCCN(S(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872475187	GD	On-Demand	Anodyne	F13A1	23	43
Cc1ccc(S(=O)(=O)N2CCN(CC(C)C)C(=O)C2)c(C#N)c1	ZINC000872475225	ED	On-Demand	Mild	TRPV4	42	35
COc1ccc(CC[C@@H]2CCCCN2c2cc(Cl)nnc2O)cc1OC	ZINC000872475240	GH	On-Demand	Anodyne	FKBP1A	43	39
COc1ccc(CC[C@H]2CCCCN2c2cc(Cl)nnc2O)cc1OC	ZINC000872475242	GH	On-Demand	Anodyne	FKBP1A	43	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCn4ccnc4C3)cc2N1	ZINC000872475249	GE	On-Demand	Anodyne	PKM	17	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCn4ccnc4C3)cc2N1	ZINC000872475252	GE	On-Demand	Anodyne	PKM	17	40
Cc1ccc(S(=O)(=O)N2CC[C@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872475253	DD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CC[C@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872475253	DD	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872475255	DD	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872475255	DD	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2CC[C@@]3(C2)C(=O)Nc2ccccc23)c(C#N)c1	ZINC000872475278	FE	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CC[C@]3(C2)C(=O)Nc2ccccc23)c(C#N)c1	ZINC000872475281	FE	On-Demand	Mild	TRPV4	42	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC(NC(=O)C4CC4)C3)cc2N1	ZINC000872475284	GD	On-Demand	Anodyne	EPHX2	27	48
COC(=O)C[C@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872475297	DD	On-Demand	Anodyne	TNK2	43	36
O=C(CCc1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872475306	EH	On-Demand	Anodyne	C3AR1	47	46
O=C(CCc1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872475306	EH	On-Demand	Anodyne	PREP	77	40
O=C(CCc1ccccc1)N1CCCN(c2ccncc2C2CC2)CC1	ZINC000872475306	EH	On-Demand	Anodyne	SSTR1	39	40
O=C(CCc1ccccc1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872475308	FG	On-Demand	Anodyne	C3AR1	40	41
COC(=O)C[C@@H]1CN(c2cc(-c3ccccc3)ncn2)CCO1	ZINC000872475320	DD	On-Demand	Anodyne	TNK2	43	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CCO	ZINC000872475400	CD	On-Demand	Mild	CASP3	44	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@@H]1CCO	ZINC000872475400	CD	On-Demand	Mild	CASP7	55	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CCO	ZINC000872475401	CD	On-Demand	Mild	CASP3	44	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC[C@H]1CCO	ZINC000872475401	CD	On-Demand	Mild	CASP7	55	35
O=S(=O)(NCCN1CCCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872475420	FD	On-Demand	Anodyne	HTR7	31	40
O=S(=O)(NCCN1CCCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872475420	FD	On-Demand	Anodyne	HTR6	15	40
COc1ccc(OC)c2sc(N[C@H](C)C(=O)N(C)C)nc12	ZINC000872475456	DE	On-Demand	Anodyne	ADORA2B	18	48
Cc1cccc(C#N)c1S(=O)(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000872475463	ED	On-Demand	Mild	F13A1	21	40
Cc1ccc(S(=O)(=O)N2CC[C@](O)(Cc3ccc(F)cc3)C2)c(C#N)c1	ZINC000872475477	FE	On-Demand	Mild	TRPV4	56	47
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(Cc3ccc(F)cc3)C2)c(C#N)c1	ZINC000872475479	FE	On-Demand	Mild	TRPV4	56	47
CC(C)(C)NC(=O)CN1CCC(CNc2ccnc3ncccc23)CC1	ZINC000872475548	FF	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)NC(=O)CN1CCC(CNc2ccnc3ncccc23)CC1	ZINC000872475548	FF	On-Demand	Anodyne	CACNA1I	53	48
CC(C)(C)NC(=O)CN1CCC(CN=c2cc[nH]cc2C2CC2)CC1	ZINC000872475576	EE	On-Demand	Anodyne	CACNA1I	38	42
c1ccc(-c2cc(N3CCC(OC[C@@H]4CCCCO4)CC3)ncn2)cc1	ZINC000872475593	FH	On-Demand	Anodyne	TNK2	56	36
c1ccc(-c2cc(N3CCC(OC[C@H]4CCCCO4)CC3)ncn2)cc1	ZINC000872475594	FH	On-Demand	Anodyne	TNK2	56	36
NC(=O)c1cc(NC2CCC(N3CCCCC3)CC2)nc(Cl)n1	ZINC000872475595	EE	On-Demand	Anodyne	L3MBTL3	74	37
Cc1ccc(S(=O)(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)c(C#N)c1	ZINC000872475629	FD	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)c(C#N)c1	ZINC000872475630	FD	On-Demand	Mild	TRPV4	42	34
COCCN(CCC(=O)OC)c1cc(-c2ccccc2)ncn1	ZINC000872475635	DE	On-Demand	Anodyne	LTB4R	22	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCC=CO3)cc2N1	ZINC000872475645	FF	On-Demand	Anodyne	PKM	32	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCC=CO3)cc2N1	ZINC000872475646	FF	On-Demand	Anodyne	PKM	32	43
COCCO[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872475648	DD	On-Demand	Mild	TRPV4	42	34
COCCO[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872475649	DD	On-Demand	Mild	TRPV4	42	34
CO[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872475652	FD	On-Demand	Anodyne	PKM	15	41
Cc1cccc(C#N)c1S(=O)(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000872475653	ED	On-Demand	Mild	EPHX2	33	47
C[C@@]1(CO)CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872475658	FE	On-Demand	Anodyne	PKM	24	40
C[C@]1(CO)CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872475660	FE	On-Demand	Anodyne	PKM	24	40
C=C(C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872475716	EE	On-Demand	Mild	PKM	40	48
c1ccc(-c2cc(N3CCC(OC[C@H]4CCCO4)CC3)ncn2)cc1	ZINC000872475728	EG	On-Demand	Anodyne	TNK2	59	39
c1ccc(-c2cc(N3CCC(OC[C@@H]4CCCO4)CC3)ncn2)cc1	ZINC000872475729	EG	On-Demand	Anodyne	TNK2	59	39
NC(=O)c1cc(N2CCC(c3ccc(F)cc3)CC2)nc(Cl)n1	ZINC000872475736	EF	On-Demand	Anodyne	SCD1	19	46
Cc1cccc(C#N)c1S(=O)(=O)N1CC(NC(=O)C2CC2)C1	ZINC000872475779	DC	On-Demand	Mild	EPHX2	34	45
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@H](C)C1	ZINC000872475789	FD	On-Demand	Anodyne	HSD11B1	19	45
C[C@H](O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@@H](C)C1	ZINC000872475790	FD	On-Demand	Anodyne	HSD11B1	19	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CC34CCOCC4)cc2N1	ZINC000872475837	GF	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CC34CCOCC4)cc2N1	ZINC000872475838	GF	On-Demand	Anodyne	PKM	26	42
Cc1c(F)ncnc1NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000872475866	ED	On-Demand	Anodyne	CACNA1I	51	50
CC(C)(C(N)=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872475875	ED	On-Demand	Anodyne	HRH4	19	62
CC(C)(C(N)=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872475875	ED	On-Demand	Anodyne	PRNP	43	32
CCC(=O)c1c(Cl)cccc1NCCN1CCC(OC)CC1	ZINC000872475904	DG	On-Demand	Anodyne	DRD4	46	38
CCC(=O)c1c(Cl)cccc1NCCN1CCC(OC)CC1	ZINC000872475904	DG	On-Demand	Anodyne	HTR4	55	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@@H]2CCCO2)CC1	ZINC000872475953	FG	On-Demand	Anodyne	PKM	47	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@H]2CCCO2)CC1	ZINC000872475955	FG	On-Demand	Anodyne	PKM	47	40
O=C(NC1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1)C1CC1	ZINC000872475965	ED	On-Demand	Anodyne	EPHX2	28	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@@H]3CCO)cc2N1	ZINC000872476000	FE	On-Demand	Anodyne	CASP7	44	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@H]3CCO)cc2N1	ZINC000872476002	FE	On-Demand	Anodyne	CASP7	44	38
Cc1ccc(S(=O)(=O)N2CCc3ncsc3C2)c(C#N)c1	ZINC000872476004	DE	On-Demand	Mild	TRPV4	41	34
Cc1cccc(C#N)c1S(=O)(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000872476005	FD	On-Demand	Mild	PKNB	42	39
COC(=O)C[C@@H]1CN(c2nc(Cl)nc3c2cnn3C)CCO1	ZINC000872476020	EC	On-Demand	Anodyne	MTOR	51	35
COC(=O)C[C@H]1CN(c2nc(Cl)nc3c2cnn3C)CCO1	ZINC000872476022	EC	On-Demand	Anodyne	MTOR	51	35
CN1C[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872476147	GD	On-Demand	Anodyne	PKM	33	43
CN1C[C@@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872476148	GD	On-Demand	Anodyne	PKM	33	43
Cc1ccc(S(=O)(=O)N2CCc3c(ncn(C)c3=O)C2)c(C#N)c1	ZINC000872476149	EC	On-Demand	Mild	TRPV4	43	35
Cn1ncc2c(NC3CCC(N4CCCCC4)CC3)nc(Cl)nc21	ZINC000872476153	EG	On-Demand	Anodyne	CCR4	19	42
Cc1c(F)ncnc1NC1CCC(N2CCCCC2)CC1	ZINC000872476161	CG	On-Demand	Anodyne	CCR4	17	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(CCO)CC3)cc2N1	ZINC000872476171	FE	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@@H]3CCO)cc2N1	ZINC000872476176	GE	On-Demand	Anodyne	PKM	34	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@H]3CCO)cc2N1	ZINC000872476177	GE	On-Demand	Anodyne	PKM	34	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@@H]3CCO)cc2N1	ZINC000872476178	GE	On-Demand	Anodyne	PKM	34	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H]3CCO)cc2N1	ZINC000872476179	GE	On-Demand	Anodyne	PKM	34	42
Cn1cnc2c(c1=O)CCN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872476180	FD	On-Demand	Anodyne	AKR1C3	54	36
Nc1cc(C2CCN(c3cc(-c4ccccc4)ncn3)CC2)[nH]n1	ZINC000872476194	DF	On-Demand	Anodyne	PKNB	49	42
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC[C@@H]1O	ZINC000872476276	FE	On-Demand	Anodyne	PKM	22	41
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC[C@H]1O	ZINC000872476278	FE	On-Demand	Anodyne	PKM	22	41
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC[C@H]1O	ZINC000872476280	FE	On-Demand	Anodyne	PKM	22	41
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC[C@@H]1O	ZINC000872476283	FE	On-Demand	Anodyne	PKM	22	41
O=S(=O)(N[C@H]1CCCC[C@@H]1O)c1ccc(F)c(C(F)F)c1	ZINC000872476294	DE	On-Demand	Anodyne	LEF	22	40
Cc1ccc(S(=O)(=O)N2CCN(CC(C)(C)O)C[C@@H]2C)c(C#N)c1	ZINC000872476310	FD	On-Demand	Mild	HSD11B1	18	41
O=C(NC1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1)C1CCC1	ZINC000872476311	FE	On-Demand	Anodyne	EPHX2	26	45
Cc1ccc(S(=O)(=O)N2CCN(CC(C)(C)O)C[C@H]2C)c(C#N)c1	ZINC000872476312	FD	On-Demand	Mild	HSD11B1	18	41
O=C(NC1CN(S(=O)(=O)c2cccc(Br)n2)C1)C1CC1	ZINC000872476400	FC	On-Demand	Anodyne	EPHX2	22	43
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[C@@H]1O	ZINC000872476404	DE	On-Demand	Anodyne	GCKR	74	34
C[C@@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[C@H]1O	ZINC000872476405	DE	On-Demand	Anodyne	GCKR	74	34
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[C@H]1O	ZINC000872476407	DE	On-Demand	Anodyne	GCKR	74	34
CNC(=O)[C@@H](C)Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872476432	CD	On-Demand	Anodyne	ADORA2B	18	47
Cc1ccc(S(=O)(=O)N2C[C@@H](CO)[C@H](c3ccsc3)C2)c(C#N)c1	ZINC000872476455	FE	On-Demand	Mild	TRPV4	40	32
CC(C)(C(N)=O)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872476457	FE	On-Demand	Anodyne	HRH4	18	50
c1cnc2nccc(NC3CCC(N4CCCCC4)CC3)c2c1	ZINC000872476489	DH	On-Demand	Anodyne	HRH3	15	44
Cc1c(F)ncnc1N1CCN(C(C)(C)C(N)=O)CC1	ZINC000872476496	CC	On-Demand	Anodyne	SIRT3	54	34
Cc1c(F)ncnc1N1CCN(C(C)(C)C(N)=O)CC1	ZINC000872476496	CC	On-Demand	Anodyne	SIRT2	40	33
C[C@H]1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[C@@H]1O	ZINC000872476547	DE	On-Demand	Anodyne	GCKR	74	34
Cc1ccc(S(=O)(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)c(C#N)c1	ZINC000872476549	FD	On-Demand	Mild	PKNB	40	35
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(c2c(F)cccc2F)CC1	ZINC000872476558	GF	On-Demand	Mild	PKM	20	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(c2c(F)cccc2F)CC1	ZINC000872476558	GF	On-Demand	Mild	TRPV4	45	39
Cc1cccc(C#N)c1S(=O)(=O)NCCN1CCC[C@H]1C	ZINC000872476561	DD	On-Demand	Mild	HRH3	51	44
Cc1cccc(C#N)c1S(=O)(=O)NCCN1CCC[C@@H]1C	ZINC000872476563	DD	On-Demand	Mild	HRH3	51	44
Cc1ccc(S(=O)(=O)N2CCN(CCO)C(C)(C)C2)c(C#N)c1	ZINC000872476565	EC	On-Demand	Mild	TRPV4	46	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CCO	ZINC000872476629	DE	On-Demand	Anodyne	CASP3	106	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CCO	ZINC000872476629	DE	On-Demand	Anodyne	APP	42	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1CCO	ZINC000872476629	DE	On-Demand	Anodyne	CASP7	118	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CCO	ZINC000872476631	DE	On-Demand	Anodyne	CASP3	106	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CCO	ZINC000872476631	DE	On-Demand	Anodyne	APP	42	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1CCO	ZINC000872476631	DE	On-Demand	Anodyne	CASP7	118	44
Cc1c(F)ncnc1NCc1ccccc1CS(C)(=O)=O	ZINC000872476634	DE	On-Demand	Anodyne	PTK2	42	36
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000872476636	GD	On-Demand	Mild	EPHX2	37	46
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000872476637	GD	On-Demand	Mild	EPHX2	37	46
Cc1ccc(S(=O)(=O)N2CCN(CCO)[C@H](C)C2)c(C#N)c1	ZINC000872476638	DC	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CCN(CCO)[C@@H](C)C2)c(C#N)c1	ZINC000872476639	DC	On-Demand	Mild	TRPV4	42	35
COC(=O)C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872476645	EF	On-Demand	Anodyne	GRM5	15	40
COC(=O)C[C@@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CCO1	ZINC000872476646	EF	On-Demand	Anodyne	GRM5	15	40
CC(C)(C)NC(=O)CN1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872476682	FD	On-Demand	Anodyne	CACNA1H	21	40
CC(C)(C)NC(=O)CN1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872476682	FD	On-Demand	Anodyne	CACNA1I	78	57
Cc1c(F)ncnc1N1CC[C@H](OCCCc2ccccc2)C1	ZINC000872476734	DG	On-Demand	Anodyne	PDE3A	41	37
Cc1c(F)ncnc1N1CC[C@H](OCCCc2ccccc2)C1	ZINC000872476734	DG	On-Demand	Anodyne	DCK	41	37
Cc1c(F)ncnc1N1CC[C@H](OCCCc2ccccc2)C1	ZINC000872476734	DG	On-Demand	Anodyne	PDE3B	45	37
Cc1c(F)ncnc1N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000872476735	DG	On-Demand	Anodyne	PDE3A	41	37
Cc1c(F)ncnc1N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000872476735	DG	On-Demand	Anodyne	DCK	41	37
Cc1c(F)ncnc1N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000872476735	DG	On-Demand	Anodyne	PDE3B	45	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(O)(C(F)F)CC1	ZINC000872476772	FF	On-Demand	Anodyne	PKM	47	38
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c(C#N)c1	ZINC000872476777	GD	On-Demand	Mild	EPHX2	41	50
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c(C#N)c1	ZINC000872476777	GD	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c(C#N)c1	ZINC000872476778	GD	On-Demand	Mild	EPHX2	41	50
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c(C#N)c1	ZINC000872476778	GD	On-Demand	Mild	TRPV4	43	36
CN(C)CCCOC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872476822	EG	On-Demand	Anodyne	DCK	37	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(CO)CCCC3)cc2N1	ZINC000872476839	GE	On-Demand	Anodyne	PKM	38	44
O=C(NCCCNc1cc(Cl)nnc1O)C1CCC1	ZINC000872476846	CD	On-Demand	Anodyne	IKBKE	43	40
O=C(NCCCNc1cc(Cl)nnc1O)C1CCC1	ZINC000872476846	CD	On-Demand	Anodyne	TBK1	89	40
O=C(NCCCNc1nc(Cl)nc2sccc12)C1CCC1	ZINC000872476950	DG	On-Demand	Anodyne	IKBKE	44	42
O=C(NCCCNc1nc(Cl)nc2sccc12)C1CCC1	ZINC000872476950	DG	On-Demand	Anodyne	MARK3	25	42
O=C(NCCCNc1nc(Cl)nc2sccc12)C1CCC1	ZINC000872476950	DG	On-Demand	Anodyne	TBK1	105	44
CCN(C)C(=O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872476977	FD	On-Demand	Anodyne	PKM	37	44
Cc1ccc(S(=O)(=O)N2CCOCC3(CCCC3)C2)c(C#N)c1	ZINC000872476991	EE	On-Demand	Mild	TRPV4	44	36
CC[C@@H](CNc1cc(Cl)nnc1O)Oc1cccc(F)c1	ZINC000872476998	DG	On-Demand	Anodyne	PDS	48	41
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	ACHE	23	41
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	P2RY12	98	41
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	LTB4R	19	40
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	SIRT3	59	33
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	SIRT2	55	33
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	SIRT1	54	33
COC(=O)CCC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872477051	EG	On-Demand	Anodyne	VCP	43	42
O=S(=O)(c1cccc(Br)n1)N1CCc2nnc(O)cc2C1	ZINC000872477091	FD	On-Demand	Anodyne	AKR1C3	59	40
COCC1=CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872477122	DD	On-Demand	Mild	TRPV4	42	35
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477157	EG	On-Demand	Anodyne	DRD4	43	48
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477157	EG	On-Demand	Anodyne	ACHE	33	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477157	EG	On-Demand	Anodyne	SIGMAR1	36	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477158	EG	On-Demand	Anodyne	DRD4	43	48
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477158	EG	On-Demand	Anodyne	ACHE	33	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477158	EG	On-Demand	Anodyne	SIGMAR1	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477159	EG	On-Demand	Anodyne	DRD4	43	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477159	EG	On-Demand	Anodyne	ACHE	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872477159	EG	On-Demand	Anodyne	SIGMAR1	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477160	EG	On-Demand	Anodyne	DRD4	43	48
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477160	EG	On-Demand	Anodyne	ACHE	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(Cl)nnc1O	ZINC000872477160	EG	On-Demand	Anodyne	SIGMAR1	36	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCCC[C@H]3O)cc2N1	ZINC000872477169	FE	On-Demand	Anodyne	PKM	38	46
NC(=O)c1cc(NC2CCN(C3CCCC3)CC2)nc(Cl)n1	ZINC000872477176	DE	On-Demand	Anodyne	HRH3	15	41
CCC1(CC)CN(S(=O)(=O)c2ccc(C)cc2C#N)CC[S@]1=O	ZINC000872477177	FE	On-Demand	Mild	TRPV4	51	40
CCC1(CC)CN(S(=O)(=O)c2ccc(C)cc2C#N)CC[S@@]1=O	ZINC000872477178	FE	On-Demand	Mild	TRPV4	51	40
C#C[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H]1CCCO1	ZINC000872477184	GE	On-Demand	Mild	PKM	29	42
C#C[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H]1CCCO1	ZINC000872477185	GE	On-Demand	Mild	PKM	29	42
C#C[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H]1CCCO1	ZINC000872477186	GE	On-Demand	Mild	PKM	29	42
C#C[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H]1CCCO1	ZINC000872477187	GE	On-Demand	Mild	PKM	29	42
O=C(N1CCC(CNc2cc(Cl)nnc2O)CC1)C(F)(F)F	ZINC000872477205	EE	On-Demand	Anodyne	CACNA1I	44	34
COC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872477229	CE	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872477229	CE	On-Demand	Anodyne	SIRT3	65	39
COC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872477229	CE	On-Demand	Anodyne	SIRT2	56	39
COC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872477229	CE	On-Demand	Anodyne	SIRT1	55	39
COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872477244	GE	On-Demand	Anodyne	PROKR1	59	32
COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872477245	GE	On-Demand	Anodyne	PROKR1	59	32
COC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872477257	CF	On-Demand	Anodyne	SIRT3	59	40
COC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872477257	CF	On-Demand	Anodyne	SIRT2	54	34
COC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872477257	CF	On-Demand	Anodyne	SIRT1	54	33
CO[C@@H](C)[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872477277	FE	On-Demand	Anodyne	PKM	40	48
CC[C@]1(C)CN(S(=O)(=O)c2ccc(C)cc2C#N)CCO1	ZINC000872477292	DE	On-Demand	Mild	TRPV4	44	35
CO[C@@H](C)[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872477295	DE	On-Demand	Anodyne	LEF	37	41
Cc1ccc(S(=O)(=O)N2CCn3ncnc3C2)c(C#N)c1	ZINC000872477322	DC	On-Demand	Mild	TRPV4	44	36
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000872477325	GF	On-Demand	Mild	TRPV4	46	40
Cc1c(F)ncnc1N1CCC(OCCCNC(=O)OC(C)(C)C)CC1	ZINC000872477326	FF	On-Demand	Anodyne	SIRT3	56	45
Cc1c(F)ncnc1N1CCC(OCCCNC(=O)OC(C)(C)C)CC1	ZINC000872477326	FF	On-Demand	Anodyne	SIRT2	55	45
Cc1c(F)ncnc1N1CCC(OCCCNC(=O)OC(C)(C)C)CC1	ZINC000872477326	FF	On-Demand	Anodyne	SIRT1	51	36
CO[C@@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872477344	CG	On-Demand	Anodyne	PDE3A	43	39
CO[C@@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872477344	CG	On-Demand	Anodyne	DCK	36	41
CO[C@@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872477344	CG	On-Demand	Anodyne	PDE3B	47	39
Cc1ccc(S(=O)(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c(C#N)c1	ZINC000872477356	FD	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c(C#N)c1	ZINC000872477356	FD	On-Demand	Mild	TRPV4	43	35
O=C(Cc1cccc(F)c1)N1CCCN(c2ccnc3ncccc23)CC1	ZINC000872477363	FG	On-Demand	Anodyne	KCNQ2	17	45
NC(=O)c1cc(N2CCC(c3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872477364	EF	On-Demand	Anodyne	SCD1	16	44
Cn1ncc2c(N3CCC[C@H](CNC(=O)c4ccccc4)C3)nc(Cl)nc21	ZINC000872477375	GF	On-Demand	Anodyne	CACNA1I	66	37
Cn1ncc2c(N3CCC[C@@H](CNC(=O)c4ccccc4)C3)nc(Cl)nc21	ZINC000872477376	GF	On-Demand	Anodyne	CACNA1I	66	37
Cc1ccc(S(=O)(=O)N2CCOC3(CCOCC3)CC2)c(C#N)c1	ZINC000872477391	FD	On-Demand	Mild	TRPV4	45	39
CO[C@@H]1CCN(c2ccnc3ncccc23)C1	ZINC000872477394	BD	On-Demand	Anodyne	PDE3B	43	37
Nc1nsc(N2CCN(c3cc(-c4ccccc4)ncn3)CC2)n1	ZINC000872477452	ED	On-Demand	Anodyne	HRH4	20	59
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCCCO3)cc2N1	ZINC000872477460	FF	On-Demand	Anodyne	PKM	22	40
COC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872477503	CE	On-Demand	Anodyne	SIRT3	71	39
COC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872477503	CE	On-Demand	Anodyne	SIRT2	61	39
COC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872477503	CE	On-Demand	Anodyne	SIRT1	59	38
COC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872477570	EC	On-Demand	Mild	EPHX2	15	41
COC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872477570	EC	On-Demand	Mild	TRPV4	47	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)C(F)(F)F)CC1	ZINC000872477586	FE	On-Demand	Mild	EPHX2	32	41
NC(=O)c1cc(NCCC2CCN(CC(F)(F)F)CC2)nc(Cl)n1	ZINC000872477644	FE	On-Demand	Anodyne	SIRT1	40	33
Cc1ccc(S(=O)(=O)N2C[C@H](O)CC(F)(F)C2)c(C#N)c1	ZINC000872477651	DD	On-Demand	Mild	TRPV4	47	38
Cc1ccc(S(=O)(=O)N2C[C@@H](O)CC(F)(F)C2)c(C#N)c1	ZINC000872477652	DD	On-Demand	Mild	TRPV4	47	38
C[C@@H](CCN1CCN(C)CC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872477710	GE	On-Demand	Anodyne	HTR7	15	57
O=C(Cc1cccc(F)c1)N1CCCN(c2cc(Cl)nnc2O)CC1	ZINC000872477719	FE	On-Demand	Anodyne	KCNQ2	23	45
Cc1ccc(S(=O)(=O)N2CCO[C@@]3(CCOC3)C2)c(C#N)c1	ZINC000872477729	DD	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CCO[C@]3(CCOC3)C2)c(C#N)c1	ZINC000872477730	DD	On-Demand	Mild	TRPV4	42	34
CC(C)(C)NC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872477731	GF	On-Demand	Anodyne	PKM	41	37
CC(C)(C)NC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872477731	GF	On-Demand	Anodyne	TGM2	53	34
CC(C)(C)NC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872477731	GF	On-Demand	Anodyne	F13A1	61	37
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCOC(F)(F)F)cc2N1	ZINC000872477755	GE	On-Demand	Anodyne	PKM	38	46
Cc1noc(C)c1CCCNc1ccnc2ncccc12	ZINC000872477790	CG	On-Demand	Anodyne	HNMT	49	36
Cc1ccc(S(=O)(=O)N2CC[C@@](F)(C#N)C2)c(C#N)c1	ZINC000872477805	CD	On-Demand	Mild	TRPV4	47	40
Cc1ccc(S(=O)(=O)N2CC[C@](F)(C#N)C2)c(C#N)c1	ZINC000872477806	CD	On-Demand	Mild	TRPV4	47	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCCO1	ZINC000872477820	CE	On-Demand	Anodyne	PKM	40	38
COC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872477835	ED	On-Demand	Anodyne	SIRT3	62	33
COC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872477835	ED	On-Demand	Anodyne	SIRT2	53	33
COC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872477835	ED	On-Demand	Anodyne	SIRT1	51	33
Nc1nc(C(F)F)nc(N2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000872477851	FE	On-Demand	Anodyne	HTR3A	28	51
Nc1nc(C(F)F)nc(N2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000872477851	FE	On-Demand	Anodyne	SORD	34	47
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477853	GD	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477853	GD	On-Demand	Anodyne	CCR8	103	50
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477853	GD	On-Demand	Anodyne	SFRP1	99	35
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477853	GD	On-Demand	Anodyne	WNT3	65	33
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477854	GD	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477854	GD	On-Demand	Anodyne	CCR8	103	50
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477854	GD	On-Demand	Anodyne	SFRP1	99	35
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1	ZINC000872477854	GD	On-Demand	Anodyne	WNT3	65	33
Cc1c(F)ncnc1N1CCN(c2ccc3ccccc3n2)CC1	ZINC000872477874	DF	On-Demand	Anodyne	HTR3A	30	56
Cc1c(F)ncnc1N1CCN(c2ccc3ccccc3n2)CC1	ZINC000872477874	DF	On-Demand	Anodyne	SORD	40	48
CCC(=O)c1c(Cl)cccc1N1CC[C@@H](OC)C1	ZINC000872477877	CG	On-Demand	Anodyne	LIPG	45	36
O=C(NCCCN=c1cc[nH]cc1C1CC1)C1CCC1	ZINC000872477879	CE	On-Demand	Anodyne	TBK1	78	38
Oc1nnc(Cl)cc1NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000872477888	GG	On-Demand	Anodyne	ACHE	42	44
Oc1nnc(Cl)cc1NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000872477888	GG	On-Demand	Anodyne	SIGMAR1	36	54
Oc1nnc(Cl)cc1NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000872477888	GG	On-Demand	Anodyne	BCHE	17	41
Cn1ncc2c(NC3CCN(C4CCCC4)CC3)nc(Cl)nc21	ZINC000872477891	EF	On-Demand	Anodyne	CCR4	17	43
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	GSK3A	23	40
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	MTNR1A	18	40
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	MTNR1B	16	40
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	IKBKE	44	44
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	TBK1	93	44
O=C(NCCCNc1cc(-c2ccccc2)ncn1)C1CCC1	ZINC000872477894	DF	On-Demand	Anodyne	VCP	59	38
O=C(C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1)C(F)(F)F	ZINC000872477927	GG	On-Demand	Anodyne	GCK	47	36
Cc1ccc(S(=O)(=O)N2CCO[C@H](COC(C)C)C2)c(C#N)c1	ZINC000872477933	ED	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2CCO[C@@H](COC(C)C)C2)c(C#N)c1	ZINC000872477934	ED	On-Demand	Mild	TRPV4	42	35
Cn1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C2)cn1	ZINC000872477939	FG	On-Demand	Anodyne	GCKR	54	33
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477942	ED	On-Demand	Mild	P2RY12	45	39
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477942	ED	On-Demand	Mild	CTSC	17	40
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477942	ED	On-Demand	Mild	CCR8	113	52
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477942	ED	On-Demand	Mild	SFRP1	122	37
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477942	ED	On-Demand	Mild	WNT3	82	36
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477943	ED	On-Demand	Mild	P2RY12	45	39
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477943	ED	On-Demand	Mild	CTSC	17	40
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477943	ED	On-Demand	Mild	CCR8	113	52
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477943	ED	On-Demand	Mild	SFRP1	122	37
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872477943	ED	On-Demand	Mild	WNT3	82	36
Nc1nsc(N2CCN(c3cc(-c4cccc(Cl)c4)ncn3)CC2)n1	ZINC000872477956	FF	On-Demand	Anodyne	HRH4	20	53
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCOCC(F)F)cc2N1	ZINC000872477974	GE	On-Demand	Anodyne	PKM	37	44
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	P2RY12	25	40
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	GRIN2B	35	46
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	FAAH	15	45
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	SIRT3	50	33
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	SIRT2	51	33
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	SIRT1	50	33
O=C(N1CCC(CNc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872478019	FG	On-Demand	Anodyne	VCP	68	41
CCOC(=O)N1CC[C@@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872478085	ED	On-Demand	Anodyne	CCR8	42	40
CCOC(=O)N1CC[C@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872478086	ED	On-Demand	Anodyne	CCR8	42	40
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872478102	EF	On-Demand	Anodyne	SLC6A1	50	32
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872478102	EF	On-Demand	Anodyne	PREP	16	41
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872478102	EF	On-Demand	Anodyne	AKT1	17	44
Cc1c(F)ncnc1N1CCC[C@@H](CNC(=O)c2ccccc2)C1	ZINC000872478102	EF	On-Demand	Anodyne	CACNA1I	51	33
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872478103	EF	On-Demand	Anodyne	SLC6A1	50	32
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872478103	EF	On-Demand	Anodyne	PREP	16	41
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872478103	EF	On-Demand	Anodyne	AKT1	17	44
Cc1c(F)ncnc1N1CCC[C@H](CNC(=O)c2ccccc2)C1	ZINC000872478103	EF	On-Demand	Anodyne	CACNA1I	51	33
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	FKBP1A	28	40
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	CASP3	42	38
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	MMP13	38	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	MMP3	36	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	CASP7	57	36
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	MMP7	46	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478111	EG	On-Demand	Anodyne	MMP1	42	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	FKBP1A	28	40
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	CASP3	42	38
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	MMP13	38	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	MMP3	36	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	CASP7	57	36
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	MMP7	46	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478112	EG	On-Demand	Anodyne	MMP1	42	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872478120	EF	On-Demand	Anodyne	DRD4	25	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872478121	EF	On-Demand	Anodyne	DRD4	25	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872478122	EF	On-Demand	Anodyne	DRD4	25	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872478123	EF	On-Demand	Anodyne	DRD4	25	42
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478127	ED	On-Demand	Mild	CCR8	105	49
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478127	ED	On-Demand	Mild	SFRP1	80	33
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478127	ED	On-Demand	Mild	WNT3	46	32
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478128	ED	On-Demand	Mild	CCR8	105	49
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478128	ED	On-Demand	Mild	SFRP1	80	33
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872478128	ED	On-Demand	Mild	WNT3	46	32
Cc1ccc(S(=O)(=O)N2CCSC3(CCOCC3)C2)c(C#N)c1	ZINC000872478142	FE	On-Demand	Mild	TRPV4	43	36
C/C=C\C[C@@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478143	FE	On-Demand	Anodyne	PKM	37	44
C/C=C/C[C@@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478144	FE	On-Demand	Anodyne	PKM	37	44
C/C=C/C[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478145	FE	On-Demand	Anodyne	PKM	37	44
C/C=C\C[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478146	FE	On-Demand	Anodyne	PKM	37	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCCO3)cc2N1	ZINC000872478184	EE	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3OCCCO3)cc2N1	ZINC000872478188	FD	On-Demand	Anodyne	PKM	37	44
COC(=O)CCC1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872478189	EH	On-Demand	Anodyne	SIRT3	55	32
COC(=O)CCC1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872478189	EH	On-Demand	Anodyne	SIRT2	51	32
COC(=O)CCC1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872478189	EH	On-Demand	Anodyne	SIRT1	50	32
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@H]1CO	ZINC000872478201	DE	On-Demand	Anodyne	CASP7	41	35
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@@H]1CO	ZINC000872478202	DE	On-Demand	Anodyne	CASP7	41	35
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@@H]1CO	ZINC000872478203	DE	On-Demand	Anodyne	CASP7	41	35
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)[C@H]1CO	ZINC000872478204	DE	On-Demand	Anodyne	CASP7	41	35
N#C[C@@]1(F)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872478207	FE	On-Demand	Mild	TRPV4	41	34
N#C[C@]1(F)CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872478208	FE	On-Demand	Mild	TRPV4	41	34
COc1ccc(OC)c2sc(NCC(C)(C)S(C)(=O)=O)nc12	ZINC000872478260	EF	On-Demand	Anodyne	ADORA2B	16	40
Cc1c(F)ncnc1NCCCNC(=O)C1CCC1	ZINC000872478262	CD	On-Demand	Anodyne	IKBKE	44	45
Cc1c(F)ncnc1NCCCNC(=O)C1CCC1	ZINC000872478262	CD	On-Demand	Anodyne	MARK3	25	45
Cc1c(F)ncnc1NCCCNC(=O)C1CCC1	ZINC000872478262	CD	On-Demand	Anodyne	TBK1	101	47
Cn1ncc2c(N3CCN(c4ccc5ccccc5n4)CC3)nc(Cl)nc21	ZINC000872478264	GF	On-Demand	Anodyne	HTR3A	28	53
Cn1ncc2c(N3CCN(c4ccc5ccccc5n4)CC3)nc(Cl)nc21	ZINC000872478264	GF	On-Demand	Anodyne	SORD	22	41
Nc1nc(C(F)F)nc(N2CCC[C@H](CNC(=O)c3ccccc3)C2)n1	ZINC000872478272	FE	On-Demand	Anodyne	DPP4	15	43
Nc1nc(C(F)F)nc(N2CCC[C@H](CNC(=O)c3ccccc3)C2)n1	ZINC000872478272	FE	On-Demand	Anodyne	CACNA1I	41	32
Nc1nc(C(F)F)nc(N2CCC[C@@H](CNC(=O)c3ccccc3)C2)n1	ZINC000872478273	FE	On-Demand	Anodyne	DPP4	15	43
Nc1nc(C(F)F)nc(N2CCC[C@@H](CNC(=O)c3ccccc3)C2)n1	ZINC000872478273	FE	On-Demand	Anodyne	CACNA1I	41	32
Oc1nnc(Cl)cc1N1CCC(c2cccc(F)c2)CC1	ZINC000872478290	DG	On-Demand	Anodyne	GRM2	15	44
Oc1nnc(Cl)cc1N1CCC(c2cccc(F)c2)CC1	ZINC000872478290	DG	On-Demand	Anodyne	MLYCD	16	47
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccccc1	ZINC000872478291	EE	On-Demand	Anodyne	DRD2	18	41
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccccc1	ZINC000872478291	EE	On-Demand	Anodyne	CCR3	16	44
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccccc1	ZINC000872478291	EE	On-Demand	Anodyne	DPP4	17	40
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccccc1	ZINC000872478291	EE	On-Demand	Anodyne	PREP	16	41
O=C(NC[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccccc1	ZINC000872478291	EE	On-Demand	Anodyne	CACNA1I	65	37
O=S(=O)(N[C@@H]1CCCC[C@H]1O)c1ccc(F)c(C(F)F)c1	ZINC000872478304	DE	On-Demand	Anodyne	LEF	22	40
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	ADRA1D	27	40
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	ADRA1A	19	40
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	ADRA1B	21	40
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	F13A1	19	46
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	CCR8	93	44
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	SFRP1	126	39
CCOC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478318	FE	On-Demand	Anodyne	WNT3	86	39
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	ADRA1D	27	40
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	ADRA1A	19	40
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	ADRA1B	21	40
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	F13A1	19	46
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	CCR8	93	44
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	SFRP1	126	39
CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872478319	FE	On-Demand	Anodyne	WNT3	86	39
COC(=O)[C@H]1C[C@H](C)CCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478332	GD	On-Demand	Anodyne	MMP1	25	43
COC(=O)[C@@H]1C[C@@H](C)CCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478333	GD	On-Demand	Anodyne	MMP1	25	43
COC(=O)[C@H]1C[C@@H](C)CCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478334	GD	On-Demand	Anodyne	MMP1	25	43
COC(=O)[C@@H]1C[C@H](C)CCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478335	GD	On-Demand	Anodyne	MMP1	25	43
O=C(NC[C@H]1CCCN(c2ccncc2C2CC2)C1)c1ccccc1	ZINC000872478343	EH	On-Demand	Anodyne	PIM1	19	40
O=C(NC[C@H]1CCCN(c2ccncc2C2CC2)C1)c1ccccc1	ZINC000872478343	EH	On-Demand	Anodyne	PREP	26	42
O=C(NC[C@H]1CCCN(c2ccncc2C2CC2)C1)c1ccccc1	ZINC000872478343	EH	On-Demand	Anodyne	PIM3	15	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2nnc(O)cc2C1	ZINC000872478344	FE	On-Demand	Anodyne	AKR1C3	59	40
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](CO)C2)c(C#N)c1	ZINC000872478379	DC	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](CO)C2)c(C#N)c1	ZINC000872478380	DC	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](CO)C2)c(C#N)c1	ZINC000872478381	DC	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](CO)O[C@H](C)C2)c(C#N)c1	ZINC000872478382	DC	On-Demand	Mild	TRPV4	43	35
C=CCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478437	EF	On-Demand	Mild	PKM	24	40
CO[C@@H]1CCN(c2ncc(Br)c(N3CC[C@@H](OC)C3)n2)C1	ZINC000872478441	FD	On-Demand	Anodyne	PDE3B	43	34
O=C(NC[C@H]1CCCN(c2ccnc3ncccc23)C1)c1ccccc1	ZINC000872478455	EG	On-Demand	Anodyne	DRD2	15	41
O=C(NC[C@H]1CCCN(c2ccnc3ncccc23)C1)c1ccccc1	ZINC000872478455	EG	On-Demand	Anodyne	DRD3	18	40
O=C(NC[C@H]1CCCN(c2ccnc3ncccc23)C1)c1ccccc1	ZINC000872478455	EG	On-Demand	Anodyne	PREP	29	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000872478466	GF	On-Demand	Mild	TRPV4	47	41
Nc1nc(NCCCOC2CCN(Cc3ccccc3)CC2)nc(C(F)F)n1	ZINC000872478474	GF	On-Demand	Anodyne	SIGMAR1	22	51
CN(C)CCCOC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872478489	ED	On-Demand	Anodyne	SCD1	20	42
Cn1ncc2c(NCCCNC(=O)C3CCC3)nc(Cl)nc21	ZINC000872478520	DD	On-Demand	Anodyne	IKBKE	45	49
Cn1ncc2c(NCCCNC(=O)C3CCC3)nc(Cl)nc21	ZINC000872478520	DD	On-Demand	Anodyne	MARK3	26	49
Cn1ncc2c(NCCCNC(=O)C3CCC3)nc(Cl)nc21	ZINC000872478520	DD	On-Demand	Anodyne	TBK1	102	49
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOC2(CCOCC2)CC1	ZINC000872478522	GF	On-Demand	Anodyne	PKM	47	40
O=C(NCCCNc1ccnc2ncccc12)C1CCC1	ZINC000872478524	CE	On-Demand	Anodyne	HRP1_PLAFA	53	48
O=C(NCCCNc1ccnc2ncccc12)C1CCC1	ZINC000872478524	CE	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCCNc1ccnc2ncccc12)C1CCC1	ZINC000872478524	CE	On-Demand	Anodyne	HNMT	55	41
O=C(NCCCNc1ccnc2ncccc12)C1CCC1	ZINC000872478524	CE	On-Demand	Anodyne	IKBKE	43	39
O=C(NCCCNc1ccnc2ncccc12)C1CCC1	ZINC000872478524	CE	On-Demand	Anodyne	TBK1	93	41
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478527	FE	On-Demand	Anodyne	MMP13	24	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478527	FE	On-Demand	Anodyne	MMP3	24	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478527	FE	On-Demand	Anodyne	MMP7	37	44
CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478527	FE	On-Demand	Anodyne	MMP1	29	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478528	FE	On-Demand	Anodyne	MMP13	24	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478528	FE	On-Demand	Anodyne	MMP3	24	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478528	FE	On-Demand	Anodyne	MMP7	37	44
CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872478528	FE	On-Demand	Anodyne	MMP1	29	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCCN(c2ncccc2F)CC1	ZINC000872478559	FE	On-Demand	Mild	PKM	19	40
CO[C@@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478568	ED	On-Demand	Anodyne	PKM	41	49
CC(C)(C)OC(=O)NCCCOC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872478619	GF	On-Demand	Anodyne	SIRT3	34	42
CC(C)(C)OC(=O)NCCCOC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872478619	GF	On-Demand	Anodyne	SIRT2	30	42
CC(C)(C)OC(=O)NCCCOC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872478619	GF	On-Demand	Anodyne	SIRT1	30	42
COC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872478620	FD	On-Demand	Anodyne	PKM	42	39
COC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872478620	FD	On-Demand	Anodyne	F13A1	41	36
COc1ccc(OC)c2sc(N3CC[C@@H](OC)C3)nc12	ZINC000872478623	CF	On-Demand	Anodyne	PDE3B	45	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3[C@H]4CCC[C@H]43)cc2N1	ZINC000872478636	FF	On-Demand	Anodyne	PKM	41	51
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3[C@H]4CCC[C@H]43)cc2N1	ZINC000872478637	FF	On-Demand	Anodyne	PKM	41	51
O=S(=O)(NCC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872478660	FF	On-Demand	Anodyne	ADRA1D	27	43
O=S(=O)(NCC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872478660	FF	On-Demand	Anodyne	ADRA1A	19	43
O=S(=O)(NCC1CCN(C2CC2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872478660	FF	On-Demand	Anodyne	ADRA1B	21	43
O=C(CCc1ccccc1)N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872478677	EE	On-Demand	Anodyne	GRIN2B	27	44
O=C(CCc1ccccc1)N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872478677	EE	On-Demand	Anodyne	C3AR1	41	40
O=C(CCc1ccccc1)N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872478678	EE	On-Demand	Anodyne	GRIN2B	27	44
O=C(CCc1ccccc1)N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872478678	EE	On-Demand	Anodyne	C3AR1	41	40
C#C[C@H](CC)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872478679	CD	On-Demand	Mild	NR3C2	15	40
C#C[C@@H](CC)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872478680	CD	On-Demand	Mild	NR3C2	15	40
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc2ncccc12	ZINC000872478685	FE	On-Demand	Anodyne	CACNA1C	104	40
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc2ncccc12	ZINC000872478685	FE	On-Demand	Anodyne	CACNA1D	80	39
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc2ncccc12	ZINC000872478686	FE	On-Demand	Anodyne	CACNA1C	104	40
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc2ncccc12	ZINC000872478686	FE	On-Demand	Anodyne	CACNA1D	80	39
COc1ccc(OC)c2sc(N[C@H](C)CCCO)nc12	ZINC000872478702	CF	On-Demand	Anodyne	ADORA2B	15	43
COc1ccc(OC)c2sc(N[C@@H](C)CCCO)nc12	ZINC000872478704	CF	On-Demand	Anodyne	ADORA2B	15	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC3CC(O)C3)cc2N1	ZINC000872478708	FE	On-Demand	Anodyne	PKM	36	45
C[C@@H]1CN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCO1	ZINC000872478710	GF	On-Demand	Anodyne	HTR2A	16	42
C[C@@H]1CN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCO1	ZINC000872478710	GF	On-Demand	Anodyne	HTR7	39	42
C[C@@H]1CN(CCCNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CCCO1	ZINC000872478710	GF	On-Demand	Anodyne	HTR6	17	42
Cn1ncc2c(N[C@H]3CCN(C(=O)CCc4ccccc4)C3)nc(Cl)nc21	ZINC000872478715	GF	On-Demand	Anodyne	C3AR1	40	38
Cn1ncc2c(N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)nc(Cl)nc21	ZINC000872478717	GF	On-Demand	Anodyne	C3AR1	40	38
C#C[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478722	CE	On-Demand	Mild	LEF	36	42
C#C[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478723	CE	On-Demand	Mild	LEF	36	42
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478729	EE	On-Demand	Bother	CACNA1C	58	49
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478729	EE	On-Demand	Bother	CACNA1D	87	49
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478729	EE	On-Demand	Bother	SLC27A4	52	35
C[C@@H]1CN(C2CCOCC2)CCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872478734	GF	On-Demand	Anodyne	HSD11B1	19	43
COC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478736	EE	On-Demand	Bother	CACNA1C	58	49
COC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478736	EE	On-Demand	Bother	CACNA1D	87	49
COC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478736	EE	On-Demand	Bother	SLC27A4	52	35
COC(=O)C1=C(C)NC(=S)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872478741	FD	On-Demand	Anodyne	CACNA1C	44	34
COC(=O)C1=C(C)NC(=S)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872478741	FD	On-Demand	Anodyne	PROKR1	43	30
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872478743	FD	On-Demand	Anodyne	CACNA1C	44	34
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872478743	FD	On-Demand	Anodyne	PROKR1	43	30
C[C@@H]1COCC[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478795	FE	On-Demand	Anodyne	PKM	32	44
C[C@@H]1COCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478796	FE	On-Demand	Anodyne	PKM	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC34CCOCC4)cc2N1	ZINC000872478804	GF	On-Demand	Anodyne	PKM	15	40
O=S(=O)(NC1CCN(c2cccnn2)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872478805	GF	On-Demand	Anodyne	SFRP1	65	35
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCS1	ZINC000872478830	EG	On-Demand	Anodyne	PKM	40	37
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CCS1	ZINC000872478831	EG	On-Demand	Anodyne	PKM	40	37
CCCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)N(C)C)cc1C	ZINC000872478863	EE	On-Demand	Anodyne	PPARG	15	47
CCCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)N(C)C)cc1C	ZINC000872478863	EE	On-Demand	Anodyne	SLC27A4	87	40
CCCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)N(C)C)cc1C	ZINC000872478864	EE	On-Demand	Anodyne	PPARG	15	47
CCCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)N(C)C)cc1C	ZINC000872478864	EE	On-Demand	Anodyne	SLC27A4	87	40
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478865	FD	On-Demand	Anodyne	TSHR	49	33
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478865	FD	On-Demand	Anodyne	CACNA1C	61	34
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478865	FD	On-Demand	Anodyne	CACNA1D	69	34
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478865	FD	On-Demand	Anodyne	SLC27A4	85	39
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478866	FD	On-Demand	Anodyne	TSHR	49	33
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478866	FD	On-Demand	Anodyne	CACNA1C	61	34
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478866	FD	On-Demand	Anodyne	CACNA1D	69	34
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872478866	FD	On-Demand	Anodyne	SLC27A4	85	39
Cc1cccc(C#N)c1S(=O)(=O)N1CCc2ccnc(O)c2C1	ZINC000872478895	ED	On-Demand	Mild	AKR1C3	51	39
Cc1ccc(S(=O)(=O)N2C[C@@H]3CN(C)C[C@@H]3C2)c(C#N)c1	ZINC000872478904	DD	On-Demand	Mild	TRPV4	44	37
N#CCN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872478924	DF	On-Demand	Mild	GRIN2B	17	40
N#CCN1CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872478924	DF	On-Demand	Mild	VCP	62	38
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478939	EF	On-Demand	Bother	CACNA1C	83	42
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478939	EF	On-Demand	Bother	CACNA1D	98	42
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478939	EF	On-Demand	Bother	SLC27A4	58	39
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478941	EF	On-Demand	Bother	CACNA1C	83	42
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478941	EF	On-Demand	Bother	CACNA1D	98	42
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(C)ccc([N+](=O)[O-])c1C	ZINC000872478941	EF	On-Demand	Bother	SLC27A4	58	39
C#C[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478993	ED	On-Demand	Mild	PKM	39	48
C#C[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872478994	ED	On-Demand	Mild	PKM	39	48
O=C(CCc1ccccc1)N1CC[C@@H](N=c2cc[nH]cc2C2CC2)C1	ZINC000872479006	EG	On-Demand	Anodyne	GRIN2B	15	40
O=C(CCc1ccccc1)N1CC[C@H](N=c2cc[nH]cc2C2CC2)C1	ZINC000872479007	EG	On-Demand	Anodyne	GRIN2B	15	40
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479014	FE	On-Demand	Anodyne	TSHR	43	32
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479014	FE	On-Demand	Anodyne	CACNA1C	57	39
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479014	FE	On-Demand	Anodyne	CACNA1D	54	36
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479014	FE	On-Demand	Anodyne	SLC27A4	87	41
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479015	FE	On-Demand	Anodyne	TSHR	43	32
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479015	FE	On-Demand	Anodyne	CACNA1C	57	39
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479015	FE	On-Demand	Anodyne	CACNA1D	54	36
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479015	FE	On-Demand	Anodyne	SLC27A4	87	41
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	HTR1A	46	40
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	DRD2	42	40
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	ADRA1D	51	36
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	ADRA1A	43	36
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	DRD3	45	40
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	PDE3A	41	38
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	PDE3B	44	38
COc1ccccc1N1CC[C@@H](Nc2ncnc(F)c2C)C1	ZINC000872479016	DF	On-Demand	Anodyne	EHMT2	40	35
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	HTR1A	46	40
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	DRD2	42	40
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	ADRA1D	51	36
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	ADRA1A	43	36
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	DRD3	45	40
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	PDE3A	41	38
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	PDE3B	44	38
COc1ccccc1N1CC[C@H](Nc2ncnc(F)c2C)C1	ZINC000872479020	DF	On-Demand	Anodyne	EHMT2	40	35
C[C@@H]1COCC[C@@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872479057	DE	On-Demand	Anodyne	LEF	16	42
C[C@@H]1COCC[C@H]1NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872479058	DE	On-Demand	Anodyne	LEF	16	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCO)cc2N1	ZINC000872479070	ED	On-Demand	Anodyne	PKM	40	48
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479078	FD	On-Demand	Anodyne	CACNA1C	105	41
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479078	FD	On-Demand	Anodyne	CACNA1D	88	41
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479078	FD	On-Demand	Anodyne	SLC27A4	69	34
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479080	FD	On-Demand	Anodyne	CACNA1C	105	41
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479080	FD	On-Demand	Anodyne	CACNA1D	88	41
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479080	FD	On-Demand	Anodyne	SLC27A4	69	34
COc1ccccc1N1CC[C@@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479087	EE	On-Demand	Anodyne	HTR1A	35	41
COc1ccccc1N1CC[C@@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479087	EE	On-Demand	Anodyne	DRD2	32	41
COc1ccccc1N1CC[C@@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479087	EE	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479087	EE	On-Demand	Anodyne	DRD3	31	41
COc1ccccc1N1CC[C@@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479087	EE	On-Demand	Anodyne	HRH4	43	35
COc1ccccc1N1CC[C@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479088	EE	On-Demand	Anodyne	HTR1A	35	41
COc1ccccc1N1CC[C@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479088	EE	On-Demand	Anodyne	DRD2	32	41
COc1ccccc1N1CC[C@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479088	EE	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479088	EE	On-Demand	Anodyne	DRD3	31	41
COc1ccccc1N1CC[C@H](Nc2nc(N)nc(C(F)F)n2)C1	ZINC000872479088	EE	On-Demand	Anodyne	HRH4	43	35
N#CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479100	ED	On-Demand	Mild	PKM	38	48
COc1ccccc1N1CC[C@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479108	EF	On-Demand	Anodyne	HTR1A	46	40
COc1ccccc1N1CC[C@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479108	EF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479108	EF	On-Demand	Anodyne	ADRA1A	33	40
COc1ccccc1N1CC[C@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479108	EF	On-Demand	Anodyne	ADRA1B	29	40
COc1ccccc1N1CC[C@@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479109	EF	On-Demand	Anodyne	HTR1A	46	40
COc1ccccc1N1CC[C@@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479109	EF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479109	EF	On-Demand	Anodyne	ADRA1A	33	40
COc1ccccc1N1CC[C@@H](Nc2cc(C)nc3c2cnn3C)C1	ZINC000872479109	EF	On-Demand	Anodyne	ADRA1B	29	40
c1cnc2nccc(NCCCO[C@@H]3CCOC3)c2c1	ZINC000872479115	CE	On-Demand	Anodyne	HNMT	50	36
c1cnc2nccc(NCCCO[C@H]3CCOC3)c2c1	ZINC000872479118	CE	On-Demand	Anodyne	HNMT	50	36
O=C(N[C@@H]1CCCN(c2cc(Cl)nnc2O)C1)c1cc2ccccc2o1	ZINC000872479151	FF	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1cc2ccccc2o1	ZINC000872479154	FF	On-Demand	Anodyne	DRD4	15	41
Cc1c(F)ncnc1N[C@H]1CCN(c2ncccc2F)C1	ZINC000872479191	CE	On-Demand	Anodyne	PRKCQ	40	31
Cc1c(F)ncnc1N[C@@H]1CCN(c2ncccc2F)C1	ZINC000872479194	CE	On-Demand	Anodyne	PRKCQ	40	31
CC[C@@H]1CCC[C@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872479198	CE	On-Demand	Anodyne	SYK	47	39
CC[C@H]1CCC[C@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872479199	CE	On-Demand	Anodyne	SYK	47	39
CC[C@@H]1CCC[C@@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872479200	CE	On-Demand	Anodyne	SYK	47	39
CC[C@H]1CCC[C@@H]1Nc1cc(C(N)=O)nc(Cl)n1	ZINC000872479201	CE	On-Demand	Anodyne	SYK	47	39
Nc1nc(C(F)F)nc(N2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000872479223	GF	On-Demand	Anodyne	DRD4	16	45
Nc1nc(C(F)F)nc(N2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000872479224	GF	On-Demand	Anodyne	DRD4	16	45
CN1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872479233	GD	On-Demand	Anodyne	PKM	32	45
CC(=O)N(C[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872479262	GF	On-Demand	Anodyne	CASP3	95	40
CC(=O)N(C[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872479262	GF	On-Demand	Anodyne	CASP7	102	42
Nc1nc(N[C@@H]2CCN(c3ncccc3Cl)C2)nc(C(F)F)n1	ZINC000872479265	EE	On-Demand	Anodyne	HRH4	47	37
Nc1nc(N[C@H]2CCN(c3ncccc3Cl)C2)nc(C(F)F)n1	ZINC000872479266	EE	On-Demand	Anodyne	HRH4	47	37
COc1ccccc1N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479294	DF	On-Demand	Anodyne	HTR1A	47	39
COc1ccccc1N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479294	DF	On-Demand	Anodyne	DRD2	46	39
COc1ccccc1N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479294	DF	On-Demand	Anodyne	ADRA1D	42	37
COc1ccccc1N1CC[C@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479294	DF	On-Demand	Anodyne	DRD3	49	39
COc1ccccc1N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479295	DF	On-Demand	Anodyne	HTR1A	47	39
COc1ccccc1N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479295	DF	On-Demand	Anodyne	DRD2	46	39
COc1ccccc1N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479295	DF	On-Demand	Anodyne	ADRA1D	42	37
COc1ccccc1N1CC[C@@H](Nc2cc(Cl)nnc2O)C1	ZINC000872479295	DF	On-Demand	Anodyne	DRD3	49	39
CC(=O)N(C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872479303	GF	On-Demand	Anodyne	CASP3	95	40
CC(=O)N(C[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872479303	GF	On-Demand	Anodyne	CASP7	102	42
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[S@]1=O	ZINC000872479358	FE	On-Demand	Anodyne	PKM	40	37
CS(=O)(=O)N[C@H]1CCC[C@@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872479359	EE	On-Demand	Anodyne	VCP	40	37
C[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[S@@]1=O	ZINC000872479360	FE	On-Demand	Anodyne	PKM	40	37
CS(=O)(=O)N[C@H]1CCC[C@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872479361	EE	On-Demand	Anodyne	VCP	40	37
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[S@@]1=O	ZINC000872479362	FE	On-Demand	Anodyne	PKM	40	37
C[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC[S@]1=O	ZINC000872479363	FE	On-Demand	Anodyne	PKM	40	37
CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872479364	EE	On-Demand	Anodyne	VCP	40	37
CS(=O)(=O)N[C@@H]1CCC[C@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872479366	EE	On-Demand	Anodyne	VCP	40	37
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479372	EE	On-Demand	Bother	CACNA1C	116	50
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479372	EE	On-Demand	Bother	CACNA1D	121	51
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479372	EE	On-Demand	Bother	SLC27A4	58	39
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479374	EE	On-Demand	Bother	CACNA1C	116	50
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479374	EE	On-Demand	Bother	CACNA1D	121	51
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872479374	EE	On-Demand	Bother	SLC27A4	58	39
COC(=O)CCCSc1cc(-c2ccccc2)ncn1	ZINC000872479394	CG	On-Demand	Anodyne	LTB4R	25	49
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479395	ED	On-Demand	Anodyne	CACNA1C	73	40
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479395	ED	On-Demand	Anodyne	CACNA1D	56	40
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2nccnc2c1	ZINC000872479395	ED	On-Demand	Anodyne	SLC27A4	79	36
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479397	ED	On-Demand	Anodyne	CACNA1C	73	40
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479397	ED	On-Demand	Anodyne	CACNA1D	56	40
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479397	ED	On-Demand	Anodyne	SLC27A4	79	36
C[C@@H](O)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479420	FE	On-Demand	Anodyne	PKM	40	48
C#C[C@H](CC)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872479425	CE	On-Demand	Mild	LEF	32	43
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479426	GE	On-Demand	Anodyne	CACNA1C	49	37
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479426	GE	On-Demand	Anodyne	CACNA1D	51	35
C#C[C@@H](CC)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872479427	CE	On-Demand	Mild	LEF	32	43
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479428	GE	On-Demand	Anodyne	CACNA1C	49	37
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479428	GE	On-Demand	Anodyne	CACNA1D	51	35
Nc1nc(N[C@@H]2CCN(c3ncccc3F)C2)nc(C(F)F)n1	ZINC000872479430	ED	On-Demand	Anodyne	HRH4	49	36
Nc1nc(N[C@@H]2CCN(c3ncccc3F)C2)nc(C(F)F)n1	ZINC000872479430	ED	On-Demand	Anodyne	PRKCQ	40	30
Nc1nc(N[C@H]2CCN(c3ncccc3F)C2)nc(C(F)F)n1	ZINC000872479433	ED	On-Demand	Anodyne	HRH4	49	36
Nc1nc(N[C@H]2CCN(c3ncccc3F)C2)nc(C(F)F)n1	ZINC000872479433	ED	On-Demand	Anodyne	PRKCQ	40	30
Oc1nnc(Cl)cc1N[C@@H]1CCN(c2ncccc2F)C1	ZINC000872479436	DE	On-Demand	Anodyne	PRKCQ	42	33
Oc1nnc(Cl)cc1N[C@H]1CCN(c2ncccc2F)C1	ZINC000872479437	DE	On-Demand	Anodyne	PRKCQ	42	33
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2ccnc(O)c2C1	ZINC000872479438	FF	On-Demand	Anodyne	AKR1C3	60	40
COc1ccc(OC(F)F)c(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872479448	EF	On-Demand	Anodyne	DHFR	31	48
COc1ccc(OC(F)F)c(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872479448	EF	On-Demand	Anodyne	DRTS_TOXGO	53	48
COc1ccc(OC(F)F)c(CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872479448	EF	On-Demand	Anodyne	DYR_PNECA	40	48
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479451	FD	On-Demand	Anodyne	TSHR	41	30
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479451	FD	On-Demand	Anodyne	CACNA1C	54	34
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479451	FD	On-Demand	Anodyne	CACNA1D	62	33
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479452	FD	On-Demand	Anodyne	TSHR	41	30
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479452	FD	On-Demand	Anodyne	CACNA1C	54	34
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cn2cccn2)c1	ZINC000872479452	FD	On-Demand	Anodyne	CACNA1D	62	33
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479458	EF	On-Demand	Anodyne	CACNA1C	90	53
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479458	EF	On-Demand	Anodyne	CACNA1D	69	53
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479458	EF	On-Demand	Anodyne	SLC27A4	66	32
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cccc1OCC	ZINC000872479459	EF	On-Demand	Anodyne	CACNA1C	90	53
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cccc1OCC	ZINC000872479459	EF	On-Demand	Anodyne	CACNA1D	69	53
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cccc1OCC	ZINC000872479459	EF	On-Demand	Anodyne	SLC27A4	66	32
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[S@](=O)CC2)c(C#N)c1	ZINC000872479489	ED	On-Demand	Mild	EPHX2	23	44
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[S@](=O)CC2)c(C#N)c1	ZINC000872479489	ED	On-Demand	Mild	TRPV4	42	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[S@](=O)CC2)c(C#N)c1	ZINC000872479490	ED	On-Demand	Mild	EPHX2	23	44
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[S@](=O)CC2)c(C#N)c1	ZINC000872479490	ED	On-Demand	Mild	TRPV4	42	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[S@@](=O)CC2)c(C#N)c1	ZINC000872479491	ED	On-Demand	Mild	EPHX2	23	44
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)[S@@](=O)CC2)c(C#N)c1	ZINC000872479491	ED	On-Demand	Mild	TRPV4	42	36
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[S@@](=O)CC2)c(C#N)c1	ZINC000872479492	ED	On-Demand	Mild	EPHX2	23	44
Cc1ccc(S(=O)(=O)N2CC[C@H](C)[S@@](=O)CC2)c(C#N)c1	ZINC000872479492	ED	On-Demand	Mild	TRPV4	42	36
N#CCN1CCC(CNc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872479501	EG	On-Demand	Mild	VCP	27	42
CC(=O)N(C[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N)C1CC1	ZINC000872479507	FE	On-Demand	Mild	CASP3	40	38
CC(=O)N(C[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N)C1CC1	ZINC000872479507	FE	On-Demand	Mild	CASP7	47	38
CC(=O)N(C[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N)C1CC1	ZINC000872479508	FE	On-Demand	Mild	CASP3	40	38
CC(=O)N(C[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1C#N)C1CC1	ZINC000872479508	FE	On-Demand	Mild	CASP7	47	38
C#C[C@H](C)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479541	EE	On-Demand	Mild	PKM	31	41
C#C[C@@H](C)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479543	EE	On-Demand	Mild	PKM	31	41
OC[C@H]1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872479550	CG	On-Demand	Anodyne	VCP	60	38
NC(=O)c1cc(N[C@@H]2CCN(c3ncccc3Cl)C2)nc(Cl)n1	ZINC000872479558	FD	On-Demand	Anodyne	PRKD1	54	36
NC(=O)c1cc(N[C@H]2CCN(c3ncccc3Cl)C2)nc(Cl)n1	ZINC000872479560	FD	On-Demand	Anodyne	PRKD1	54	36
Cc1ccc(S(=O)(=O)N2CCN(c3nc(F)c(F)cc3F)CC2)c(C#N)c1	ZINC000872479561	GE	On-Demand	Mild	TRPV4	46	39
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872479573	DD	On-Demand	Anodyne	CACNA1C	83	43
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872479573	DD	On-Demand	Anodyne	CACNA1D	63	43
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872479573	DD	On-Demand	Anodyne	TGFBR2	44	40
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2nccnc2c1	ZINC000872479573	DD	On-Demand	Anodyne	SLC27A4	106	48
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479574	DD	On-Demand	Anodyne	CACNA1C	83	43
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479574	DD	On-Demand	Anodyne	CACNA1D	63	43
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479574	DD	On-Demand	Anodyne	TGFBR2	44	40
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2nccnc2c1	ZINC000872479574	DD	On-Demand	Anodyne	SLC27A4	106	48
COc1cc(C)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872479578	CE	On-Demand	Anodyne	DHFR	32	44
COc1cc(C)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872479578	CE	On-Demand	Anodyne	FOLA	16	43
COc1cc(C)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872479578	CE	On-Demand	Anodyne	DRTS_TOXGO	48	44
COc1cc(C)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872479578	CE	On-Demand	Anodyne	DYR_PNECA	35	44
COc1cc(C)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872479578	CE	On-Demand	Anodyne	DRTS_TRYCR	40	43
CCC1=C(C(=O)OC)[C@H](c2c(C)ccc([N+](=O)[O-])c2C)NC(=S)N1	ZINC000872479615	EF	On-Demand	Bother	CACNA1C	43	39
CCC1=C(C(=O)OC)[C@H](c2c(C)ccc([N+](=O)[O-])c2C)NC(=S)N1	ZINC000872479615	EF	On-Demand	Bother	CACNA1D	73	39
CCC1=C(C(=O)OC)[C@@H](c2c(C)ccc([N+](=O)[O-])c2C)NC(=S)N1	ZINC000872479616	EF	On-Demand	Bother	CACNA1C	43	39
CCC1=C(C(=O)OC)[C@@H](c2c(C)ccc([N+](=O)[O-])c2C)NC(=S)N1	ZINC000872479616	EF	On-Demand	Bother	CACNA1D	73	39
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479627	DE	On-Demand	Anodyne	CACNA1C	100	55
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479627	DE	On-Demand	Anodyne	CACNA1D	76	55
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cccc1OCC	ZINC000872479627	DE	On-Demand	Anodyne	SLC27A4	92	42
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cccc1OCC	ZINC000872479628	DE	On-Demand	Anodyne	CACNA1C	100	55
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cccc1OCC	ZINC000872479628	DE	On-Demand	Anodyne	CACNA1D	76	55
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cccc1OCC	ZINC000872479628	DE	On-Demand	Anodyne	SLC27A4	92	42
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc2ncccc12	ZINC000872479630	EE	On-Demand	Anodyne	CACNA1C	110	41
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc2ncccc12	ZINC000872479630	EE	On-Demand	Anodyne	CACNA1D	83	41
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc2ncccc12	ZINC000872479630	EE	On-Demand	Anodyne	SLC27A4	78	36
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc2ncccc12	ZINC000872479631	EE	On-Demand	Anodyne	CACNA1C	110	41
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc2ncccc12	ZINC000872479631	EE	On-Demand	Anodyne	CACNA1D	83	41
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc2ncccc12	ZINC000872479631	EE	On-Demand	Anodyne	SLC27A4	78	36
COC1(CO)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872479632	DD	On-Demand	Mild	TRPV4	53	45
CN(C)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872479648	FF	On-Demand	Anodyne	PKM	46	39
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCc2cc(O)ccc2C1	ZINC000872479662	EE	On-Demand	Mild	STS	30	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCc2cc(O)ccc2C1	ZINC000872479662	EE	On-Demand	Mild	MTTP	15	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCc2cc(O)ccc2C1	ZINC000872479663	EE	On-Demand	Mild	STS	30	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCc2cc(O)ccc2C1	ZINC000872479663	EE	On-Demand	Mild	MTTP	15	40
Cn1ncc2c(N[C@@H]3CCN(c4ncccc4F)C3)nc(Cl)nc21	ZINC000872479665	EE	On-Demand	Anodyne	PRKCQ	40	32
Cn1ncc2c(N[C@H]3CCN(c4ncccc4F)C3)nc(Cl)nc21	ZINC000872479666	EE	On-Demand	Anodyne	PRKCQ	40	32
CCOC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872479682	EG	On-Demand	Anodyne	LEF	36	41
C[C@@H]1CN(CCCCNc2ccnc3ncccc23)C[C@@H](C)O1	ZINC000872479692	DF	On-Demand	Anodyne	HRP1_PLAFA	91	37
C[C@@H]1CN(CCCCNc2ccnc3ncccc23)C[C@@H](C)O1	ZINC000872479692	DF	On-Demand	Anodyne	HNMT	79	48
C[C@@H](O)CCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872479724	DE	On-Demand	Anodyne	LEF	32	43
CN1C[C@H]2CN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)C[C@H]2C1	ZINC000872479731	GD	On-Demand	Anodyne	PKM	34	43
NC(=O)c1cc(N[C@@H]2CCN(c3ncccc3F)C2)nc(Cl)n1	ZINC000872479790	ED	On-Demand	Anodyne	PRKD1	40	33
NC(=O)c1cc(N[C@@H]2CCN(c3ncccc3F)C2)nc(Cl)n1	ZINC000872479790	ED	On-Demand	Anodyne	PRKCQ	41	33
NC(=O)c1cc(N[C@H]2CCN(c3ncccc3F)C2)nc(Cl)n1	ZINC000872479792	ED	On-Demand	Anodyne	PRKD1	40	33
NC(=O)c1cc(N[C@H]2CCN(c3ncccc3F)C2)nc(Cl)n1	ZINC000872479792	ED	On-Demand	Anodyne	PRKCQ	41	33
CCOC(=O)C1=C(C(C)=O)[C@@H](c2c(F)cccc2OCC)NC(=S)N1	ZINC000872479794	FE	On-Demand	Mild	CACNA1D	16	42
CCOC(=O)C1=C(C(C)=O)[C@H](c2c(F)cccc2OCC)NC(=S)N1	ZINC000872479797	FE	On-Demand	Mild	CACNA1D	16	42
CCN(C)C(=O)[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479848	GD	On-Demand	Anodyne	PKM	36	43
CCN(C)C(=O)[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872479850	GD	On-Demand	Anodyne	PKM	36	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)CC(F)F)cc2N1	ZINC000872479954	GD	On-Demand	Anodyne	PKM	38	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)CC(F)F)cc2N1	ZINC000872479955	GD	On-Demand	Anodyne	PKM	38	43
CN(C)[C@@H]1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872479957	GF	On-Demand	Anodyne	PKM	23	41
O=S(=O)(N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872479958	GF	On-Demand	Anodyne	PTPN2	46	37
O=S(=O)(N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872479958	GF	On-Demand	Anodyne	SFRP1	97	35
O=S(=O)(N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1)C(F)(F)F	ZINC000872479958	GF	On-Demand	Anodyne	WNT3	50	31
CCOC(=O)C1=C(C(=O)C(C)C)[C@H](c2ccc3nccnc3c2)NC(=S)N1	ZINC000872479968	GE	On-Demand	Mild	SLC27A4	47	32
CCOC(=O)C1=C(C(=O)C(C)C)[C@@H](c2ccc3nccnc3c2)NC(=S)N1	ZINC000872479969	GE	On-Demand	Mild	SLC27A4	47	32
O=C(N[C@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccc2ccccc2c1	ZINC000872479975	GG	On-Demand	Anodyne	DRD4	20	47
O=C(N[C@@H]1CCCN(c2cc(Cl)nnc2O)C1)c1ccc2ccccc2c1	ZINC000872479976	GG	On-Demand	Anodyne	DRD4	20	47
Cc1ccc(S(=O)(=O)N2CC[C@@H](C)S(=O)(=O)CC2)c(C#N)c1	ZINC000872480004	ED	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C)S(=O)(=O)CC2)c(C#N)c1	ZINC000872480006	ED	On-Demand	Mild	EPHX2	15	41
CO[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C[C@H]1OC	ZINC000872480009	GD	On-Demand	Anodyne	PKM	27	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000872480027	GG	On-Demand	Mild	CCR1	15	47
O=S(=O)(C1CC1)N1CCC(Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872480097	FF	On-Demand	Anodyne	PTPN2	45	35
Cc1cccc(C#N)c1S(=O)(=O)N1CC(O)(C(C)C)C1	ZINC000872480107	CD	On-Demand	Mild	TRPV4	41	32
CC[C@H]1CCN(c2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480154	CD	On-Demand	Anodyne	SIRT3	44	32
CSC1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872480186	FF	On-Demand	Anodyne	PKM	41	50
O=C(CCc1ccccc1)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480221	EG	On-Demand	Anodyne	GRIN2B	22	51
O=C(CCc1ccccc1)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480221	EG	On-Demand	Anodyne	C3AR1	46	44
O=C(CCc1ccccc1)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480221	EG	On-Demand	Anodyne	CCR8	54	38
O=C(CCc1ccccc1)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480222	EG	On-Demand	Anodyne	GRIN2B	22	51
O=C(CCc1ccccc1)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480222	EG	On-Demand	Anodyne	C3AR1	46	44
O=C(CCc1ccccc1)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480222	EG	On-Demand	Anodyne	CCR8	54	38
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480261	DD	On-Demand	Bother	CACNA1C	90	61
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480261	DD	On-Demand	Bother	CACNA1D	120	61
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480261	DD	On-Demand	Bother	SLC27A4	52	35
COC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480262	DD	On-Demand	Bother	CACNA1C	90	61
COC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480262	DD	On-Demand	Bother	CACNA1D	120	61
COC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1C	ZINC000872480262	DD	On-Demand	Bother	SLC27A4	52	35
Cc1ccc(S(=O)(=O)N2CCc3ccnc(O)c3C2)c(C#N)c1	ZINC000872480269	ED	On-Demand	Mild	TRPV4	45	37
C[C@@H](C(=O)N1CCCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872480272	FE	On-Demand	Anodyne	P2RY12	45	34
C[C@@H](C(=O)N1CCCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872480272	FE	On-Demand	Anodyne	PRNP	50	40
C[C@H](C(=O)N1CCCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872480273	FE	On-Demand	Anodyne	P2RY12	45	34
C[C@H](C(=O)N1CCCC1)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872480273	FE	On-Demand	Anodyne	PRNP	50	40
CCOc1ccc([C@@H](C)NC(=O)CCCNc2cc(Cl)nnc2O)cc1	ZINC000872480337	GG	On-Demand	Anodyne	ACACA	17	41
CCOc1ccc([C@@H](C)NC(=O)CCCNc2cc(Cl)nnc2O)cc1	ZINC000872480337	GG	On-Demand	Anodyne	ACACB	20	42
C#CCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872480383	ED	On-Demand	Mild	PKM	30	41
O=C1[C@@H]2[C@@H](C(=O)N1CCNc1ccnc3ncccc13)[C@H]1C=C[C@H]2C1	ZINC000872480401	ED	On-Demand	Anodyne	HRP1_PLAFA	63	33
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNc1ccnc2ncccc12	ZINC000872480403	ED	On-Demand	Anodyne	HRP1_PLAFA	63	33
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNc1ccnc2ncccc12	ZINC000872480404	ED	On-Demand	Anodyne	HRP1_PLAFA	63	33
Nc1nc(N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872480473	FE	On-Demand	Anodyne	GRIN2B	21	44
Nc1nc(N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872480473	FE	On-Demand	Anodyne	C3AR1	41	41
CCN(C)C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872480474	ED	On-Demand	Anodyne	LEF	40	47
Nc1nc(N[C@H]2CCN(C(=O)CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872480475	FE	On-Demand	Anodyne	GRIN2B	21	44
Nc1nc(N[C@H]2CCN(C(=O)CCc3ccccc3)C2)nc(C(F)F)n1	ZINC000872480475	FE	On-Demand	Anodyne	C3AR1	41	41
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	HTR1A	59	39
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	DRD2	53	39
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	ADRA1D	57	38
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	ADRA1A	50	38
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	ADRA1B	45	38
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	DRD3	60	38
COc1ccccc1N1CC[C@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480490	ED	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	HTR1A	59	39
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	DRD2	53	39
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	ADRA1D	57	38
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	ADRA1A	50	38
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	ADRA1B	45	38
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	DRD3	60	38
COc1ccccc1N1CC[C@@H](Nc2cc(C(N)=O)nc(Cl)n2)C1	ZINC000872480491	ED	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872480517	FF	On-Demand	Anodyne	HTR1A	40	36
COc1ccccc1N1CC[C@@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872480517	FF	On-Demand	Anodyne	EHMT2	80	41
COc1ccccc1N1CC[C@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872480518	FF	On-Demand	Anodyne	HTR1A	40	36
COc1ccccc1N1CC[C@H](Nc2nc(Cl)nc3c2cnn3C)C1	ZINC000872480518	FF	On-Demand	Anodyne	EHMT2	80	41
Cc1c(F)ncnc1N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480527	EF	On-Demand	Anodyne	GRIN2B	22	46
Cc1c(F)ncnc1N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480527	EF	On-Demand	Anodyne	C3AR1	44	44
Cc1c(F)ncnc1N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480527	EF	On-Demand	Anodyne	MLNR	30	42
Cc1c(F)ncnc1N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480527	EF	On-Demand	Anodyne	BIRC2	24	40
Cc1c(F)ncnc1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480528	EF	On-Demand	Anodyne	GRIN2B	22	46
Cc1c(F)ncnc1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480528	EF	On-Demand	Anodyne	C3AR1	44	44
Cc1c(F)ncnc1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480528	EF	On-Demand	Anodyne	MLNR	30	42
Cc1c(F)ncnc1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000872480528	EF	On-Demand	Anodyne	BIRC2	24	40
CN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872480552	ED	On-Demand	Anodyne	ADRA1D	29	41
CN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872480552	ED	On-Demand	Anodyne	ADRA1A	21	41
CN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872480552	ED	On-Demand	Anodyne	ADRA1B	23	41
CN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1=O	ZINC000872480552	ED	On-Demand	Anodyne	SFRP1	40	32
CCC(=O)c1c(Cl)cccc1N[C@@H](C)CCCO	ZINC000872480554	CH	On-Demand	Anodyne	CXCL8	41	39
CCC(=O)c1c(Cl)cccc1N[C@H](C)CCCO	ZINC000872480555	CH	On-Demand	Anodyne	CXCL8	41	39
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872480608	GD	On-Demand	Anodyne	CACNA1C	66	35
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cn(Cc2ccc(OC)cc2)nn1	ZINC000872480609	GD	On-Demand	Anodyne	CACNA1C	66	35
Cc1ccc(S(=O)(=O)N2CCS[C@H](C)CC2)c(C#N)c1	ZINC000872480615	DE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CCS[C@H](C)CC2)c(C#N)c1	ZINC000872480615	DE	On-Demand	Mild	TRPV4	42	36
Cc1ccc(S(=O)(=O)N2CCS[C@@H](C)CC2)c(C#N)c1	ZINC000872480616	DE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CCS[C@@H](C)CC2)c(C#N)c1	ZINC000872480616	DE	On-Demand	Mild	TRPV4	42	36
N#CCN1CCC(CNc2cc(Cl)nnc2O)CC1	ZINC000872480623	CD	On-Demand	Mild	CACNA1I	42	33
CCN(C)C(=O)[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872480631	ED	On-Demand	Anodyne	LEF	40	47
COc1cc(CN2CC[C@@H](Nc3cc(Cl)nnc3O)C2)cc(OC)c1	ZINC000872480690	FF	On-Demand	Anodyne	SSTR5	55	35
COc1cc(CN2CC[C@@H](Nc3cc(Cl)nnc3O)C2)cc(OC)c1	ZINC000872480690	FF	On-Demand	Anodyne	MCHR1	17	44
COc1cc(CN2CC[C@H](Nc3cc(Cl)nnc3O)C2)cc(OC)c1	ZINC000872480691	FF	On-Demand	Anodyne	SSTR5	55	35
COc1cc(CN2CC[C@H](Nc3cc(Cl)nnc3O)C2)cc(OC)c1	ZINC000872480691	FF	On-Demand	Anodyne	MCHR1	17	44
C#C[C@H](CC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872480761	EE	On-Demand	Mild	PKM	38	46
C#C[C@@H](CC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872480762	EE	On-Demand	Mild	PKM	38	46
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	HTR1A	51	44
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	DRD2	37	46
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	DRD3	39	46
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	PDE3A	39	40
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	HTR7	35	46
COc1ccccc1N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872480777	DG	On-Demand	Anodyne	PDE3B	44	40
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	HTR1A	51	44
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	DRD2	37	46
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	DRD3	39	46
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	PDE3A	39	40
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	HTR7	35	46
COc1ccccc1N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872480778	DG	On-Demand	Anodyne	PDE3B	44	40
O=S(=O)(NCCCCO)c1ccc(F)c(C(F)F)c1	ZINC000872480781	CD	On-Demand	Anodyne	LEF	28	43
COCCO[C@@H]1C[C@@H](CO)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872480796	FC	On-Demand	Mild	TRPV4	42	35
COCCO[C@@H]1C[C@H](CO)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872480797	FC	On-Demand	Mild	TRPV4	42	35
COCCO[C@H]1C[C@H](CO)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872480798	FC	On-Demand	Mild	TRPV4	42	35
COCCO[C@H]1C[C@@H](CO)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872480799	FC	On-Demand	Mild	TRPV4	42	35
CO[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)C[C@H]1OC	ZINC000872480848	DC	On-Demand	Mild	TRPV4	45	38
COc1cc(CN2CC[C@H](Nc3ncnc(F)c3C)C2)cc(OC)c1	ZINC000872480868	EF	On-Demand	Anodyne	SSTR5	63	37
COc1cc(CN2CC[C@@H](Nc3ncnc(F)c3C)C2)cc(OC)c1	ZINC000872480869	EF	On-Demand	Anodyne	SSTR5	63	37
COCCOC1CN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872480881	CD	On-Demand	Anodyne	P2RY12	44	39
Cc1c(F)ncnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872480931	EG	On-Demand	Anodyne	LTA4H	55	47
Cc1c(F)ncnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872480931	EG	On-Demand	Anodyne	HRH3	40	39
Cc1c(F)ncnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872480931	EG	On-Demand	Anodyne	TNK2	31	41
Cc1c(F)ncnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872480931	EG	On-Demand	Anodyne	PSMB1	41	38
Nc1nc(N[C@@H]2CCN(c3c(F)cccc3F)C2)nc(C(F)F)n1	ZINC000872481025	EE	On-Demand	Anodyne	HRH4	44	36
Nc1nc(N[C@H]2CCN(c3c(F)cccc3F)C2)nc(C(F)F)n1	ZINC000872481026	EE	On-Demand	Anodyne	HRH4	44	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CC[C@@H](O)C3)cc2N1	ZINC000872481193	FE	On-Demand	Anodyne	PKM	33	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CC[C@H](O)C3)cc2N1	ZINC000872481194	FE	On-Demand	Anodyne	PKM	33	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CC[C@H](O)C3)cc2N1	ZINC000872481195	FE	On-Demand	Anodyne	PKM	33	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CC[C@@H](O)C3)cc2N1	ZINC000872481196	FE	On-Demand	Anodyne	PKM	33	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3[C@H]4COC[C@H]43)cc2N1	ZINC000872481262	FD	On-Demand	Anodyne	PKM	40	49
Cc1ccncc1CN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872481349	GG	On-Demand	Anodyne	PKM	35	42
O=S(=O)(N[C@H](CO)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872481375	FD	On-Demand	Anodyne	LEF	37	55
O=S(=O)(N[C@@H](CO)C1CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872481377	FD	On-Demand	Anodyne	LEF	37	55
Cc1c(F)ncnc1NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000872481383	CE	On-Demand	Anodyne	ERG2	17	41
Cc1c(F)ncnc1NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000872481383	CE	On-Demand	Anodyne	Q2TU57_MAIZE	19	41
Cc1c(F)ncnc1NCCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872481384	CE	On-Demand	Anodyne	ERG2	17	41
Cc1c(F)ncnc1NCCCCN1C[C@H](C)O[C@H](C)C1	ZINC000872481384	CE	On-Demand	Anodyne	Q2TU57_MAIZE	19	41
Cc1c(F)ncnc1NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000872481385	CE	On-Demand	Anodyne	ERG2	17	41
Cc1c(F)ncnc1NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000872481385	CE	On-Demand	Anodyne	Q2TU57_MAIZE	19	41
Oc1nnc(Cl)cc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872481397	FF	On-Demand	Anodyne	ESR1	68	37
Oc1nnc(Cl)cc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872481397	FF	On-Demand	Anodyne	ESR2	46	37
Oc1nnc(Cl)cc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000872481397	FF	On-Demand	Anodyne	LTA4H	50	44
Nc1nc(NC2CCN(CCOc3ccc(F)cc3)CC2)nc(C(F)F)n1	ZINC000872481442	GE	On-Demand	Anodyne	LTA4H	48	43
Cc1cc(C)c2cccc(OS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c2n1	ZINC000872481445	FG	On-Demand	Anodyne	BDKRB2	70	31
Cc1cc(C)c2cccc(OS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c2n1	ZINC000872481446	FG	On-Demand	Anodyne	BDKRB2	70	31
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481499	FH	On-Demand	Anodyne	HRH1	37	46
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481499	FH	On-Demand	Anodyne	CCR3	36	46
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481499	FH	On-Demand	Anodyne	LIPG	22	43
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481500	FH	On-Demand	Anodyne	HRH1	37	46
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481500	FH	On-Demand	Anodyne	CCR3	36	46
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000872481500	FH	On-Demand	Anodyne	LIPG	22	43
c1ccc2c(c1)COC21CCN(c2ccncc2C2CC2)CC1	ZINC000872481515	DH	On-Demand	Anodyne	SIGMAR1	17	45
O=S(=O)(N[C@H](CO)CC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872481538	EF	On-Demand	Anodyne	LEF	32	45
O=S(=O)(N[C@@H](CO)CC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872481539	EF	On-Demand	Anodyne	LEF	32	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)CC3CCC3)cc2N1	ZINC000872481546	GE	On-Demand	Anodyne	PKM	32	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)CC3CCC3)cc2N1	ZINC000872481547	GE	On-Demand	Anodyne	PKM	32	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCSC3)cc2N1	ZINC000872481618	FF	On-Demand	Anodyne	PKM	31	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCSC3)cc2N1	ZINC000872481619	FF	On-Demand	Anodyne	PKM	31	42
C[C@@H]1OCC[C@]1(O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481653	ED	On-Demand	Anodyne	PSEN2	48	31
c1ccc2c(c1)COC21CCN(c2ccnc3ncccc23)CC1	ZINC000872481677	DH	On-Demand	Anodyne	SIGMAR1	15	47
NC(=O)[C@H]1CC[C@@H](CNc2cc(-c3ccccc3)ncn2)O1	ZINC000872481689	CD	On-Demand	Anodyne	VCP	65	41
NC(=O)[C@@H]1CC[C@@H](CNc2cc(-c3ccccc3)ncn2)O1	ZINC000872481690	CD	On-Demand	Anodyne	VCP	65	41
NC(=O)[C@@H]1CC[C@H](CNc2cc(-c3ccccc3)ncn2)O1	ZINC000872481691	CD	On-Demand	Anodyne	VCP	65	41
NC(=O)[C@H]1CC[C@H](CNc2cc(-c3ccccc3)ncn2)O1	ZINC000872481692	CD	On-Demand	Anodyne	VCP	65	41
O=S(=O)(NCCN1CC=CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872481725	EE	On-Demand	Anodyne	HTR7	26	41
C=CCOC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872481750	FD	On-Demand	Mild	LEF	36	42
C=CCOC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872481751	FD	On-Demand	Mild	LEF	36	42
Cc1ccc(S(=O)(=O)N2C[C@@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872481823	CD	On-Demand	Mild	TRPV4	48	39
Cc1ccc(S(=O)(=O)N2C[C@H](O)C(C)(C)C2)c(C#N)c1	ZINC000872481824	CD	On-Demand	Mild	TRPV4	48	39
Cc1c(F)ncnc1N1CC[C@@H](OCC(C)C)C1	ZINC000872481834	CE	On-Demand	Anodyne	PDE3B	45	36
Cc1c(F)ncnc1N1CC[C@H](OCC(C)C)C1	ZINC000872481835	CE	On-Demand	Anodyne	PDE3B	45	36
COC(=O)[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481880	FE	On-Demand	Anodyne	MMP13	42	38
COC(=O)[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481880	FE	On-Demand	Anodyne	MMP2	20	47
COC(=O)[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481880	FE	On-Demand	Anodyne	MMP3	50	38
COC(=O)[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481880	FE	On-Demand	Anodyne	MMP7	42	36
COC(=O)[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481880	FE	On-Demand	Anodyne	MMP1	42	38
CC(=O)N1CCC[C@@H](CNS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872481898	ED	On-Demand	Mild	CCR8	44	35
CC(=O)N1CCC[C@H](CNS(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872481899	ED	On-Demand	Mild	CCR8	44	35
OC[C@@H]1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872481920	CG	On-Demand	Anodyne	VCP	60	38
COc1ccc(OC)c2sc(NCC(=O)NCCO)nc12	ZINC000872481925	DC	On-Demand	Anodyne	ADORA2B	17	43
Cc1ccc(S(=O)(=O)N2CCSC(C)(C)CC2)c(C#N)c1	ZINC000872481965	DF	On-Demand	Mild	TRPV4	47	42
Cc1cccc(C#N)c1S(=O)(=O)N1CC(C)(O)C1	ZINC000872481979	CC	On-Demand	Mild	TRPV4	43	33
C[C@]1(O)CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872481983	GF	On-Demand	Anodyne	PKM	27	42
COC(=O)[C@@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481991	FD	On-Demand	Anodyne	MMP2	17	48
COC(=O)[C@@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481991	FD	On-Demand	Anodyne	MMP1	27	50
COC(=O)[C@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481992	FD	On-Demand	Anodyne	MMP2	17	48
COC(=O)[C@H]1CSCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872481992	FD	On-Demand	Anodyne	MMP1	27	50
N#CCC1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872482082	FF	On-Demand	Mild	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCN3CC=CCC3)cc2N1	ZINC000872482095	GE	On-Demand	Anodyne	PKM	32	45
COC(=O)[C@@]12CCOC[C@@H]1CN(S(=O)(=O)c1ccc(C)cc1C#N)C2	ZINC000872482102	FD	On-Demand	Mild	TRPV4	43	35
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)n1	ZINC000872482110	GG	On-Demand	Anodyne	HRH1	32	40
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)n1	ZINC000872482110	GG	On-Demand	Anodyne	CCR3	31	40
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)n1	ZINC000872482111	GG	On-Demand	Anodyne	HRH1	32	40
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)n1	ZINC000872482111	GG	On-Demand	Anodyne	CCR3	31	40
COC[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872482122	DD	On-Demand	Anodyne	LEF	36	40
NC(=O)[C@H]1CCCC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482155	CF	On-Demand	Anodyne	SYK	29	40
NC(=O)[C@H]1CCCC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482155	CF	On-Demand	Anodyne	VCP	40	36
NC(=O)[C@@H]1CCCC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482156	CF	On-Demand	Anodyne	SYK	29	40
NC(=O)[C@@H]1CCCC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482156	CF	On-Demand	Anodyne	VCP	40	36
NC(=O)[C@H]1CCCC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482157	CF	On-Demand	Anodyne	SYK	29	40
NC(=O)[C@H]1CCCC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482157	CF	On-Demand	Anodyne	VCP	40	36
NC(=O)[C@@H]1CCCC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482158	CF	On-Demand	Anodyne	SYK	29	40
NC(=O)[C@@H]1CCCC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872482158	CF	On-Demand	Anodyne	VCP	40	36
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCCO)cc2N1	ZINC000872482201	FE	On-Demand	Anodyne	PKM	39	47
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(F)(F)CC1	ZINC000872482284	EG	On-Demand	Anodyne	PKM	48	40
CC(=O)N1CCC[C@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872482316	FE	On-Demand	Anodyne	SFRP1	45	32
CC(=O)N1CCC[C@@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872482317	FE	On-Demand	Anodyne	SFRP1	45	32
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(C#N)c1	ZINC000872482339	FD	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@]3(CCCOC3)C2)c(C#N)c1	ZINC000872482340	FD	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@]3(CCCOC3)C2)c(C#N)c1	ZINC000872482341	FD	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@]3(CCCOC3)C2)c(C#N)c1	ZINC000872482342	FD	On-Demand	Mild	TRPV4	41	32
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872482382	GG	On-Demand	Mild	SLC18A3	32	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872482382	GG	On-Demand	Mild	EPHX2	30	43
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000872482382	GG	On-Demand	Mild	WNT3A	46	32
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@H](O)c2ncc[nH]2)CC1	ZINC000872482397	GF	On-Demand	Anodyne	HTR2B	15	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC([C@@H](O)c2ncc[nH]2)CC1	ZINC000872482398	GF	On-Demand	Anodyne	HTR2B	15	45
O=S(=O)(NCCCCCO)c1ccc(F)c(C(F)F)c1	ZINC000872482417	DE	On-Demand	Anodyne	LEF	27	42
Cc1ccc(S(=O)(=O)N2CC[C@]3(CNC(=O)C3)C2)c(C#N)c1	ZINC000872482435	DC	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CNC(=O)C3)C2)c(C#N)c1	ZINC000872482436	DC	On-Demand	Mild	TRPV4	45	38
CO[C@@]1(C)CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872482478	DE	On-Demand	Mild	TRPV4	47	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC(F)(F)CC3)cc2N1	ZINC000872482507	GG	On-Demand	Anodyne	PKM	32	43
Cc1c(F)ncnc1N1CCC(OC(C)(C)C)CC1	ZINC000872482598	CF	On-Demand	Anodyne	PDE3B	42	33
C[C@]1(O)CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872482601	EF	On-Demand	Anodyne	PKM	41	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](Oc2ccncc2)C1	ZINC000872482627	FG	On-Demand	Anodyne	GCKR	43	31
C[C@H]1C[C@@H](C)N1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872482659	CF	On-Demand	Anodyne	PKM	41	36
COC(=O)[C@@H](C)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872482673	FD	On-Demand	Anodyne	PKM	35	41
CCOc1ccccc1NC(=O)c1cc(S(=O)(=O)NCCOC)ccc1Br	ZINC000872482714	JG	On-Demand	Anodyne	KCNK3	32	40
CCOc1ccccc1NC(=O)c1cc(S(=O)(=O)NCCOC)ccc1Br	ZINC000872482714	JG	On-Demand	Anodyne	KCNK9	24	40
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@]3(CCOC3)C2)c(C#N)c1	ZINC000872482774	ED	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@]3(CCOC3)C2)c(C#N)c1	ZINC000872482775	ED	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@]3(CCOC3)C2)c(C#N)c1	ZINC000872482776	ED	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@]3(CCOC3)C2)c(C#N)c1	ZINC000872482777	ED	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2C[C@H](C)OC3(CCOCC3)C2)c(C#N)c1	ZINC000872482874	FD	On-Demand	Mild	TRPV4	43	34
Cc1ccc(S(=O)(=O)N2C[C@@H](C)OC3(CCOCC3)C2)c(C#N)c1	ZINC000872482875	FD	On-Demand	Mild	TRPV4	43	34
C[C@H]1C[C@@H](C)N1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872482918	EF	On-Demand	Anodyne	PKM	31	43
CO[C@@]1(C)CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872482938	DE	On-Demand	Mild	TRPV4	45	37
COC(=O)[C@H]1CSCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872482943	FD	On-Demand	Anodyne	MMP9	16	47
COC(=O)[C@H]1CSCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872482943	FD	On-Demand	Anodyne	MMP1	22	50
COC(=O)[C@@H]1CSCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872482944	FD	On-Demand	Anodyne	MMP9	16	47
COC(=O)[C@@H]1CSCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872482944	FD	On-Demand	Anodyne	MMP1	22	50
CC(=O)N1CCN(c2cc(-c3ccccc3)ncn2)[C@H](C)C1	ZINC000872483071	CE	On-Demand	Anodyne	SMO	36	43
CC(=O)N1CCN(c2cc(-c3ccccc3)ncn2)[C@@H](C)C1	ZINC000872483072	CE	On-Demand	Anodyne	SMO	36	43
Cc1ccc(S(=O)(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872483114	GF	On-Demand	Mild	TRPV4	49	41
Cc1ccc(S(=O)(=O)N2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)c(C#N)c1	ZINC000872483115	GF	On-Demand	Mild	TRPV4	49	41
Cc1ccc(S(=O)(=O)N2CCn3c(Br)cnc3C2)c(C#N)c1	ZINC000872483173	GE	On-Demand	Mild	TRPV4	41	34
Cc1ccc(S(=O)(=O)N2CCO[C@H](C(=O)C3CC3)C2)c(C#N)c1	ZINC000872483188	ED	On-Demand	Mild	EPHX2	15	42
Cc1ccc(S(=O)(=O)N2CCO[C@@H](C(=O)C3CC3)C2)c(C#N)c1	ZINC000872483189	ED	On-Demand	Mild	EPHX2	15	42
COc1ccc(OC)c2sc(N[C@H](C(N)=O)C(C)C)nc12	ZINC000872483223	DE	On-Demand	Anodyne	ADORA2B	16	42
COc1ccc(OC)c2sc(N[C@@H](C(N)=O)C(C)C)nc12	ZINC000872483224	DE	On-Demand	Anodyne	ADORA2B	16	42
Nc1nc(N[C@H](Cc2ccccc2)C(F)(F)F)nc(C(F)F)n1	ZINC000872483243	EF	On-Demand	Anodyne	TPH1	57	38
Nc1nc(N[C@@H](Cc2ccccc2)C(F)(F)F)nc(C(F)F)n1	ZINC000872483244	EF	On-Demand	Anodyne	TPH1	57	38
N#CC1CCC(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872483277	GG	On-Demand	Mild	PKM	26	42
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](C)C(=O)N1CCCC1	ZINC000872483285	DD	On-Demand	Mild	TRY2_BOVIN	55	39
c1ccc(-c2cc(N3CCO[C@@H](CNc4cccnn4)C3)ncn2)cc1	ZINC000872483308	EE	On-Demand	Anodyne	TNK2	52	34
c1ccc(-c2cc(N3CCO[C@H](CNc4cccnn4)C3)ncn2)cc1	ZINC000872483309	EE	On-Demand	Anodyne	TNK2	52	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCF)cc2N1	ZINC000872483331	DD	On-Demand	Anodyne	PKM	42	51
COC(=O)CN(CCN1CCN(C)CC1)S(=O)(=O)c1c(C)cccc1C#N	ZINC000872483336	GC	On-Demand	Mild	DRD4	40	31
Oc1nnc(Cl)cc1N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000872483350	FI	On-Demand	Anodyne	RBP4	93	48
Oc1nnc(Cl)cc1N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000872483350	FI	On-Demand	Anodyne	SCD1	21	40
Oc1nnc(Cl)cc1N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000872483350	FI	On-Demand	Anodyne	SCD	16	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCOC(F)F)cc2N1	ZINC000872483403	GF	On-Demand	Anodyne	PKM	37	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CCO2)CC1	ZINC000872483404	EF	On-Demand	Anodyne	PKM	50	40
CCC(=O)N1CC[C@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872483438	EG	On-Demand	Anodyne	EPHX2	17	48
CCC(=O)N1CC[C@@H](Nc2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872483439	EG	On-Demand	Anodyne	EPHX2	17	48
C#CCC[C@@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872483558	FD	On-Demand	Mild	PKM	37	44
O=C(C1CCCC1)N1CC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872483633	EG	On-Demand	Anodyne	PRKD1	60	39
O=C(C1CCCC1)N1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872483634	EG	On-Demand	Anodyne	PRKD1	60	39
O=C(Nc1ccccc1)N1CC[C@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872483636	GF	On-Demand	Anodyne	CCR8	75	41
O=C(Nc1ccccc1)N1CC[C@@H](NS(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872483637	GF	On-Demand	Anodyne	CCR8	75	41
C#CCC[C@H](O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872483659	FD	On-Demand	Mild	PKM	37	44
N#CC1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872483683	FE	On-Demand	Mild	PKM	37	45
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](CCO)Cc1ccccc1	ZINC000872483701	EE	On-Demand	Mild	CTRB_BOVIN	44	32
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](CCO)Cc1ccccc1	ZINC000872483702	EE	On-Demand	Mild	CTRB_BOVIN	44	32
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN(c2nccs2)CC1	ZINC000872483723	FE	On-Demand	Mild	CCR8	44	32
CC[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCCO1	ZINC000872483741	GF	On-Demand	Anodyne	PKM	21	40
Cc1ccc(S(=O)(=O)N2CCN(c3nccnc3C)CC2)c(C#N)c1	ZINC000872483772	FD	On-Demand	Mild	TRPV4	46	38
Cc1c(F)ncnc1N1CCN(CCC(=O)N(C)C)CC1	ZINC000872483791	CC	On-Demand	Anodyne	ABCC1	65	34
Cn1ncc2c(N[C@@H]3CCN(C(=O)C4CCCC4)C3)nc(Cl)nc21	ZINC000872483794	EE	On-Demand	Anodyne	Q4VQ11_PIG	45	34
Cn1ncc2c(N[C@H]3CCN(C(=O)C4CCCC4)C3)nc(Cl)nc21	ZINC000872483795	EE	On-Demand	Anodyne	Q4VQ11_PIG	45	34
CCC(=O)c1c(Cl)cccc1N[C@@H]1CCN(C(=O)CC)C1	ZINC000872483815	DG	On-Demand	Anodyne	EPHX2	21	45
CCC(=O)c1c(Cl)cccc1N[C@H]1CCN(C(=O)CC)C1	ZINC000872483817	DG	On-Demand	Anodyne	EPHX2	21	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC4(CCO4)CC3)cc2N1	ZINC000872483873	GF	On-Demand	Anodyne	PKM	18	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCO[C@H](C(F)F)C1	ZINC000872483896	EE	On-Demand	Anodyne	PKM	43	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCO[C@@H](C(F)F)C1	ZINC000872483897	EE	On-Demand	Anodyne	PKM	43	37
Cn1ncc2c(N3CC[C@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483932	EE	On-Demand	Anodyne	PDE3A	41	50
Cn1ncc2c(N3CC[C@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483932	EE	On-Demand	Anodyne	DCK	47	35
Cn1ncc2c(N3CC[C@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483932	EE	On-Demand	Anodyne	PDE3B	49	50
Cn1ncc2c(N3CC[C@@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483934	EE	On-Demand	Anodyne	PDE3A	41	50
Cn1ncc2c(N3CC[C@@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483934	EE	On-Demand	Anodyne	DCK	47	35
Cn1ncc2c(N3CC[C@@H](Oc4ccccn4)C3)nc(Cl)nc21	ZINC000872483934	EE	On-Demand	Anodyne	PDE3B	49	50
CCC(=O)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872483940	CE	On-Demand	Anodyne	MAPK9	20	40
CCC(=O)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872483940	CE	On-Demand	Anodyne	MAPK8	16	41
CCC(=O)N1CC[C@@H](Nc2ccnc3ncccc23)C1	ZINC000872483940	CE	On-Demand	Anodyne	CCR8	64	39
CCC(=O)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872483942	CE	On-Demand	Anodyne	MAPK9	20	40
CCC(=O)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872483942	CE	On-Demand	Anodyne	MAPK8	16	41
CCC(=O)N1CC[C@H](Nc2ccnc3ncccc23)C1	ZINC000872483942	CE	On-Demand	Anodyne	CCR8	64	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C[C@H]3CO)cc2N1	ZINC000872483956	ED	On-Demand	Anodyne	PKM	38	45
CCC(=O)N1CC[C@H](Nc2nc3c(OC)ccc(OC)c3s2)C1	ZINC000872484008	EF	On-Demand	Anodyne	ADORA2B	20	44
CCC(=O)N1CC[C@@H](Nc2nc3c(OC)ccc(OC)c3s2)C1	ZINC000872484010	EF	On-Demand	Anodyne	ADORA2B	20	44
COCC[C@@H](CO)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872484016	FD	On-Demand	Anodyne	CRTM	24	44
COCC[C@H](CO)NS(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872484018	FD	On-Demand	Anodyne	CRTM	24	44
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccn3)C2)n1	ZINC000872484032	DD	On-Demand	Anodyne	PDE3A	25	44
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccn3)C2)n1	ZINC000872484032	DD	On-Demand	Anodyne	DCK	43	35
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccn3)C2)n1	ZINC000872484032	DD	On-Demand	Anodyne	PDE3B	29	44
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccn3)C2)n1	ZINC000872484033	DD	On-Demand	Anodyne	PDE3A	25	44
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccn3)C2)n1	ZINC000872484033	DD	On-Demand	Anodyne	DCK	43	35
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccn3)C2)n1	ZINC000872484033	DD	On-Demand	Anodyne	PDE3B	29	44
CCN1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872484071	ED	On-Demand	Anodyne	F10	38	48
NC(=O)c1cc(N2CC[C@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484132	DD	On-Demand	Anodyne	PDE3A	17	43
NC(=O)c1cc(N2CC[C@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484132	DD	On-Demand	Anodyne	PDE3B	22	43
NC(=O)c1cc(N2CC[C@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484132	DD	On-Demand	Anodyne	SCD1	26	41
NC(=O)c1cc(N2CC[C@@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484134	DD	On-Demand	Anodyne	PDE3A	17	43
NC(=O)c1cc(N2CC[C@@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484134	DD	On-Demand	Anodyne	PDE3B	22	43
NC(=O)c1cc(N2CC[C@@H](Oc3cccnc3)C2)nc(Cl)n1	ZINC000872484134	DD	On-Demand	Anodyne	SCD1	26	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1ccnn1	ZINC000872484183	FE	On-Demand	Anodyne	CASP3	90	39
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1Cn1ccnn1	ZINC000872484183	FE	On-Demand	Anodyne	CASP7	99	39
CCN1CC[C@H](NS(=O)(=O)c2ccc(C)cc2C#N)C1=O	ZINC000872484198	DC	On-Demand	Mild	F10	20	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@@H]1CCCO1	ZINC000872484226	EG	On-Demand	Anodyne	CASP7	45	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@@H]1CCCO1	ZINC000872484227	EG	On-Demand	Anodyne	CASP7	45	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@H]1CCCO1	ZINC000872484228	EG	On-Demand	Anodyne	CASP7	45	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@H]1CCCO1	ZINC000872484229	EG	On-Demand	Anodyne	CASP7	45	34
Cc1c(F)ncnc1NC[C@H](O)COc1ccccc1Br	ZINC000872484244	FF	On-Demand	Anodyne	ADRB2	23	42
Cc1c(F)ncnc1NC[C@@H](O)COc1ccccc1Br	ZINC000872484245	FF	On-Demand	Anodyne	ADRB2	23	42
CS(=O)(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872484354	CD	On-Demand	Anodyne	MAPK8	17	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(C(F)F)CC3)cc2N1	ZINC000872484363	FF	On-Demand	Anodyne	PKM	38	47
COc1cccc([C@H]2CN(c3cc(C(N)=O)nc(Cl)n3)CCO2)c1	ZINC000872484411	ED	On-Demand	Anodyne	DRD4	41	32
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CCCOC3)C2)c(C#N)c1	ZINC000872484456	DE	On-Demand	Mild	TRPV4	44	37
Cc1ccc(S(=O)(=O)N2CC[C@]3(CCCOC3)C2)c(C#N)c1	ZINC000872484458	DE	On-Demand	Mild	TRPV4	44	37
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccn2)C1	ZINC000872484465	CD	On-Demand	Anodyne	PDE3A	49	60
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccn2)C1	ZINC000872484465	CD	On-Demand	Anodyne	DCK	56	44
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccn2)C1	ZINC000872484465	CD	On-Demand	Anodyne	PDE3B	55	60
O=C1C[C@@H](Nc2cc(Cl)nnc2O)CN1C1CCCCC1	ZINC000872484468	DE	On-Demand	Anodyne	INHA	18	43
O=C1C[C@H](Nc2cc(Cl)nnc2O)CN1C1CCCCC1	ZINC000872484469	DE	On-Demand	Anodyne	INHA	18	43
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccn2)C1	ZINC000872484470	CD	On-Demand	Anodyne	PDE3A	49	60
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccn2)C1	ZINC000872484470	CD	On-Demand	Anodyne	DCK	56	44
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccn2)C1	ZINC000872484470	CD	On-Demand	Anodyne	PDE3B	55	60
COc1cccc(OCCN2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872484498	GD	On-Demand	Anodyne	HTR1A	21	42
COc1cccc(OCCN2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872484498	GD	On-Demand	Anodyne	DRD2	20	45
COc1cccc(OCCN2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872484498	GD	On-Demand	Anodyne	DRD4	46	36
COc1cccc(OCCN2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872484498	GD	On-Demand	Anodyne	LTA4H	21	44
COc1cccc(OCCN2CCN(c3nc(N)nc(C(F)F)n3)CC2)c1	ZINC000872484498	GD	On-Demand	Anodyne	HTR7	15	41
Nc1nc(C(F)F)nc(N2CCN(Cc3ccccc3Cl)CC2)n1	ZINC000872484516	FE	On-Demand	Anodyne	DRD4	31	41
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872484541	DE	On-Demand	Anodyne	HTR1A	19	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872484541	DE	On-Demand	Anodyne	DRD2	25	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872484541	DE	On-Demand	Anodyne	DRD4	45	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872484541	DE	On-Demand	Anodyne	DRD3	16	48
Oc1nnc(Cl)cc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872484541	DE	On-Demand	Anodyne	SIGMAR1	18	46
Oc1nnc(Cl)cc1N1CC[C@H](Oc2cccnc2)C1	ZINC000872484561	CD	On-Demand	Anodyne	PDE3A	25	47
Oc1nnc(Cl)cc1N1CC[C@H](Oc2cccnc2)C1	ZINC000872484561	CD	On-Demand	Anodyne	PDE3B	30	47
Oc1nnc(Cl)cc1N1CC[C@H](Oc2cccnc2)C1	ZINC000872484561	CD	On-Demand	Anodyne	LIPG	21	43
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2cccnc2)C1	ZINC000872484562	CD	On-Demand	Anodyne	PDE3A	25	47
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2cccnc2)C1	ZINC000872484562	CD	On-Demand	Anodyne	PDE3B	30	47
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2cccnc2)C1	ZINC000872484562	CD	On-Demand	Anodyne	LIPG	21	43
c1ccc(O[C@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872484607	CG	On-Demand	Anodyne	PDE3A	28	47
c1ccc(O[C@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872484607	CG	On-Demand	Anodyne	PDE3B	35	47
c1ccc(O[C@@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872484610	CG	On-Demand	Anodyne	PDE3A	28	47
c1ccc(O[C@@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872484610	CG	On-Demand	Anodyne	PDE3B	35	47
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccn2)C1	ZINC000872484630	CD	On-Demand	Anodyne	PDE3A	38	48
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccn2)C1	ZINC000872484630	CD	On-Demand	Anodyne	PDE3B	45	48
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccn2)C1	ZINC000872484632	CD	On-Demand	Anodyne	PDE3A	38	48
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccn2)C1	ZINC000872484632	CD	On-Demand	Anodyne	PDE3B	45	48
COC[C@@H](O)CNS(=O)(=O)c1c(C)cccc1C#N	ZINC000872484646	CC	On-Demand	Mild	ADRB1	49	32
Cc1cc(N2CC[C@@H](Oc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872484652	DE	On-Demand	Anodyne	PDE3A	39	48
Cc1cc(N2CC[C@@H](Oc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872484652	DE	On-Demand	Anodyne	PDE3B	46	48
Cc1cc(N2CC[C@H](Oc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872484654	DE	On-Demand	Anodyne	PDE3A	39	48
Cc1cc(N2CC[C@H](Oc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872484654	DE	On-Demand	Anodyne	PDE3B	46	48
CCC(=O)N1CC[C@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484731	DF	On-Demand	Anodyne	EPHX2	19	44
CCC(=O)N1CC[C@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484731	DF	On-Demand	Anodyne	CCR8	46	37
CCC(=O)N1CC[C@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484731	DF	On-Demand	Anodyne	SFRP1	66	34
CCC(=O)N1CC[C@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484731	DF	On-Demand	Anodyne	WNT3	44	34
CCC(=O)N1CC[C@@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484733	DF	On-Demand	Anodyne	EPHX2	19	44
CCC(=O)N1CC[C@@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484733	DF	On-Demand	Anodyne	CCR8	46	37
CCC(=O)N1CC[C@@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484733	DF	On-Demand	Anodyne	SFRP1	66	34
CCC(=O)N1CC[C@@H](Nc2cc(C(C)(C)C)nc(Cl)n2)C1	ZINC000872484733	DF	On-Demand	Anodyne	WNT3	44	34
O=C1N[C@H]2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C[C@@H]2CO1	ZINC000872484754	FD	On-Demand	Anodyne	PKM	42	40
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HTR1A	57	55
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	DRD2	37	53
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	DRD4	46	39
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HTR2A	49	53
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HTR2C	21	43
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	DRD3	49	48
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HRP1_PLAFA	84	35
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HTR7	56	50
Oc1nnc(Cl)cc1NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000872484777	FF	On-Demand	Anodyne	HNMT	42	35
Cc1cc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n(C)n1	ZINC000872484780	GE	On-Demand	Anodyne	PKM	38	45
COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872484782	GF	On-Demand	Anodyne	KCNQ2	44	42
COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872484782	GF	On-Demand	Anodyne	NPY2R	70	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CCOCC2)CC1	ZINC000872484793	FG	On-Demand	Anodyne	PKM	51	41
Nc1nc(C(F)F)nc(N2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000872484834	ED	On-Demand	Anodyne	DRD4	22	53
CCOC(=O)[C@]1(COC)CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872484877	GD	On-Demand	Mild	TRPV4	46	37
CCOC(=O)[C@@]1(COC)CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872484878	GD	On-Demand	Mild	TRPV4	46	37
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000872484910	GH	On-Demand	Anodyne	DRD4	18	45
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000872484910	GH	On-Demand	Anodyne	SIGMAR1	20	47
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000872484910	GH	On-Demand	Anodyne	SSTR5	65	37
Oc1nnc(Cl)cc1NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000872484910	GH	On-Demand	Anodyne	MCHR1	29	42
C[S@@](=O)C1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872484917	GD	On-Demand	Anodyne	PKM	38	46
NC(=O)c1cc(N2CC[C@@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484965	DD	On-Demand	Anodyne	PDE3A	26	44
NC(=O)c1cc(N2CC[C@@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484965	DD	On-Demand	Anodyne	PDE3B	32	44
NC(=O)c1cc(N2CC[C@@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484965	DD	On-Demand	Anodyne	SCD1	23	43
NC(=O)c1cc(N2CC[C@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484966	DD	On-Demand	Anodyne	PDE3A	26	44
NC(=O)c1cc(N2CC[C@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484966	DD	On-Demand	Anodyne	PDE3B	32	44
NC(=O)c1cc(N2CC[C@H](Oc3ccccn3)C2)nc(Cl)n1	ZINC000872484966	DD	On-Demand	Anodyne	SCD1	23	43
NC(=O)c1cc(N2CCC[C@@H](Nc3ccccc3)C2)nc(Cl)n1	ZINC000872484967	EE	On-Demand	Anodyne	PRKD1	29	42
NC(=O)c1cc(N2CCC[C@H](Nc3ccccc3)C2)nc(Cl)n1	ZINC000872484968	EE	On-Demand	Anodyne	PRKD1	29	42
COc1cccc(C=C2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872484979	EH	On-Demand	Anodyne	DRD4	44	36
N#Cc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)cn1	ZINC000872484993	GF	On-Demand	Mild	GCK	62	37
N#Cc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)CC2)cn1	ZINC000872484993	GF	On-Demand	Mild	GCKR	69	36
CCC(=O)N1CC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485014	CF	On-Demand	Anodyne	P2RY12	132	37
CCC(=O)N1CC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485014	CF	On-Demand	Anodyne	EPHX2	17	45
CCC(=O)N1CC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485014	CF	On-Demand	Anodyne	CCR8	42	35
CCC(=O)N1CC[C@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485014	CF	On-Demand	Anodyne	VCP	40	33
CCC(=O)N1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485016	CF	On-Demand	Anodyne	P2RY12	132	37
CCC(=O)N1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485016	CF	On-Demand	Anodyne	EPHX2	17	45
CCC(=O)N1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485016	CF	On-Demand	Anodyne	CCR8	42	35
CCC(=O)N1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)C1	ZINC000872485016	CF	On-Demand	Anodyne	VCP	40	33
Cn1ncc2c(N3CCN(Cc4cccc(F)c4)CC3)nc(Cl)nc21	ZINC000872485080	FE	On-Demand	Anodyne	DRD4	18	45
CCN1CC[C@H](NS(=O)(=O)c2cccc(Br)n2)C1=O	ZINC000872485091	EC	On-Demand	Anodyne	F10	28	44
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(CNC(=O)C(F)(F)F)CC1	ZINC000872485187	GD	On-Demand	Mild	EPHX2	25	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(CNC(=O)C(F)(F)F)CC1	ZINC000872485187	GD	On-Demand	Mild	CACNA1I	52	33
Cc1ccc(S(=O)(=O)N2CC[C@H](c3ccccn3)C2)c(C#N)c1	ZINC000872485188	EE	On-Demand	Mild	EPHX2	16	42
Cc1ccc(S(=O)(=O)N2CC[C@H](c3ccccn3)C2)c(C#N)c1	ZINC000872485188	EE	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2CC[C@@H](c3ccccn3)C2)c(C#N)c1	ZINC000872485189	EE	On-Demand	Mild	EPHX2	16	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](c3ccccn3)C2)c(C#N)c1	ZINC000872485189	EE	On-Demand	Mild	TRPV4	41	32
C#C[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872485190	DF	On-Demand	Mild	LEF	39	49
C#C[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872485191	DF	On-Demand	Mild	LEF	39	49
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000872485201	GE	On-Demand	Mild	CCR8	74	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000872485201	GE	On-Demand	Mild	SFRP1	55	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000872485201	GE	On-Demand	Mild	WNT3	54	31
CN(C)CC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872485202	GE	On-Demand	Anodyne	PKM	38	46
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c(C#N)c1	ZINC000872485207	GF	On-Demand	Mild	EPHX2	24	46
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c(C#N)c1	ZINC000872485208	GF	On-Demand	Mild	EPHX2	24	46
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	HTR1A	48	46
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	DRD2	42	46
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	DRD4	53	41
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	HTR2A	35	45
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	HTR2C	20	42
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	DRD3	48	42
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	HTR4	22	45
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	LTA4H	27	42
COc1cccc(OCCN2CCN(c3cc(C(N)=O)nc(Cl)n3)CC2)c1	ZINC000872485264	GD	On-Demand	Anodyne	HRH3	18	44
Nc1nc(C(F)F)nc(N2CCC(c3ccccc3C(F)(F)F)CC2)n1	ZINC000872485303	FH	On-Demand	Anodyne	RBP4	87	56
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA2	89	50
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA1	73	50
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA7	57	44
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA5B	56	44
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA4	85	44
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA5A	60	44
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA12	48	50
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	CA9	53	37
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	NCE103	41	36
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	MTCA1	51	35
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	P96878_MYCTU	53	44
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	KCNK3	46	41
CCOc1ccccc1NC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000872485359	EE	On-Demand	Anodyne	KCNK9	44	41
CCN1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1=O	ZINC000872485388	GD	On-Demand	Anodyne	PKM	35	45
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2Cl)CC1	ZINC000872485444	EF	On-Demand	Anodyne	DRD2	31	47
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2Cl)CC1	ZINC000872485444	EF	On-Demand	Anodyne	DRD4	51	47
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2Cl)CC1	ZINC000872485444	EF	On-Demand	Anodyne	DRD3	36	47
Oc1nnc(Cl)cc1N1CCN(Cc2ccccc2Cl)CC1	ZINC000872485444	EF	On-Demand	Anodyne	HTR7	18	44
Cc1c(F)ncnc1N1CC[C@@H](OCc2ccccn2)C1	ZINC000872485469	CE	On-Demand	Anodyne	PDE3A	44	44
Cc1c(F)ncnc1N1CC[C@@H](OCc2ccccn2)C1	ZINC000872485469	CE	On-Demand	Anodyne	DCK	44	35
Cc1c(F)ncnc1N1CC[C@@H](OCc2ccccn2)C1	ZINC000872485469	CE	On-Demand	Anodyne	PDE3B	49	44
Cc1c(F)ncnc1N1CC[C@@H](OCc2ccccn2)C1	ZINC000872485469	CE	On-Demand	Anodyne	LIPG	17	49
Cc1c(F)ncnc1N1CC[C@H](OCc2ccccn2)C1	ZINC000872485470	CE	On-Demand	Anodyne	PDE3A	44	44
Cc1c(F)ncnc1N1CC[C@H](OCc2ccccn2)C1	ZINC000872485470	CE	On-Demand	Anodyne	DCK	44	35
Cc1c(F)ncnc1N1CC[C@H](OCc2ccccn2)C1	ZINC000872485470	CE	On-Demand	Anodyne	PDE3B	49	44
Cc1c(F)ncnc1N1CC[C@H](OCc2ccccn2)C1	ZINC000872485470	CE	On-Demand	Anodyne	LIPG	17	49
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	HTR1A	82	41
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	DRD2	71	41
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	DRD4	45	41
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	ADRA1D	49	39
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	ADRA1A	48	39
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	DRD3	78	40
COCCOc1ccccc1N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872485543	FE	On-Demand	Anodyne	HTR7	51	39
OC[C@@H]1CCN(Cc2ccccc2)C[C@H]1Nc1cc(Cl)nnc1O	ZINC000872485549	EE	On-Demand	Anodyne	SIGMAR1	32	40
OC[C@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872485551	EE	On-Demand	Anodyne	SIGMAR1	32	40
OC[C@H]1CCN(Cc2ccccc2)C[C@H]1Nc1cc(Cl)nnc1O	ZINC000872485554	EE	On-Demand	Anodyne	SIGMAR1	32	40
OC[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1cc(Cl)nnc1O	ZINC000872485556	EE	On-Demand	Anodyne	SIGMAR1	32	40
Cc1cc(N2CC[C@H](OCc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872485569	DE	On-Demand	Anodyne	LIPG	17	49
Cc1cc(N2CC[C@@H](OCc3ccccn3)C2)c2cnn(C)c2n1	ZINC000872485570	DE	On-Demand	Anodyne	LIPG	17	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCCOC3)cc2N1	ZINC000872485587	ED	On-Demand	Anodyne	PKM	18	41
O=[N+]([O-])c1cccc(CN(c2cc(Cl)nnc2O)C2CC2)c1	ZINC000872485645	DF	On-Demand	Bother	CACNA1D	47	33
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	HTR1A	71	44
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	DRD2	65	47
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	DRD1	19	42
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	DRD4	54	44
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	HTR2A	33	44
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	DRD3	66	44
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	HTR4	15	44
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	LTA4H	27	43
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	HTR7	44	45
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	SIGMAR1	15	41
COc1cccc(OCCN2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872485671	FE	On-Demand	Anodyne	ABCB1	17	40
C[C@@H]1C[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872485673	EE	On-Demand	Anodyne	PKM	40	50
CC(C)(C)[C@@H](O)C[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872485694	FE	On-Demand	Anodyne	LEF	34	41
CC(C)(C)[C@@H](O)C[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872485697	FE	On-Demand	Anodyne	LEF	34	41
O=S1(=O)CCC[C@@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872485699	DE	On-Demand	Anodyne	VCP	53	36
O=S1(=O)CCC[C@H]1CNc1cc(-c2ccccc2)ncn1	ZINC000872485701	DE	On-Demand	Anodyne	VCP	53	36
c1ccc(CO[C@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872485715	CG	On-Demand	Anodyne	LIPG	23	52
c1ccc(CO[C@@H]2CCN(c3ccncc3C3CC3)C2)nc1	ZINC000872485716	CG	On-Demand	Anodyne	LIPG	23	52
COC(=O)[C@@]1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872485760	GD	On-Demand	Mild	TRPV4	48	41
Oc1nnc(Cl)cc1NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000872485763	EE	On-Demand	Anodyne	SLC18A3	33	44
Oc1nnc(Cl)cc1NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000872485764	EE	On-Demand	Anodyne	SLC18A3	33	44
Oc1nnc(Cl)cc1NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000872485765	EE	On-Demand	Anodyne	SLC18A3	33	44
Oc1nnc(Cl)cc1NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000872485766	EE	On-Demand	Anodyne	SLC18A3	33	44
Cc1c(F)ncnc1N1CCN(C2CCCCC2)CC1	ZINC000872485909	CE	On-Demand	Anodyne	EBP	27	40
CN1C[C@@H]2[C@@H](CCCN2S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872485925	FE	On-Demand	Anodyne	CASP3	44	40
CN1C[C@@H]2[C@@H](CCCN2S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872485925	FE	On-Demand	Anodyne	CASP7	61	40
O=S(=O)(CCNc1cc(-c2ccccc2)ncn1)CC1CC1	ZINC000872485928	DE	On-Demand	Anodyne	VCP	55	36
NC(=O)c1cc(N2CCN(Cc3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872485932	ED	On-Demand	Anodyne	DRD2	15	44
NC(=O)c1cc(N2CCN(Cc3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872485932	ED	On-Demand	Anodyne	DRD4	29	44
NC(=O)c1cc(N2CCN(Cc3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872485932	ED	On-Demand	Anodyne	SIGMAR1	17	43
NC(=O)c1cc(N2CCN(Cc3cccc(F)c3)CC2)nc(Cl)n1	ZINC000872485932	ED	On-Demand	Anodyne	FAAH	19	41
COCC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872485950	FE	On-Demand	Anodyne	PKM	37	46
c1ccc(-c2cc(N3CC[C@@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486005	EG	On-Demand	Anodyne	PDE3A	39	40
c1ccc(-c2cc(N3CC[C@@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486005	EG	On-Demand	Anodyne	PDE3B	44	40
c1ccc(-c2cc(N3CC[C@@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486005	EG	On-Demand	Anodyne	LIPG	17	52
c1ccc(-c2cc(N3CC[C@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486006	EG	On-Demand	Anodyne	PDE3A	39	40
c1ccc(-c2cc(N3CC[C@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486006	EG	On-Demand	Anodyne	PDE3B	44	40
c1ccc(-c2cc(N3CC[C@H](OCc4ccccn4)C3)ncn2)cc1	ZINC000872486006	EG	On-Demand	Anodyne	LIPG	17	52
Oc1nnc(Cl)cc1N1CCC[C@@H]1CCCc1ccccc1	ZINC000872486085	DH	On-Demand	Anodyne	SLC18A2	42	45
Oc1nnc(Cl)cc1N1CCC[C@H]1CCCc1ccccc1	ZINC000872486086	DH	On-Demand	Anodyne	SLC18A2	42	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC3(O)CCC3)cc2N1	ZINC000872486177	FE	On-Demand	Anodyne	PKM	38	47
Cn1ncc2c(N[C@H]3CCOC4(CCCC4)C3)nc(Cl)nc21	ZINC000872486187	DF	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Cn1ncc2c(N[C@@H]3CCOC4(CCCC4)C3)nc(Cl)nc21	ZINC000872486188	DF	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Cc1c(F)ncnc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872486199	DE	On-Demand	Anodyne	DRD2	16	55
Cc1c(F)ncnc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872486199	DE	On-Demand	Anodyne	DRD4	30	55
Cc1c(F)ncnc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872486199	DE	On-Demand	Anodyne	ABCC1	76	37
Cc1c(F)ncnc1N1CCN(Cc2cccc(F)c2)CC1	ZINC000872486199	DE	On-Demand	Anodyne	ABCB1A	45	32
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	HTR1A	30	44
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	DRD2	28	48
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	DRD4	46	37
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	HTR2A	19	44
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	PDGFRB	44	35
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	LTA4H	22	44
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	HTR7	16	41
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	ABCC1	83	37
COc1cccc(OCCN2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486201	EE	On-Demand	Anodyne	ABCB1A	45	33
COCCN(Cc1ccccc1)c1cc(C)nc2c1cnn2C	ZINC000872486240	DF	On-Demand	Anodyne	CRHR1	23	42
Cc1ccc(S(=O)(=O)N2CC[C@](F)(CO)C2)c(C#N)c1	ZINC000872486252	CC	On-Demand	Mild	TRPV4	51	43
Cc1ccc(S(=O)(=O)N2CC[C@@](F)(CO)C2)c(C#N)c1	ZINC000872486253	CC	On-Demand	Mild	TRPV4	51	43
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	APP	44	37
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	ST14	63	34
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	CACNA1I	52	33
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	F13A1	16	43
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	GPR119	48	40
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	SFRP1	60	37
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872486277	GF	On-Demand	Anodyne	WNT3	40	33
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	HTR1A	75	41
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	DRD2	66	41
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	DRD4	43	39
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	ADRA1D	43	38
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	ADRA1A	44	40
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	DRD3	78	40
COCCOc1ccccc1N1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872486365	GD	On-Demand	Anodyne	HTR7	49	35
Cn1ncc2c(N[C@@H]3CCOC4(CCC4)C3)nc(Cl)nc21	ZINC000872486373	DF	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Cn1ncc2c(N[C@H]3CCOC4(CCC4)C3)nc(Cl)nc21	ZINC000872486374	DF	On-Demand	Anodyne	Q4VQ11_PIG	40	33
c1ccc(CO[C@H]2CCN(c3ccnc4ncccc34)C2)nc1	ZINC000872486407	DF	On-Demand	Anodyne	LIPG	25	54
c1ccc(CO[C@@H]2CCN(c3ccnc4ncccc34)C2)nc1	ZINC000872486408	DF	On-Demand	Anodyne	LIPG	25	54
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1	ZINC000872486428	GF	On-Demand	Anodyne	GCKR	52	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1	ZINC000872486429	GF	On-Demand	Anodyne	GCKR	52	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1	ZINC000872486430	GF	On-Demand	Anodyne	GCKR	52	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1	ZINC000872486431	GF	On-Demand	Anodyne	GCKR	52	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2C[C@@H]21	ZINC000872486437	DF	On-Demand	Anodyne	CASP3	53	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2C[C@@H]21	ZINC000872486437	DF	On-Demand	Anodyne	CASP7	74	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2C[C@H]21	ZINC000872486438	DF	On-Demand	Anodyne	CASP3	53	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2C[C@H]21	ZINC000872486438	DF	On-Demand	Anodyne	CASP7	74	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2C[C@H]21	ZINC000872486439	DF	On-Demand	Anodyne	CASP3	53	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2C[C@H]21	ZINC000872486439	DF	On-Demand	Anodyne	CASP7	74	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2C[C@@H]21	ZINC000872486440	DF	On-Demand	Anodyne	CASP3	53	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]2C[C@@H]21	ZINC000872486440	DF	On-Demand	Anodyne	CASP7	74	38
COC(=O)c1cccc(NC2CCN(c3ncnc(F)c3C)CC2)c1	ZINC000872486481	EF	On-Demand	Anodyne	LIMK2	53	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3(C(F)(F)F)CC3)cc2N1	ZINC000872486482	GG	On-Demand	Anodyne	PKM	37	44
COCCN(CCOC)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872486518	GD	On-Demand	Mild	TRPV4	43	36
Cc1cccc(C#N)c1S(=O)(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000872486537	EE	On-Demand	Mild	GLRA1	42	34
COC(=O)CCN(C[C@@H]1CCCO1)c1cc(-c2ccccc2)ncn1	ZINC000872486600	EF	On-Demand	Anodyne	TNK2	55	38
Cn1ncc2c(N[C@@H]3CCOC4(CCCCC4)C3)nc(Cl)nc21	ZINC000872486607	EG	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Cn1ncc2c(N[C@H]3CCOC4(CCCCC4)C3)nc(Cl)nc21	ZINC000872486608	EG	On-Demand	Anodyne	Q4VQ11_PIG	40	33
Nc1nc(C(F)F)nc(N2CCC[C@H]2CCCc2ccccc2)n1	ZINC000872486609	EG	On-Demand	Anodyne	SLC18A2	47	49
Nc1nc(C(F)F)nc(N2CCC[C@@H]2CCCc2ccccc2)n1	ZINC000872486610	EG	On-Demand	Anodyne	SLC18A2	47	49
Cc1ccc(S(=O)(=O)N2C[C@@H](CO)[C@H](c3cnn(C(C)C)c3)C2)c(C#N)c1	ZINC000872486615	GE	On-Demand	Mild	TRPV4	41	33
COc1ccc(OC)c2sc(NC3CCN([C@@H]4CCOC4)CC3)nc12	ZINC000872486692	FF	On-Demand	Anodyne	SSTR5	25	41
COc1ccc(OC)c2sc(NC3CCN([C@H]4CCOC4)CC3)nc12	ZINC000872486693	FF	On-Demand	Anodyne	SSTR5	25	41
CN(C1(CO)CC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872486694	FD	On-Demand	Anodyne	PKM	31	40
Cn1ncc2c(NC3CCN([C@@H]4CCOC4)CC3)nc(Cl)nc21	ZINC000872486718	ED	On-Demand	Anodyne	Q4VQ11_PIG	42	37
Cn1ncc2c(NC3CCN([C@H]4CCOC4)CC3)nc(Cl)nc21	ZINC000872486719	ED	On-Demand	Anodyne	Q4VQ11_PIG	42	37
NC(=O)c1cc(N2CC[C@@H](OCc3ccccn3)C2)nc(Cl)n1	ZINC000872486767	ED	On-Demand	Anodyne	LIPG	27	51
NC(=O)c1cc(N2CC[C@H](OCc3ccccn3)C2)nc(Cl)n1	ZINC000872486768	ED	On-Demand	Anodyne	LIPG	27	51
Oc1nnc(Cl)cc1N1CC[C@@H](OCc2ccccn2)C1	ZINC000872486792	DE	On-Demand	Anodyne	LIPG	39	55
Oc1nnc(Cl)cc1N1CC[C@H](OCc2ccccn2)C1	ZINC000872486793	DE	On-Demand	Anodyne	LIPG	39	55
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@H]1c1cc[nH]n1	ZINC000872486802	FG	On-Demand	Anodyne	CASP3	40	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@H]1c1cc[nH]n1	ZINC000872486802	FG	On-Demand	Anodyne	CASP7	52	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@@H]1c1cc[nH]n1	ZINC000872486803	FG	On-Demand	Anodyne	CASP3	40	35
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCC[C@@H]1c1cc[nH]n1	ZINC000872486803	FG	On-Demand	Anodyne	CASP7	52	34
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)c(C#N)c1	ZINC000872486855	FE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)c(C#N)c1	ZINC000872486855	FE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)[C@@H](CO)C2)c(C#N)c1	ZINC000872486856	FE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)[C@@H](CO)C2)c(C#N)c1	ZINC000872486856	FE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c(C#N)c1	ZINC000872486857	FE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c(C#N)c1	ZINC000872486857	FE	On-Demand	Mild	TRPV4	42	34
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)[C@H](CO)C2)c(C#N)c1	ZINC000872486858	FE	On-Demand	Mild	EPHX2	15	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)[C@H](CO)C2)c(C#N)c1	ZINC000872486858	FE	On-Demand	Mild	TRPV4	42	34
CCN(Cc1ccc(OC)cc1)c1nc(N)nc(C(F)F)n1	ZINC000872486881	DE	On-Demand	Anodyne	DRTS_TOXGO	23	40
CCN(Cc1ccc(OC)cc1)c1nc(N)nc(C(F)F)n1	ZINC000872486881	DE	On-Demand	Anodyne	DYR_PNECA	22	40
c1ccc(-c2cc(NC3CCN([C@H]4CCOC4)CC3)ncn2)cc1	ZINC000872486882	DF	On-Demand	Anodyne	MAPK10	15	41
c1ccc(-c2cc(NC3CCN([C@@H]4CCOC4)CC3)ncn2)cc1	ZINC000872486883	DF	On-Demand	Anodyne	MAPK10	15	41
c1ccc(-c2cc(N3CCC(NC4CC4)CC3)ncn2)cc1	ZINC000872486910	CF	On-Demand	Anodyne	HRH4	18	62
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCOC1	ZINC000872486965	CE	On-Demand	Anodyne	PKM	48	41
Nc1nc(NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)nc(C(F)F)n1	ZINC000872487010	GF	On-Demand	Anodyne	TPH1	31	45
Nc1nc(NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)nc(C(F)F)n1	ZINC000872487011	GF	On-Demand	Anodyne	TPH1	31	45
Cc1c(F)ncnc1N(C)CCCn1ccnc1	ZINC000872487020	BD	On-Demand	Anodyne	TBXAS1	24	40
CCC(=O)c1c(Cl)cccc1NC1CCN(C(=O)CCOC)CC1	ZINC000872487084	FG	On-Demand	Anodyne	CCR8	53	37
Nc1nc(C(F)F)nc(N2CC[C@H](OCc3ccccn3)C2)n1	ZINC000872487092	DD	On-Demand	Anodyne	LIPG	17	50
Nc1nc(C(F)F)nc(N2CC[C@@H](OCc3ccccn3)C2)n1	ZINC000872487093	DD	On-Demand	Anodyne	LIPG	17	50
CCN(Cc1ccc(OC)c(OC)c1)c1nc(N)nc(C(F)F)n1	ZINC000872487101	EE	On-Demand	Anodyne	DHFR	21	40
CCN(Cc1ccc(OC)c(OC)c1)c1nc(N)nc(C(F)F)n1	ZINC000872487101	EE	On-Demand	Anodyne	DRTS_TOXGO	34	40
CCN(Cc1ccc(OC)c(OC)c1)c1nc(N)nc(C(F)F)n1	ZINC000872487101	EE	On-Demand	Anodyne	DYR_PNECA	28	40
CCN(Cc1ccc(OC)c(OC)c1)c1nc(N)nc(C(F)F)n1	ZINC000872487101	EE	On-Demand	Anodyne	DRTS_TRYCR	46	37
COC(=O)N1CCC(CNS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872487155	GD	On-Demand	Anodyne	HTR4	17	43
COC(=O)N1CCC(CNS(=O)(=O)c2cccc(Br)n2)CC1	ZINC000872487155	GD	On-Demand	Anodyne	CCR8	51	36
Oc1nnc(Cl)cc1N1CC[C@@H](OCCN2CCCCC2)C1	ZINC000872487172	ED	On-Demand	Anodyne	LIPG	36	41
Oc1nnc(Cl)cc1N1CC[C@H](OCCN2CCCCC2)C1	ZINC000872487173	ED	On-Demand	Anodyne	LIPG	36	41
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)C(=O)C2)c(C#N)c1	ZINC000872487209	FD	On-Demand	Mild	TRPV4	43	36
COCCN(Cc1ccc2c(c1)OCO2)c1cc(C(N)=O)nc(Cl)n1	ZINC000872487256	FD	On-Demand	Anodyne	BMP1	60	36
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872487277	FD	On-Demand	Mild	EPHX2	15	40
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872487277	FD	On-Demand	Mild	TRPV4	42	32
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872487277	FD	On-Demand	Mild	CACNA1I	40	31
COC(=O)N1CCC(CNS(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872487277	FD	On-Demand	Mild	CCR8	51	36
CCN(Cc1ccc(OC)cc1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872487314	DE	On-Demand	Anodyne	PROKR1	59	32
COC(=O)N1CCC(CNS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872487333	FD	On-Demand	Mild	GRIN2B	20	40
COC(=O)N1CCC(CNS(=O)(=O)c2c(C)cccc2C#N)CC1	ZINC000872487333	FD	On-Demand	Mild	CCR8	75	38
Fc1cc(Cl)cc2sc(N3CCC(NC4CC4)CC3)nc12	ZINC000872487348	EH	On-Demand	Anodyne	HRH4	19	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000872487361	GG	On-Demand	Mild	AR	23	40
CCCCN(CC(N)=O)c1cc(-c2ccccc2)ncn1	ZINC000872487362	CE	On-Demand	Anodyne	TSPO	22	44
N#CCNC(=O)CNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487385	DC	On-Demand	Mild	TBXA2R	40	31
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOc2cc(O)ccc2C1	ZINC000872487391	FG	On-Demand	Anodyne	PKM	40	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOc2cc(O)ccc2C1	ZINC000872487391	FG	On-Demand	Anodyne	AKR1C3	47	40
CCCN(C(=O)c1cccs1)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872487444	FH	On-Demand	Anodyne	SIRT3	57	40
CCCN(C(=O)c1cccs1)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872487444	FH	On-Demand	Anodyne	SIRT2	53	40
CCCN(C(=O)c1cccs1)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872487444	FH	On-Demand	Anodyne	SIRT1	54	40
CCn1cc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cn1	ZINC000872487445	GE	On-Demand	Anodyne	PKM	30	42
Cc1c(F)ncnc1N1CC[C@H](OCCN2CCCCC2)C1	ZINC000872487458	DE	On-Demand	Anodyne	PDE3B	42	33
Cc1c(F)ncnc1N1CC[C@@H](OCCN2CCCCC2)C1	ZINC000872487459	DE	On-Demand	Anodyne	PDE3B	42	33
CN1[C@H]2CC[C@H]1CC(N(C)S(=O)(=O)c1cccc(Br)n1)C2	ZINC000872487490	FE	On-Demand	Anodyne	GLRA1	42	33
COC(=O)c1cccc(NC2CCN(c3cc(Cl)nnc3O)CC2)c1	ZINC000872487540	FF	On-Demand	Anodyne	BRD3	28	40
C[C@@H]1CSC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872487576	FF	On-Demand	Anodyne	PKM	36	46
C[C@@H]1CSC[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872487577	FF	On-Demand	Anodyne	PKM	36	46
C[C@@H]1COCC[C@@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872487588	GF	On-Demand	Anodyne	PKM	30	42
C[C@@H]1COCC[C@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872487590	GF	On-Demand	Anodyne	PKM	30	42
Cc1cccc(C#N)c1S(=O)(=O)N1CCCc2occc2C1	ZINC000872487645	DF	On-Demand	Mild	AKR1C3	42	37
CCC[C@]1(CO)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872487656	DE	On-Demand	Mild	TRPV4	47	39
COC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487675	FD	On-Demand	Anodyne	CASP3	42	36
COC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487675	FD	On-Demand	Anodyne	MMP13	17	42
COC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487675	FD	On-Demand	Anodyne	MMP3	16	42
COC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487675	FD	On-Demand	Anodyne	CASP7	56	35
COC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487675	FD	On-Demand	Anodyne	MMP1	15	42
COC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487676	FD	On-Demand	Anodyne	CASP3	42	36
COC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487676	FD	On-Demand	Anodyne	MMP13	17	42
COC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487676	FD	On-Demand	Anodyne	MMP3	16	42
COC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487676	FD	On-Demand	Anodyne	CASP7	56	35
COC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487676	FD	On-Demand	Anodyne	MMP1	15	42
NC(=O)C[C@H](Nc1cc(-c2ccccc2)ncn1)C1CCOCC1	ZINC000872487677	EE	On-Demand	Anodyne	VCP	51	35
NC(=O)C[C@@H](Nc1cc(-c2ccccc2)ncn1)C1CCOCC1	ZINC000872487678	EE	On-Demand	Anodyne	VCP	51	35
CCC(=O)c1c(Cl)cccc1N1CCCC2(C1)OCCO2	ZINC000872487696	DG	On-Demand	Anodyne	KCNQ2	40	34
COC(=O)[C@@H](CF)NS(=O)(=O)c1ccc(C)cc1C#N	ZINC000872487704	DC	On-Demand	Mild	ITGAV	45	33
Cc1ccc(S(=O)(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)c(C#N)c1	ZINC000872487715	GF	On-Demand	Mild	TRPV4	48	40
Cc1ccc(S(=O)(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c(C#N)c1	ZINC000872487716	GF	On-Demand	Mild	TRPV4	48	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCSC3)cc2N1	ZINC000872487735	GG	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCSC3)cc2N1	ZINC000872487736	GG	On-Demand	Anodyne	PKM	26	42
COCCN(CC(C)C)c1cc(C)nc2c1cnn2C	ZINC000872487784	CE	On-Demand	Anodyne	CRHR1	20	48
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCOCC(F)(F)C1	ZINC000872487898	EE	On-Demand	Anodyne	PKM	41	36
CCOC(=O)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872487929	FE	On-Demand	Anodyne	P2RY12	106	40
CCOC(=O)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872487929	FE	On-Demand	Anodyne	CPT1A	44	35
CCOC(=O)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872487929	FE	On-Demand	Anodyne	SIRT3	42	31
CCOC(=O)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872487929	FE	On-Demand	Anodyne	SIRT2	43	30
CCOC(=O)CNC(=O)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872487929	FE	On-Demand	Anodyne	VCP	43	38
COC(=O)C[C@@H]1CCCN1c1cc(-c2ccccc2)ncn1	ZINC000872487942	CF	On-Demand	Anodyne	NOS2	23	40
COC(=O)C[C@@H]1CCCN1c1cc(-c2ccccc2)ncn1	ZINC000872487942	CF	On-Demand	Anodyne	ACKR3	57	33
COC(=O)C[C@H]1CCCN1c1cc(-c2ccccc2)ncn1	ZINC000872487943	CF	On-Demand	Anodyne	NOS2	23	40
COC(=O)C[C@H]1CCCN1c1cc(-c2ccccc2)ncn1	ZINC000872487943	CF	On-Demand	Anodyne	ACKR3	57	33
NC(=O)N1CCC[C@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872487967	FD	On-Demand	Anodyne	F2	23	51
NC(=O)N1CCC[C@@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872487968	FD	On-Demand	Anodyne	F2	23	51
COC(=O)[C@@H](CF)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487969	ED	On-Demand	Anodyne	TRY2_BOVIN	41	33
COC(=O)[C@@H](CF)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872487969	ED	On-Demand	Anodyne	LEF	44	47
CCOC(=O)CNC(=O)C1CCN(c2nc(Cl)nc3sccc23)CC1	ZINC000872487991	GE	On-Demand	Anodyne	P2RY12	18	42
CSCC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)N(C)C	ZINC000872488005	GE	On-Demand	Anodyne	LEF	38	42
Cc1ccc(S(=O)(=O)N2CC[C@H](n3cc(Cl)cn3)C2)c(C#N)c1	ZINC000872488014	FE	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2CC[C@@H](n3cc(Cl)cn3)C2)c(C#N)c1	ZINC000872488017	FE	On-Demand	Mild	TRPV4	44	36
CCc1nnc(CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)s1	ZINC000872488049	FF	On-Demand	Anodyne	LEF	29	41
CC[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)OC	ZINC000872488068	FE	On-Demand	Anodyne	PKM	39	48
O=S(=O)(c1cccc(Br)n1)N1CCCc2occc2C1	ZINC000872488107	FF	On-Demand	Anodyne	AKR1C3	52	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCc3nccs3)cc2N1	ZINC000872488151	GF	On-Demand	Anodyne	PKM	26	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCc2occc2C1	ZINC000872488228	EG	On-Demand	Anodyne	AKR1C3	54	36
CNC(=O)[C@@H](Nc1nc2c(OC)ccc(OC)c2s1)C(C)C	ZINC000872488231	DE	On-Demand	Anodyne	ADORA2B	15	42
CCCN(CC1CC1)c1cc(C(N)=O)nc(Cl)n1	ZINC000872488234	CD	On-Demand	Anodyne	CRHR1	23	56
COc1ccc(OC)c2sc(N[C@H](CC(N)=O)C3CCOCC3)nc12	ZINC000872488255	FE	On-Demand	Anodyne	ADORA2B	15	40
COc1ccc(OC)c2sc(N[C@@H](CC(N)=O)C3CCOCC3)nc12	ZINC000872488257	FE	On-Demand	Anodyne	ADORA2B	15	40
Cc1ccc(S(=O)(=O)N2CCOCC(F)(F)C2)c(C#N)c1	ZINC000872488293	DD	On-Demand	Mild	TRPV4	46	37
CCOC(=O)CNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872488337	DC	On-Demand	Anodyne	SIRT3	69	37
CCOC(=O)CNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872488337	DC	On-Demand	Anodyne	SIRT2	55	35
CCOC(=O)CNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872488337	DC	On-Demand	Anodyne	SIRT1	54	33
CCOC(=O)CNC(=O)C1CCN(c2ncnc(F)c2C)CC1	ZINC000872488337	DC	On-Demand	Anodyne	LIMK2	21	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3=CCCOC3)cc2N1	ZINC000872488339	FE	On-Demand	Anodyne	PKM	32	42
Cn1cncc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872488357	FD	On-Demand	Anodyne	PKM	33	43
COCC[C@H](COC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872488395	GD	On-Demand	Anodyne	PKM	38	45
COCC[C@@H](COC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872488396	GD	On-Demand	Anodyne	PKM	38	45
CCCN(CC1CC1)c1cc(Cl)nnc1O	ZINC000872488532	BE	On-Demand	Anodyne	CRHR1	19	43
CO[C@@H](C)[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872488556	FE	On-Demand	Anodyne	PKM	40	48
CO[C@@H](C)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872488559	DE	On-Demand	Anodyne	LEF	37	41
CC(C)(CO)[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C1CC1	ZINC000872488571	FF	On-Demand	Anodyne	LEF	38	44
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	P2RY12	39	40
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	PDGFRB	34	42
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	GRIN2B	23	47
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	AKT2	19	41
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	AKT3	28	41
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	TGM2	38	41
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	AKT1	32	44
Cc1c(F)ncnc1N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000872488594	EE	On-Demand	Anodyne	SLC12A5	68	36
CCOC(=O)CNC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872488636	ED	On-Demand	Anodyne	SIRT3	40	31
CCOC(=O)CNC(=O)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872488636	ED	On-Demand	Anodyne	SIRT1	40	31
COC(=O)[C@@H](CF)NS(=O)(=O)c1c(C)cccc1C#N	ZINC000872488639	DC	On-Demand	Mild	ITGAV	49	36
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)N3CCCC3)C2)c(C#N)c1	ZINC000872488640	ED	On-Demand	Mild	EPHX2	33	46
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)c(C#N)c1	ZINC000872488641	ED	On-Demand	Mild	EPHX2	33	46
COc1ccc(OC)c2sc(NC[C@@H](O)c3cccnc3)nc12	ZINC000872488642	EF	On-Demand	Anodyne	ADRB2	15	42
COc1ccc(OC)c2sc(NC[C@@H](O)c3cccnc3)nc12	ZINC000872488642	EF	On-Demand	Anodyne	ADRB1	20	44
COc1ccc(OC)c2sc(NC[C@@H](O)c3cccnc3)nc12	ZINC000872488642	EF	On-Demand	Anodyne	ADRB3	67	44
COc1ccc(OC)c2sc(NC[C@H](O)c3cccnc3)nc12	ZINC000872488643	EF	On-Demand	Anodyne	ADRB2	15	42
COc1ccc(OC)c2sc(NC[C@H](O)c3cccnc3)nc12	ZINC000872488643	EF	On-Demand	Anodyne	ADRB1	20	44
COc1ccc(OC)c2sc(NC[C@H](O)c3cccnc3)nc12	ZINC000872488643	EF	On-Demand	Anodyne	ADRB3	67	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H](CO)C3CCCC3)cc2N1	ZINC000872488719	GE	On-Demand	Anodyne	PKM	41	48
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H](CO)C3CCCC3)cc2N1	ZINC000872488720	GE	On-Demand	Anodyne	PKM	41	48
C=C(CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872488772	EE	On-Demand	Mild	AOC3	25	41
C=C(CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)c1ccccc1	ZINC000872488774	EE	On-Demand	Mild	AOC3	25	41
COc1cccc(C2(CNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C)CC2)c1	ZINC000872488796	FE	On-Demand	Anodyne	ICMT	35	42
COc1cccc(C2(CNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)CC2)c1	ZINC000872488797	FE	On-Demand	Anodyne	ICMT	35	42
COCC(C)(C)N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872488818	FF	On-Demand	Anodyne	PKM	25	40
COCC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872488821	FD	On-Demand	Anodyne	LEF	42	50
COCC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872488824	FD	On-Demand	Anodyne	LEF	42	50
Cn1ncc2c(NC[C@@H](c3ccccc3)C(C)(C)CO)nc(Cl)nc21	ZINC000872488854	FG	On-Demand	Anodyne	ABL1	42	40
Cn1ncc2c(NC[C@H](c3ccccc3)C(C)(C)CO)nc(Cl)nc21	ZINC000872488855	FG	On-Demand	Anodyne	ABL1	42	40
N#Cc1ccncc1N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872488857	GF	On-Demand	Mild	GCK	41	35
COc1cccc(C(C)(C)CNc2nc(N)nc(C(F)F)n2)c1	ZINC000872488868	DF	On-Demand	Anodyne	DRTS_TOXGO	19	40
COCCCOc1cccc(CNc2ncnc(F)c2C)c1	ZINC000872488886	DF	On-Demand	Anodyne	CLK4	15	44
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	HTR1A	94	48
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	DRD2	68	44
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	DRD4	58	50
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	ADRA1D	66	43
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	HTR2A	23	40
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	ADRA1A	61	43
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	ADRA1B	50	39
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	DRD3	73	41
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	HTR7	62	42
COc1ccccc1NC(=O)CN1CCN(c2ccncc2C2CC2)CC1	ZINC000872488927	FF	On-Demand	Anodyne	SLC27A1	46	38
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1(F)F	ZINC000872488949	GG	On-Demand	Anodyne	PKM	19	40
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1(F)F	ZINC000872488951	GG	On-Demand	Anodyne	PKM	19	40
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	HTR1A	57	39
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	DRD2	43	40
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	DRD4	42	47
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	ADRA1D	34	42
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	DRD3	54	37
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	PDGFRB	70	40
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	HTR7	44	36
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	LIMK2	40	38
COc1ccccc1NC(=O)CN1CCN(c2ncnc(F)c2C)CC1	ZINC000872488968	FD	On-Demand	Anodyne	SLC27A1	61	39
NC(=O)c1cc(N2CCN(Cc3nc4ccccc4s3)CC2)nc(Cl)n1	ZINC000872488977	GE	On-Demand	Anodyne	LTA4H	19	40
NC(=O)c1cc(N2CCN(Cc3nc4ccccc4s3)CC2)nc(Cl)n1	ZINC000872488977	GE	On-Demand	Anodyne	AKR1B1	27	40
Cn1ncc2c(N3CCC(C(=O)Nc4ccc(O)cc4)CC3)nc(Cl)nc21	ZINC000872489016	GF	On-Demand	Anodyne	PIK3CA	23	44
Cn1ncc2c(N3CCC(C(=O)Nc4ccc(O)cc4)CC3)nc(Cl)nc21	ZINC000872489016	GF	On-Demand	Anodyne	MTOR	67	35
CON(C)C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872489017	GE	On-Demand	Anodyne	EPHX2	28	41
O=C(c1ccc(O)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872489031	EG	On-Demand	Anodyne	SLC18A3	42	39
Cc1c(F)ncnc1N1CCC(N2CCC[C@@H]2C(N)=O)CC1	ZINC000872489125	DC	On-Demand	Anodyne	SIRT3	49	33
Cc1c(F)ncnc1N1CCC(N2CCC[C@H]2C(N)=O)CC1	ZINC000872489130	DC	On-Demand	Anodyne	SIRT3	49	33
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872489214	DD	On-Demand	Anodyne	TRY2_BOVIN	61	33
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872489214	DD	On-Demand	Anodyne	LEF	43	56
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872489215	DD	On-Demand	Anodyne	TRY2_BOVIN	61	33
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(N)=O	ZINC000872489215	DD	On-Demand	Anodyne	LEF	43	56
CCOC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872489257	DG	On-Demand	Anodyne	SIRT3	61	39
CCOC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872489257	DG	On-Demand	Anodyne	SIRT2	53	39
CCOC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872489257	DG	On-Demand	Anodyne	SIRT1	53	34
O=C(Nc1ccc(O)cc1)C1CCN(c2ccnc3ncccc23)CC1	ZINC000872489265	EG	On-Demand	Anodyne	TRPV1	15	52
CN1C[C@H]2CCN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)[C@H]2C1	ZINC000872489305	GD	On-Demand	Anodyne	PKM	24	41
CN1C[C@@H]2[C@H](CCN2S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872489307	GD	On-Demand	Anodyne	PKM	24	41
CN1C[C@@H]2CCN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)[C@@H]2C1	ZINC000872489310	GD	On-Demand	Anodyne	PKM	24	41
CN1C[C@@H]2CCN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)[C@H]2C1	ZINC000872489312	GD	On-Demand	Anodyne	PKM	24	41
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	HTR1A	94	42
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	DRD2	76	44
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	DRD4	73	52
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	ADRA1D	64	44
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	ADRA1A	62	39
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	ADRA1B	47	38
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	DRD3	88	44
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	HTR4	20	45
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	HTR7	64	39
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	KCNQ2	42	36
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	RBP4	17	42
COc1ccccc1NC(=O)CN1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489314	GD	On-Demand	Anodyne	SLC27A1	43	39
COC[C@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872489344	CF	On-Demand	Anodyne	VCP	46	34
COC[C@@H](Nc1cc(-c2ccccc2)ncn1)C1CC1	ZINC000872489346	CF	On-Demand	Anodyne	VCP	46	34
Cc1ccc(S(=O)(=O)N2CC[C@@]3(C)[C@H](C2)C3(F)F)c(C#N)c1	ZINC000872489358	EF	On-Demand	Mild	TRPV4	46	40
Cc1ccc(S(=O)(=O)N2CC[C@@]3(C)[C@@H](C2)C3(F)F)c(C#N)c1	ZINC000872489360	EF	On-Demand	Mild	TRPV4	46	40
Cc1ccc(S(=O)(=O)N2CC[C@]3(C)[C@H](C2)C3(F)F)c(C#N)c1	ZINC000872489362	EF	On-Demand	Mild	TRPV4	46	40
Cc1ccc(S(=O)(=O)N2CC[C@]3(C)[C@@H](C2)C3(F)F)c(C#N)c1	ZINC000872489364	EF	On-Demand	Mild	TRPV4	46	40
O=S(=O)(NCCCCF)c1ccc(F)c(C(F)F)c1	ZINC000872489370	CF	On-Demand	Anodyne	LEF	23	41
CON(C)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872489427	FD	On-Demand	Mild	EPHX2	34	50
CON(C)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872489427	FD	On-Demand	Mild	TRPV4	43	35
Cc1c(F)ncnc1N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000872489428	ED	On-Demand	Anodyne	HPGD	44	34
O=C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872489448	GE	On-Demand	Anodyne	PKM	20	40
Cc1ccc(NC(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1Cl	ZINC000872489474	GG	On-Demand	Anodyne	HTR1B	16	46
Cc1ccc(NC(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1Cl	ZINC000872489474	GG	On-Demand	Anodyne	NPY2R	60	42
Cc1ccc(NC(=O)N2CCN(c3cc(Cl)nnc3O)CC2)cc1Cl	ZINC000872489474	GG	On-Demand	Anodyne	LIMK2	20	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC2(CCOCC2)C1	ZINC000872489498	EF	On-Demand	Anodyne	PKM	41	37
Nc1nc(C(F)F)nc(N2CCN(C(=O)OCc3ccccc3)CC2)n1	ZINC000872489499	FD	On-Demand	Anodyne	P2RY12	40	42
Nc1nc(C(F)F)nc(N2CCN(C(=O)OCc3ccccc3)CC2)n1	ZINC000872489499	FD	On-Demand	Anodyne	GRIN2B	23	45
Nc1nc(C(F)F)nc(N2CCN(C(=O)OCc3ccccc3)CC2)n1	ZINC000872489499	FD	On-Demand	Anodyne	TGM2	41	40
Nc1nc(C(F)F)nc(N2CCN(C(=O)OCc3ccccc3)CC2)n1	ZINC000872489499	FD	On-Demand	Anodyne	SLC12A5	62	33
O=[N+]([O-])c1ccccc1CN(c1cc(Cl)nnc1O)C1CC1	ZINC000872489501	DF	On-Demand	Bother	COLA	113	37
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCCF)cc2N1	ZINC000872489512	EF	On-Demand	Anodyne	PKM	39	48
Cc1ccc(S(=O)(=O)N2CC[C@]3(CCN(C)C3)C2)c(C#N)c1	ZINC000872489637	DD	On-Demand	Mild	TRPV4	48	40
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CCN(C)C3)C2)c(C#N)c1	ZINC000872489638	DD	On-Demand	Mild	TRPV4	48	40
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	HTR1A	98	42
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	DRD2	65	41
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	DRD4	54	50
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	ADRA1D	57	44
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	HTR1D	27	40
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	HTR1B	32	40
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	ADRA1A	56	44
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	DRD3	80	41
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	HTR7	69	40
COc1ccccc1NC(=O)CN1CCN(c2cc(C)nc3c2cnn3C)CC1	ZINC000872489648	GE	On-Demand	Anodyne	SLC27A1	43	35
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	HTR1A	101	45
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	DRD2	77	47
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	DRD4	64	49
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	ADRA1D	64	46
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	HTR2A	30	41
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	ADRA1A	63	43
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	ADRA1B	43	39
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	DRD3	83	47
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	PDGFRB	27	40
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	HTR7	69	45
COc1ccccc1NC(=O)CN1CCN(c2ccnc3ncccc23)CC1	ZINC000872489661	GE	On-Demand	Anodyne	SLC27A1	51	41
C[C@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)CN(C)C	ZINC000872489667	FE	On-Demand	Anodyne	PKM	40	48
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)CN(C)C	ZINC000872489668	FE	On-Demand	Anodyne	PKM	40	48
Cc1ccc(S(=O)(=O)N2CC[C@](CO)(c3ccccc3)C2)c(C#N)c1	ZINC000872489695	FE	On-Demand	Mild	TRPV4	47	39
Cc1ccc(S(=O)(=O)N2CC[C@@](CO)(c3ccccc3)C2)c(C#N)c1	ZINC000872489696	FE	On-Demand	Mild	TRPV4	47	39
O=C(OCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489697	EE	On-Demand	Anodyne	GRIN2B	24	44
O=C(OCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489697	EE	On-Demand	Anodyne	TGM2	45	42
O=C(OCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489697	EE	On-Demand	Anodyne	F13A1	42	41
O=C(OCc1ccccc1)N1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489697	EE	On-Demand	Anodyne	SLC12A5	66	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)S(=O)(=O)[C@@H](C)C2)c(C#N)c1	ZINC000872489765	ED	On-Demand	Mild	TRPV4	44	37
Cc1ccc(S(=O)(=O)N2C[C@H](C)S(=O)(=O)[C@H](C)C2)c(C#N)c1	ZINC000872489766	ED	On-Demand	Mild	TRPV4	44	37
Cc1ccc(S(=O)(=O)N2C[C@@H](C)S(=O)(=O)[C@H](C)C2)c(C#N)c1	ZINC000872489767	ED	On-Demand	Mild	TRPV4	44	37
O=S(=O)(N[C@H](CO)C1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872489779	EF	On-Demand	Anodyne	LEF	39	51
O=S(=O)(N[C@@H](CO)C1CCCC1)c1ccc(F)c(C(F)F)c1	ZINC000872489780	EF	On-Demand	Anodyne	LEF	39	51
COc1ccc(OC)c2sc(N3CCC(C(=O)NCCCO)CC3)nc12	ZINC000872489792	GE	On-Demand	Anodyne	DRD3	19	40
COc1ccc(OC)c2sc(N3CCC(C(=O)NCCCO)CC3)nc12	ZINC000872489792	GE	On-Demand	Anodyne	TBK1	58	34
C[C@@H](Nc1nc(N)nc(C(F)F)n1)[C@H](O)Cc1ccccc1	ZINC000872489843	DD	On-Demand	Anodyne	TPH1	61	38
CN1CC[C@@]2(CCN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)C2)C1	ZINC000872489845	GE	On-Demand	Anodyne	PKM	21	41
C[C@@H](Nc1nc(N)nc(C(F)F)n1)[C@@H](O)Cc1ccccc1	ZINC000872489846	DD	On-Demand	Anodyne	TPH1	61	38
CCOC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872489885	ED	On-Demand	Anodyne	SIRT3	53	32
CCOC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872489885	ED	On-Demand	Anodyne	SIRT2	43	32
CCOC(=O)CCC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872489885	ED	On-Demand	Anodyne	SIRT1	40	31
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3CC(F)(F)C3)cc2N1	ZINC000872489891	GF	On-Demand	Anodyne	PKM	37	44
CS(=O)(=O)CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872489927	GE	On-Demand	Anodyne	PKM	44	38
CCOC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489976	DE	On-Demand	Anodyne	SIRT3	59	36
CCOC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489976	DE	On-Demand	Anodyne	SIRT2	49	36
CCOC(=O)CCC1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872489976	DE	On-Demand	Anodyne	SIRT1	47	36
COCC(C)(C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872489978	FF	On-Demand	Anodyne	PKM	38	46
CO[C@@](C)(CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C1CC1	ZINC000872489993	GF	On-Demand	Anodyne	PKM	37	44
O=C(NCCCO)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872490020	ED	On-Demand	Anodyne	GSK3A	18	40
O=C(NCCCO)C1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872490020	ED	On-Demand	Anodyne	F11	20	41
O=C(Nc1ccc(O)cc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872490023	EE	On-Demand	Anodyne	NPY2R	20	41
O=C(Nc1ccc(O)cc1)C1CCN(c2cc(Cl)nnc2O)CC1	ZINC000872490023	EE	On-Demand	Anodyne	MAPK1	21	44
COCC[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490029	FE	On-Demand	Anodyne	CASP3	54	42
COCC[C@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490029	FE	On-Demand	Anodyne	CASP7	70	44
COCC[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490030	FE	On-Demand	Anodyne	CASP3	54	42
COCC[C@@H]1COCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490030	FE	On-Demand	Anodyne	CASP7	70	44
Cc1ccoc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872490043	FF	On-Demand	Anodyne	PKM	42	51
Oc1nnc(Cl)cc1N1CCN(Cc2nc3ccccc3s2)CC1	ZINC000872490046	FF	On-Demand	Anodyne	DRD4	27	47
Cc1c(F)ncnc1NCc1cccc(COCC(F)(F)F)c1	ZINC000872490075	EH	On-Demand	Anodyne	CLK4	17	40
CCOC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872490087	CE	On-Demand	Anodyne	SIRT3	72	38
CCOC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872490087	CE	On-Demand	Anodyne	SIRT2	60	38
CCOC(=O)CCC1CCN(c2ncnc(F)c2C)CC1	ZINC000872490087	CE	On-Demand	Anodyne	SIRT1	59	37
N#Cc1ccc(O[C@@H]2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C2)nc1	ZINC000872490092	GF	On-Demand	Mild	GCKR	50	31
N#Cc1ccc(O[C@H]2CCN(S(=O)(=O)c3ccc(F)c(C(F)F)c3)C2)nc1	ZINC000872490093	GF	On-Demand	Mild	GCKR	50	31
Cc1ccc(S(=O)(=O)N2CC[C@@H](CS(C)(=O)=O)C2)c(C#N)c1	ZINC000872490115	EC	On-Demand	Mild	TRPV4	43	37
Cc1ccc(S(=O)(=O)N2CC[C@H](CS(C)(=O)=O)C2)c(C#N)c1	ZINC000872490116	EC	On-Demand	Mild	TRPV4	43	37
CCC1(CC)CN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872490146	CF	On-Demand	Mild	TRPV4	42	33
Oc1nnc(Cl)cc1N1CC[C@@H](OCc2ccncc2)C1	ZINC000872490174	DE	On-Demand	Anodyne	LIPG	47	41
Oc1nnc(Cl)cc1N1CC[C@H](OCc2ccncc2)C1	ZINC000872490175	DE	On-Demand	Anodyne	LIPG	47	41
Cc1c(F)ncnc1NCCNS(=O)(=O)c1ccc(Cl)s1	ZINC000872490193	FE	On-Demand	Anodyne	CCR4	41	33
COC(=O)[C@H](Cc1ccncc1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490209	GE	On-Demand	Anodyne	TRY2_BOVIN	66	35
COC(=O)[C@H](Cc1ccncc1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490209	GE	On-Demand	Anodyne	ST14	51	35
COC(=O)[C@H](Cc1ccncc1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872490209	GE	On-Demand	Anodyne	LEF	36	41
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000872490233	EE	On-Demand	Anodyne	TRPV1	17	49
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000872490233	EE	On-Demand	Anodyne	EPHX2	16	46
Cc1c(F)ncnc1N1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000872490233	EE	On-Demand	Anodyne	LIMK2	30	55
Cc1ccc(S(=O)(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c(C#N)c1	ZINC000872490239	CC	On-Demand	Mild	TRPV4	46	38
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872490256	ED	On-Demand	Anodyne	PTR1	44	30
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1Nc1nc(N)nc(C(F)F)n1	ZINC000872490257	ED	On-Demand	Anodyne	PTR1	44	30
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CC1)OCCCO2	ZINC000872490286	FF	On-Demand	Anodyne	PKM	49	42
NC(=O)c1cc(N2CCC(CCCN3CCCC3)CC2)nc(Cl)n1	ZINC000872490418	FE	On-Demand	Anodyne	NPY1R	40	33
NC(=O)c1cc(N2CCC(CCCN3CCCC3)CC2)nc(Cl)n1	ZINC000872490418	FE	On-Demand	Anodyne	SIRT3	50	43
NC(=O)c1cc(N2CCC(CCCN3CCCC3)CC2)nc(Cl)n1	ZINC000872490418	FE	On-Demand	Anodyne	SIRT2	40	43
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000872490422	EF	On-Demand	Anodyne	PDE3A	16	44
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000872490422	EF	On-Demand	Anodyne	DCK	31	41
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000872490422	EF	On-Demand	Anodyne	PDE3B	18	44
Nc1nc(C(F)F)nc(N2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000872490422	EF	On-Demand	Anodyne	SCD1	52	44
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000872490424	EF	On-Demand	Anodyne	PDE3A	16	44
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000872490424	EF	On-Demand	Anodyne	DCK	31	41
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000872490424	EF	On-Demand	Anodyne	PDE3B	18	44
Nc1nc(C(F)F)nc(N2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000872490424	EF	On-Demand	Anodyne	SCD1	52	44
O[C@@H]1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872490482	CF	On-Demand	Anodyne	ITK	28	40
O[C@@H]1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872490482	CF	On-Demand	Anodyne	MAPK8	17	40
O[C@@H]1CC[C@@H](Nc2cc(-c3ccccc3)ncn2)CC1	ZINC000872490482	CF	On-Demand	Anodyne	CD38	16	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(CCO)CC3)cc2N1	ZINC000872490511	FD	On-Demand	Anodyne	PKM	38	45
C[C@@H](F)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872490528	EF	On-Demand	Anodyne	PKM	41	49
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872490531	EG	On-Demand	Anodyne	PDE3A	36	48
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872490531	EG	On-Demand	Anodyne	PDE3B	42	48
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872490531	EG	On-Demand	Anodyne	SCD1	59	51
Oc1nnc(Cl)cc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872490531	EG	On-Demand	Anodyne	SCD	27	42
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872490532	EG	On-Demand	Anodyne	PDE3A	36	48
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872490532	EG	On-Demand	Anodyne	PDE3B	42	48
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872490532	EG	On-Demand	Anodyne	SCD1	59	51
Oc1nnc(Cl)cc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872490532	EG	On-Demand	Anodyne	SCD	27	42
Cc1ccc(S(=O)(=O)N2C[C@H](C)N(C)[C@H](C)C2)c(C#N)c1	ZINC000872490549	DD	On-Demand	Mild	TRPV4	43	35
CCC1(CC)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872490555	CF	On-Demand	Mild	TRPV4	55	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCn4ccnc43)cc2N1	ZINC000872490653	GE	On-Demand	Anodyne	PKM	24	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCn4ccnc43)cc2N1	ZINC000872490654	GE	On-Demand	Anodyne	PKM	24	41
CC(=O)OC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872490679	CF	On-Demand	Anodyne	DCK	39	41
CC(=O)OC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872490679	CF	On-Demand	Anodyne	SCD1	44	42
CS(=O)(=O)N1CC[C@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872490689	ED	On-Demand	Anodyne	VCP	55	39
CS(=O)(=O)N1CC[C@@H](CNc2cc(-c3ccccc3)ncn2)C1	ZINC000872490690	ED	On-Demand	Anodyne	VCP	55	39
Cc1ccc(S(=O)(=O)N2CC[C@]3(CCCN(C)C3)C2)c(C#N)c1	ZINC000872490708	ED	On-Demand	Mild	TRPV4	46	38
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CCCN(C)C3)C2)c(C#N)c1	ZINC000872490709	ED	On-Demand	Mild	TRPV4	46	38
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	KLK3	41	34
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	CTSB	43	38
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	CYSP_TRYCR	40	34
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	CAPNS1	59	33
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	CAPN1	64	38
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	CAPN2	101	39
C[C@H](CC(=O)OCc1ccccc1)Nc1cc(Cl)nnc1O	ZINC000872490740	DF	On-Demand	Anodyne	NPR	62	33
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@@H](O)CC3)cc2N1	ZINC000872490753	FE	On-Demand	Anodyne	PKM	30	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CCC[C@H](O)CC3)cc2N1	ZINC000872490754	FE	On-Demand	Anodyne	PKM	30	43
COc1ccc(OC)c2sc(N[C@@H]3CCN(C(C)=O)C[C@@H]3C)nc12	ZINC000872490794	EF	On-Demand	Anodyne	ADORA2B	18	41
COc1ccc(OC)c2sc(N[C@H]3CCN(C(C)=O)C[C@@H]3C)nc12	ZINC000872490796	EF	On-Demand	Anodyne	ADORA2B	18	41
COc1ccc(OC)c2sc(N[C@H]3CCN(C(C)=O)C[C@H]3C)nc12	ZINC000872490797	EF	On-Demand	Anodyne	ADORA2B	18	41
COc1ccc(OC)c2sc(N[C@@H]3CCN(C(C)=O)C[C@H]3C)nc12	ZINC000872490799	EF	On-Demand	Anodyne	ADORA2B	18	41
Cc1c(F)ncnc1N1CCC(CCCN2CCCC2)CC1	ZINC000872490839	DG	On-Demand	Anodyne	SIRT3	49	44
Cc1c(F)ncnc1N1CCC(CCCN2CCCC2)CC1	ZINC000872490839	DG	On-Demand	Anodyne	SIRT2	38	44
Oc1nnc(Cl)cc1NCCN1CCC1	ZINC000872490840	BC	On-Demand	Anodyne	HNMT	52	40
NC(=O)c1cc(N2CC[C@@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490883	FF	On-Demand	Anodyne	PDE3A	19	45
NC(=O)c1cc(N2CC[C@@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490883	FF	On-Demand	Anodyne	DCK	27	42
NC(=O)c1cc(N2CC[C@@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490883	FF	On-Demand	Anodyne	PDE3B	21	45
NC(=O)c1cc(N2CC[C@@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490883	FF	On-Demand	Anodyne	SCD1	62	63
NC(=O)c1cc(N2CC[C@@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490883	FF	On-Demand	Anodyne	SCD	26	43
NC(=O)c1cc(N2CC[C@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490884	FF	On-Demand	Anodyne	PDE3A	19	45
NC(=O)c1cc(N2CC[C@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490884	FF	On-Demand	Anodyne	DCK	27	42
NC(=O)c1cc(N2CC[C@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490884	FF	On-Demand	Anodyne	PDE3B	21	45
NC(=O)c1cc(N2CC[C@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490884	FF	On-Demand	Anodyne	SCD1	62	63
NC(=O)c1cc(N2CC[C@H](Oc3ccccc3Cl)C2)nc(Cl)n1	ZINC000872490884	FF	On-Demand	Anodyne	SCD	26	43
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872490898	FH	On-Demand	Anodyne	P2RY12	100	34
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872490898	FH	On-Demand	Anodyne	VCP	48	35
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872490903	FH	On-Demand	Anodyne	P2RY12	100	34
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872490903	FH	On-Demand	Anodyne	VCP	48	35
c1cnc2nccc(N3CCC(CCCN4CCCC4)CC3)c2c1	ZINC000872490936	DH	On-Demand	Anodyne	DRD2	15	42
c1cnc2nccc(N3CCC(CCCN4CCCC4)CC3)c2c1	ZINC000872490936	DH	On-Demand	Anodyne	NPY1R	43	36
c1cnc2nccc(N3CCC(CCCN4CCCC4)CC3)c2c1	ZINC000872490936	DH	On-Demand	Anodyne	HNMT	89	38
COc1ccc(OC)c2sc(NC[C@@H]3CCN(S(C)(=O)=O)C3)nc12	ZINC000872491059	FE	On-Demand	Anodyne	ADORA2B	15	40
COc1ccc(OC)c2sc(NC[C@H]3CCN(S(C)(=O)=O)C3)nc12	ZINC000872491060	FE	On-Demand	Anodyne	ADORA2B	15	40
Cn1ncc2c(N[C@@H]3CC[C@@H](O)CC3)nc(Cl)nc21	ZINC000872491088	CD	On-Demand	Anodyne	MERTK	40	34
Cn1ncc2c(N[C@@H]3CC[C@@H](O)CC3)nc(Cl)nc21	ZINC000872491088	CD	On-Demand	Anodyne	Q4VQ11_PIG	59	37
O[C@@H]1CC[C@@H](Nc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872491100	DH	On-Demand	Anodyne	ITK	16	40
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)(C)O	ZINC000872491133	EF	On-Demand	Anodyne	LEF	37	44
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)(C)O	ZINC000872491134	EF	On-Demand	Anodyne	LEF	37	44
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872491156	DG	On-Demand	Anodyne	PDE3A	52	62
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872491156	DG	On-Demand	Anodyne	DCK	57	46
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872491156	DG	On-Demand	Anodyne	PDE3B	57	62
Cc1c(F)ncnc1N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000872491156	DG	On-Demand	Anodyne	SCD1	53	45
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872491157	DG	On-Demand	Anodyne	PDE3A	52	62
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872491157	DG	On-Demand	Anodyne	DCK	57	46
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872491157	DG	On-Demand	Anodyne	PDE3B	57	62
Cc1c(F)ncnc1N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000872491157	DG	On-Demand	Anodyne	SCD1	53	45
CN(C)CC1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872491237	FD	On-Demand	Anodyne	PKM	29	42
Nc1nc(N[C@@H]2CCN(c3ccccn3)C2)nc(C(F)F)n1	ZINC000872491299	DD	On-Demand	Anodyne	HRH4	52	42
Nc1nc(N[C@H]2CCN(c3ccccn3)C2)nc(C(F)F)n1	ZINC000872491300	DD	On-Demand	Anodyne	HRH4	52	42
CN(CCF)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491368	EE	On-Demand	Anodyne	PKM	36	42
CCOc1cc(Cl)ccc1CNc1nc(N)nc(C(F)F)n1	ZINC000872491424	EG	On-Demand	Anodyne	AGPAT2	34	44
Oc1nnc(Cl)cc1N1CCC(CCCN2CCCC2)CC1	ZINC000872491425	DF	On-Demand	Anodyne	SIRT3	29	41
Oc1nnc(Cl)cc1N1CCC(CCCN2CCCC2)CC1	ZINC000872491425	DF	On-Demand	Anodyne	SIRT2	25	41
C[C@@H](CCO)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491448	FE	On-Demand	Anodyne	PKM	40	47
C[C@H](CCO)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491449	FE	On-Demand	Anodyne	PKM	40	47
c1ccc(-c2cc(NCCN3CCC3)ncn2)cc1	ZINC000872491463	CE	On-Demand	Anodyne	HNMT	71	41
c1ccc(-c2cc(NCCN3CCC3)ncn2)cc1	ZINC000872491463	CE	On-Demand	Anodyne	TNK2	25	41
Cn1ncc2c(N[C@H]3CCOC3)nc(Cl)nc21	ZINC000872491483	CD	On-Demand	Anodyne	Q4VQ11_PIG	51	46
Cn1ncc2c(N[C@@H]3CCOC3)nc(Cl)nc21	ZINC000872491485	CD	On-Demand	Anodyne	Q4VQ11_PIG	51	46
CC#CCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491525	EE	On-Demand	Mild	PKM	26	40
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872491527	ED	On-Demand	Anodyne	MMP7	20	44
C[C@H]1CCC[C@@]1(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491531	GE	On-Demand	Anodyne	PKM	36	43
C[C@@H]1CCC[C@]1(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491533	GE	On-Demand	Anodyne	PKM	36	43
C[C@H]1CCC[C@]1(O)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491535	GE	On-Demand	Anodyne	PKM	36	43
Cc1cccc(C#N)c1S(=O)(=O)NCCCCCN1CCCC1	ZINC000872491584	EE	On-Demand	Mild	HTR1A	15	43
Cc1cccc(C#N)c1S(=O)(=O)NCCCCCN1CCCC1	ZINC000872491584	EE	On-Demand	Mild	DRD2	17	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCCCN1CCCC1	ZINC000872491584	EE	On-Demand	Mild	DRD3	18	41
Cc1cccc(C#N)c1S(=O)(=O)NCCCCCN1CCCC1	ZINC000872491584	EE	On-Demand	Mild	HRH3	15	40
Cc1cccc(C#N)c1S(=O)(=O)NCCCCCN1CCCC1	ZINC000872491584	EE	On-Demand	Mild	HNMT	47	38
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C(C)(C)O	ZINC000872491592	FE	On-Demand	Anodyne	PKM	39	46
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C(C)(C)O	ZINC000872491594	FE	On-Demand	Anodyne	PKM	39	46
O=S(=O)(N[C@@H](C1CC1)C1(CO)CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872491606	GF	On-Demand	Anodyne	LEF	26	42
O=S(=O)(N[C@H](C1CC1)C1(CO)CCOCC1)c1ccc(F)c(C(F)F)c1	ZINC000872491608	GF	On-Demand	Anodyne	LEF	26	42
O=S(=O)(N[C@@H]1CCn2ccnc21)c1ccc(F)c(C(F)F)c1	ZINC000872491686	EE	On-Demand	Anodyne	F10	18	40
O=S(=O)(N[C@H]1CCn2ccnc21)c1ccc(F)c(C(F)F)c1	ZINC000872491690	EE	On-Demand	Anodyne	F10	18	40
C#CCN(C)CCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491691	GD	On-Demand	Mild	PKM	33	45
CC(=O)OC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872491713	EG	On-Demand	Anodyne	DCK	35	40
CC(=O)OC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872491713	EG	On-Demand	Anodyne	GRM5	15	44
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)[C@@H]1C	ZINC000872491746	EF	On-Demand	Anodyne	PKM	30	42
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)[C@H]1C	ZINC000872491747	EF	On-Demand	Anodyne	PKM	30	42
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)[C@@H]1C	ZINC000872491748	EF	On-Demand	Anodyne	PKM	30	42
C[C@H]1[C@H](C)CN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491749	EF	On-Demand	Anodyne	PKM	30	42
NC(=O)c1cc(N[C@@H]2CCN(c3ccccn3)C2)nc(Cl)n1	ZINC000872491753	DD	On-Demand	Anodyne	HRH4	41	40
NC(=O)c1cc(N[C@@H]2CCN(c3ccccn3)C2)nc(Cl)n1	ZINC000872491753	DD	On-Demand	Anodyne	PRKD1	47	38
NC(=O)c1cc(N[C@H]2CCN(c3ccccn3)C2)nc(Cl)n1	ZINC000872491754	DD	On-Demand	Anodyne	HRH4	41	40
NC(=O)c1cc(N[C@H]2CCN(c3ccccn3)C2)nc(Cl)n1	ZINC000872491754	DD	On-Demand	Anodyne	PRKD1	47	38
CC(=O)OC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872491759	CC	On-Demand	Anodyne	SCD1	28	45
CS(=O)(=O)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872491836	GF	On-Demand	Anodyne	ADRA1D	24	41
CS(=O)(=O)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872491836	GF	On-Demand	Anodyne	ADRA1A	17	41
CS(=O)(=O)CC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872491836	GF	On-Demand	Anodyne	ADRA1B	18	41
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	CASP3	32	40
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	MMP13	18	44
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	MMP3	19	44
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	CASP7	45	34
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	MMP7	25	44
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872491838	EF	On-Demand	Anodyne	MMP1	22	44
CNC(=O)CCCN(C)c1cc(-c2ccccc2)ncn1	ZINC000872491840	CE	On-Demand	Anodyne	GSK3A	25	45
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872491849	DD	On-Demand	Mild	EPHX2	18	41
CC(=O)CN(C(C)C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491862	FF	On-Demand	Anodyne	PKM	28	40
O[C@@H]1CC[C@@H](Nc2nc3c(F)cc(Cl)cc3s2)CC1	ZINC000872491870	DH	On-Demand	Anodyne	ITK	23	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000872491882	DE	On-Demand	Anodyne	PKM	42	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H](O)CC1	ZINC000872491883	DE	On-Demand	Anodyne	PKM	42	38
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC4(CC4)C3)cc2N1	ZINC000872491918	EE	On-Demand	Anodyne	PKM	26	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC4(CC4)C3)cc2N1	ZINC000872491918	EE	On-Demand	Anodyne	TRPV4	40	31
CC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872491938	GF	On-Demand	Anodyne	PKM	19	42
Cc1cccc(C#N)c1S(=O)(=O)N1CC2(CC2)C1	ZINC000872491971	CD	On-Demand	Mild	TRPV4	41	32
c1ccc(N2CC[C@H](N=c3cc[nH]cc3C3CC3)C2)nc1	ZINC000872491973	CE	On-Demand	Anodyne	DRD4	18	41
c1ccc(N2CC[C@H](N=c3cc[nH]cc3C3CC3)C2)nc1	ZINC000872491973	CE	On-Demand	Anodyne	EBP	24	41
c1ccc(N2CC[C@@H](N=c3cc[nH]cc3C3CC3)C2)nc1	ZINC000872491974	CE	On-Demand	Anodyne	DRD4	18	41
c1ccc(N2CC[C@@H](N=c3cc[nH]cc3C3CC3)C2)nc1	ZINC000872491974	CE	On-Demand	Anodyne	EBP	24	41
CCOC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CC12COC2	ZINC000872491999	FD	On-Demand	Mild	TRPV4	45	37
CCOC(=O)[C@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)CC12COC2	ZINC000872492000	FD	On-Demand	Mild	TRPV4	45	37
O=c1cccc2n1C[C@H]1C[C@@H]2CN(S(=O)(=O)CC2CC3(CCC3)C2)C1	ZINC000872492034	FE	On-Demand	Anodyne	CHRNA4	28	51
COC[C@@]1(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872492040	DD	On-Demand	Mild	TRPV4	52	44
COC[C@]1(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872492041	DD	On-Demand	Mild	TRPV4	52	44
Cc1ccc(S(=O)(=O)N2CC[C@](O)(C(F)F)C2)c(C#N)c1	ZINC000872492074	DD	On-Demand	Mild	TRPV4	51	43
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(C(F)F)C2)c(C#N)c1	ZINC000872492075	DD	On-Demand	Mild	TRPV4	51	43
O=S(=O)(N[C@@H]1CCCN(CCCO)C1)c1ccc(F)c(C(F)F)c1	ZINC000872492104	FD	On-Demand	Anodyne	HTR7	20	52
O=S(=O)(N[C@@H]1CCCN(CCCO)C1)c1ccc(F)c(C(F)F)c1	ZINC000872492104	FD	On-Demand	Anodyne	SFRP1	37	45
O=S(=O)(N[C@H]1CCCN(CCCO)C1)c1ccc(F)c(C(F)F)c1	ZINC000872492105	FD	On-Demand	Anodyne	HTR7	20	52
O=S(=O)(N[C@H]1CCCN(CCCO)C1)c1ccc(F)c(C(F)F)c1	ZINC000872492105	FD	On-Demand	Anodyne	SFRP1	37	45
COC[C@]1(CO)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872492155	DC	On-Demand	Mild	TRPV4	53	42
OCCOC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872492157	EF	On-Demand	Anodyne	DCK	33	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3CCCC[C@@H]3O)cc2N1	ZINC000872492171	GE	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3CCCC[C@H]3O)cc2N1	ZINC000872492172	GE	On-Demand	Anodyne	PKM	36	44
O=S(=O)(NCCN1CCC(O)CC1)c1cccc(Br)n1	ZINC000872492207	FC	On-Demand	Anodyne	HTR7	30	40
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)C[C@@H](C)C2)c(C#N)c1	ZINC000872492213	GE	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)C[C@H](C)C2)c(C#N)c1	ZINC000872492214	GE	On-Demand	Mild	TRPV4	41	32
Cc1ccc(S(=O)(=O)N2CC[S@](=O)C(C)(C)CC2)c(C#N)c1	ZINC000872492221	ED	On-Demand	Mild	TRPV4	46	40
Cc1ccc(S(=O)(=O)N2CC[S@@](=O)C(C)(C)CC2)c(C#N)c1	ZINC000872492222	ED	On-Demand	Mild	TRPV4	46	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@H]3C3CC3)cc2N1	ZINC000872492257	FF	On-Demand	Anodyne	PKM	17	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@@H]3C3CC3)cc2N1	ZINC000872492258	FF	On-Demand	Anodyne	PKM	17	40
COCC1(O)CN(S(=O)(=O)c2cccc(Br)n2)C1	ZINC000872492264	EC	On-Demand	Anodyne	TRPV4	40	30
CCC1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)COC1	ZINC000872492311	FE	On-Demand	Anodyne	PKM	38	45
C[C@@H](CCCCO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492380	FE	On-Demand	Anodyne	PKM	39	44
Cc1ccc(S(=O)(=O)N2CC[C@H](O)CC(C)(C)C2)c(C#N)c1	ZINC000872492458	DE	On-Demand	Mild	TRPV4	44	35
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)CC(C)(C)C2)c(C#N)c1	ZINC000872492459	DE	On-Demand	Mild	TRPV4	44	35
CCC1(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872492463	EF	On-Demand	Anodyne	PKM	40	49
Cc1ccc(S(=O)(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C#N)c1	ZINC000872492518	FD	On-Demand	Mild	CHRNA4	27	51
CC[C@@H](CNS(C)(=O)=O)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492587	FD	On-Demand	Anodyne	LEF	33	41
NC(=O)c1cccc(CN(C2CC2)S(=O)(=O)c2ccc(F)c(C(F)F)c2)c1	ZINC000872492588	GG	On-Demand	Anodyne	ST14	45	33
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H](O)C(F)F	ZINC000872492602	GE	On-Demand	Anodyne	PKM	38	44
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H](O)C(F)F	ZINC000872492604	GE	On-Demand	Anodyne	PKM	38	44
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H](O)C(F)F	ZINC000872492606	GE	On-Demand	Anodyne	PKM	38	44
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H](O)C(F)F	ZINC000872492608	GE	On-Demand	Anodyne	PKM	38	44
C#C[C@@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492618	EC	On-Demand	Mild	PKM	38	44
C#C[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492620	EC	On-Demand	Mild	PKM	38	44
COCC1(O)CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872492622	ED	On-Demand	Anodyne	TRPV4	48	39
C[C@@H](CCCCO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492638	EF	On-Demand	Anodyne	LEF	39	42
Oc1nnc(Cl)cc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492645	EH	On-Demand	Anodyne	HRH1	15	41
Oc1nnc(Cl)cc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492645	EH	On-Demand	Anodyne	DCK	25	40
Oc1nnc(Cl)cc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492645	EH	On-Demand	Anodyne	CCR3	17	41
Oc1nnc(Cl)cc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492645	EH	On-Demand	Anodyne	SCD1	75	56
Oc1nnc(Cl)cc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492645	EH	On-Demand	Anodyne	SCD	34	43
COCCN(CC(=O)OC)c1cc(-c2ccccc2)ncn1	ZINC000872492654	DD	On-Demand	Anodyne	LTB4R	19	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCCC[C@H]1C(=O)NCC(F)F	ZINC000872492661	FD	On-Demand	Mild	ITGA4	30	40
Cc1cccc(C#N)c1S(=O)(=O)N1CCCC[C@H]1C(=O)NCC(F)F	ZINC000872492661	FD	On-Demand	Mild	CAPNS1	15	40
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCCN(CCCO)C1	ZINC000872492666	EC	On-Demand	Mild	SLC6A1	66	36
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCCN(CCCO)C1	ZINC000872492668	EC	On-Demand	Mild	SLC6A1	66	36
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(CC(F)(F)F)CC1	ZINC000872492674	GG	On-Demand	Anodyne	PKM	43	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCCN(CC(F)(F)F)CC1	ZINC000872492674	GG	On-Demand	Anodyne	GCK	56	33
CNC(=O)C[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492683	DD	On-Demand	Anodyne	LEF	41	46
CNC(=O)C[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492684	DD	On-Demand	Anodyne	LEF	41	46
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	PDE3A	42	53
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	DCK	55	46
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	PDE3B	47	53
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	SCN5A	46	34
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	SCD1	67	49
Cc1c(F)ncnc1N1CCC(Oc2ccccc2Cl)CC1	ZINC000872492742	DH	On-Demand	Anodyne	SCD	35	45
O=S1(=O)CCC(CNc2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872492785	FG	On-Demand	Anodyne	VCP	40	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC3=CCOCC3)cc2N1	ZINC000872492796	FE	On-Demand	Anodyne	PKM	35	42
CC[C@H](C)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872492797	DD	On-Demand	Mild	TRPV4	44	36
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c2nccn21	ZINC000872492802	GF	On-Demand	Anodyne	PKM	26	41
CC/C=C\CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492809	EF	On-Demand	Anodyne	PKM	39	48
C[C@@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c2nccn21	ZINC000872492810	GF	On-Demand	Anodyne	PKM	26	41
CC/C=C/CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492811	EF	On-Demand	Anodyne	PKM	39	48
CO[C@@H](C1CC1)[C@@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492821	GF	On-Demand	Anodyne	PKM	35	44
CO[C@@H](C1CC1)[C@H](C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492825	GF	On-Demand	Anodyne	PKM	35	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC3(CO)CC3)cc2N1	ZINC000872492842	FE	On-Demand	Anodyne	PKM	38	46
COCC1(O)CN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872492870	CC	On-Demand	Mild	TRPV4	55	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3(CF)CCOCC3)cc2N1	ZINC000872492876	GE	On-Demand	Anodyne	PKM	36	43
C#C[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492883	CD	On-Demand	Mild	LEF	32	41
C#C[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872492885	CD	On-Demand	Mild	LEF	32	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](F)C2)c(C#N)c1	ZINC000872492894	CD	On-Demand	Mild	EPHX2	16	42
Cc1ccc(S(=O)(=O)N2CC[C@@H](F)C2)c(C#N)c1	ZINC000872492894	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CC[C@H](F)C2)c(C#N)c1	ZINC000872492896	CD	On-Demand	Mild	EPHX2	16	42
Cc1ccc(S(=O)(=O)N2CC[C@H](F)C2)c(C#N)c1	ZINC000872492896	CD	On-Demand	Mild	TRPV4	43	35
Nc1nc(C(F)F)nc(N2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000872492900	FG	On-Demand	Anodyne	DCK	32	42
Nc1nc(C(F)F)nc(N2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000872492900	FG	On-Demand	Anodyne	SCD1	65	48
Nc1nc(C(F)F)nc(N2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000872492900	FG	On-Demand	Anodyne	SCD	32	40
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@H](F)C3)cc2N1	ZINC000872492922	EE	On-Demand	Anodyne	PKM	21	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC[C@@H](F)C3)cc2N1	ZINC000872492923	EE	On-Demand	Anodyne	PKM	21	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@H]3CO)cc2N1	ZINC000872492926	FE	On-Demand	Anodyne	PKM	34	43
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872492934	EF	On-Demand	Anodyne	ADRA1D	31	45
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872492934	EF	On-Demand	Anodyne	ADRA1A	22	45
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872492934	EF	On-Demand	Anodyne	ADRA1B	24	45
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872492934	EF	On-Demand	Anodyne	SLC6A3	21	40
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872492934	EF	On-Demand	Anodyne	DCK	22	41
CC(=O)CCCCCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872492943	GG	On-Demand	Anodyne	PKM	38	47
C[C@@H](CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)N(C)C	ZINC000872492949	FD	On-Demand	Anodyne	PKM	43	52
Cn1ncc2c(N[C@@H]3CCOC(C)(C)C3)nc(Cl)nc21	ZINC000872492983	CE	On-Demand	Anodyne	Q4VQ11_PIG	49	35
Cn1ncc2c(N[C@H]3CCOC(C)(C)C3)nc(Cl)nc21	ZINC000872492985	CE	On-Demand	Anodyne	Q4VQ11_PIG	49	35
Cc1cccc(C#N)c1S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000872492991	FD	On-Demand	Mild	CHRNA4	27	47
N#CC[C@@H]1CC[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872493006	GF	On-Demand	Mild	PKM	24	41
O=S(=O)(CCCc1ccc(C(F)(F)F)cc1)NCCN1CCC(O)CC1	ZINC000872493023	GE	On-Demand	Anodyne	SLC6A5	31	40
CCN(C)C(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872493045	FF	On-Demand	Anodyne	MMP13	27	43
CCN(C)C(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872493045	FF	On-Demand	Anodyne	MMP2	15	43
CCN(C)C(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872493045	FF	On-Demand	Anodyne	MMP12	75	38
CCN(C)C(=O)[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(C)C	ZINC000872493045	FF	On-Demand	Anodyne	LEF	42	49
Cc1ccc(S(=O)(=O)N2CC[C@@H](OC(=O)N(C)C)C2)c(C#N)c1	ZINC000872493077	ED	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2CC[C@H](OC(=O)N(C)C)C2)c(C#N)c1	ZINC000872493078	ED	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c(C#N)c1	ZINC000872493096	FE	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c(C#N)c1	ZINC000872493097	FE	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c(C#N)c1	ZINC000872493098	FE	On-Demand	Mild	TRPV4	46	37
Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c(C#N)c1	ZINC000872493099	FE	On-Demand	Mild	TRPV4	46	37
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1cccc(Br)n1)C2	ZINC000872493110	FD	On-Demand	Anodyne	SLC6A3	19	41
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1cccc(Br)n1)C2	ZINC000872493110	FD	On-Demand	Anodyne	GLRA1	42	32
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872493133	ED	On-Demand	Anodyne	MMP7	20	44
Cc1cccc(C#N)c1S(=O)(=O)NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000872493182	DD	On-Demand	Mild	GLRA1	42	32
O=S(=O)(NCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493191	FD	On-Demand	Anodyne	HTR2A	21	43
O=S(=O)(NCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493191	FD	On-Demand	Anodyne	HTR7	41	44
O=S(=O)(NCCN1CCC(O)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493191	FD	On-Demand	Anodyne	HTR6	18	43
O=S(=O)(NC1CCC(OC(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493199	FH	On-Demand	Anodyne	ADRA1D	24	42
O=S(=O)(NC1CCC(OC(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493199	FH	On-Demand	Anodyne	ADRA1A	17	42
O=S(=O)(NC1CCC(OC(F)F)CC1)c1ccc(F)c(C(F)F)c1	ZINC000872493199	FH	On-Demand	Anodyne	ADRA1B	18	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC[C@@H]3CCOC3)cc2N1	ZINC000872493209	GF	On-Demand	Anodyne	PKM	27	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC[C@H]3CCOC3)cc2N1	ZINC000872493210	GF	On-Demand	Anodyne	PKM	27	42
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](O)[C@H]1C	ZINC000872493226	CD	On-Demand	Mild	AR	29	42
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@@H](F)C1	ZINC000872493252	CE	On-Demand	Anodyne	PKM	41	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC[C@H](F)C1	ZINC000872493253	CE	On-Demand	Anodyne	PKM	41	38
CN1[C@H]2CC[C@H]1CC(NS(=O)(=O)c1cc3c(cc1Cl)CCCC(=O)N3)C2	ZINC000872493280	GF	On-Demand	Anodyne	PKM	37	45
COC[C@]1(CO)CCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872493284	DC	On-Demand	Mild	TRPV4	42	33
Cc1cc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)ccn1	ZINC000872493337	GF	On-Demand	Anodyne	PKM	39	48
OCCOC1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872493339	CE	On-Demand	Anodyne	DCK	34	41
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	CASP3	32	40
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	MMP13	18	44
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	MMP3	19	44
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	CASP7	45	34
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	MMP7	25	44
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493342	EF	On-Demand	Anodyne	MMP1	22	44
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872493392	DD	On-Demand	Mild	EPHX2	18	41
C=CCC[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493393	FE	On-Demand	Mild	PKM	27	41
C=CCC[C@@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493394	FE	On-Demand	Mild	PKM	27	41
CC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493513	GF	On-Demand	Anodyne	PKM	19	42
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(F)F	ZINC000872493520	EE	On-Demand	Anodyne	LEF	36	44
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(F)F	ZINC000872493521	EE	On-Demand	Anodyne	LEF	36	44
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(F)F	ZINC000872493522	EE	On-Demand	Anodyne	LEF	36	44
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(F)F	ZINC000872493523	EE	On-Demand	Anodyne	LEF	36	44
C[C@@H](Cc1cnn(C)c1)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493554	GE	On-Demand	Anodyne	PKM	31	41
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	F2	48	42
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	ACE	28	42
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	OPRM1	44	41
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	OPRD1	35	40
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	MME	40	42
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	MC4R	98	39
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	KCNQ2	56	34
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	TRY2_BOVIN	106	41
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	TRY1_BOVIN	48	34
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	NPFFR2	65	32
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	PREP	25	53
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	MC5R	47	35
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	CAPNS1	42	31
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	CCKBR	18	40
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	CAPN1	29	41
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	DPP7	66	45
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	ST14	95	36
O=C([C@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493560	EE	On-Demand	Anodyne	NPFFR1	45	32
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	F2	48	42
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	ACE	28	42
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	OPRM1	44	41
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	OPRD1	35	40
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	MME	40	42
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	MC4R	98	39
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	KCNQ2	56	34
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	TRY2_BOVIN	106	41
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	TRY1_BOVIN	48	34
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	NPFFR2	65	32
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	PREP	25	53
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	MC5R	47	35
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	CAPNS1	42	31
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	CCKBR	18	40
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	CAPN1	29	41
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	DPP7	66	45
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	ST14	95	36
O=C([C@@H](Cc1ccccc1)Nc1cc(Cl)nnc1O)N1CCCC1	ZINC000872493561	EE	On-Demand	Anodyne	NPFFR1	45	32
NC(=O)c1cc(N2CCC(Oc3ccccc3Cl)CC2)nc(Cl)n1	ZINC000872493587	FF	On-Demand	Anodyne	DCK	39	45
NC(=O)c1cc(N2CCC(Oc3ccccc3Cl)CC2)nc(Cl)n1	ZINC000872493587	FF	On-Demand	Anodyne	SCD1	83	71
NC(=O)c1cc(N2CCC(Oc3ccccc3Cl)CC2)nc(Cl)n1	ZINC000872493587	FF	On-Demand	Anodyne	SCD	38	46
CCn1cc([C@H](C)NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cn1	ZINC000872493604	GF	On-Demand	Anodyne	PKM	30	41
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@H]2C)c(C#N)c1	ZINC000872493629	CD	On-Demand	Mild	AR	26	43
CO[C@@H](C1CC1)[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493636	EF	On-Demand	Anodyne	LEF	33	43
CO[C@@H](C1CC1)[C@H](C)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493637	EF	On-Demand	Anodyne	LEF	33	43
O=S1(=O)CCC(CNc2cc(-c3ccccc3)ncn2)CC1	ZINC000872493644	DE	On-Demand	Anodyne	VCP	68	42
COC(=O)[C@@H](CC(C)C)N(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872493653	GE	On-Demand	Anodyne	MMP9	21	41
COC(=O)[C@@H](CC(C)C)N(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872493653	GE	On-Demand	Anodyne	MMP12	16	40
COC(=O)[C@@H](CC(C)C)N(C)S(=O)(=O)c1cccc(Br)n1	ZINC000872493653	GE	On-Demand	Anodyne	MMP1	19	41
C[C@@H](CNc1cc(-c2cccc(Cl)c2)ncn1)S(C)(=O)=O	ZINC000872493666	EF	On-Demand	Anodyne	MTNN	68	32
C[C@@H](N(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)C(C)(C)O	ZINC000872493684	FE	On-Demand	Anodyne	PKM	33	42
COCC1(O)CN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872493690	CC	On-Demand	Mild	TRPV4	69	55
CC(C)(C[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1)C(N)=O	ZINC000872493705	GG	On-Demand	Anodyne	GCKR	69	34
C[C@@H](CCCO)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493726	FE	On-Demand	Anodyne	PKM	40	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872493733	GF	On-Demand	Anodyne	CHRNA4	27	48
OC[C@H](C[C@H](O)c1ccccc1)Nc1nc(Cl)nc2sccc12	ZINC000872493741	EG	On-Demand	Anodyne	CX3CR1	44	33
OC[C@@H](C[C@@H](O)c1ccccc1)Nc1nc(Cl)nc2sccc12	ZINC000872493742	EG	On-Demand	Anodyne	CX3CR1	44	33
OC[C@H](C[C@@H](O)c1ccccc1)Nc1nc(Cl)nc2sccc12	ZINC000872493743	EG	On-Demand	Anodyne	CX3CR1	44	33
OC[C@@H](C[C@H](O)c1ccccc1)Nc1nc(Cl)nc2sccc12	ZINC000872493744	EG	On-Demand	Anodyne	CX3CR1	44	33
NC(=O)c1cc(N2CCC(c3ccccn3)CC2)nc(Cl)n1	ZINC000872493774	DE	On-Demand	Anodyne	SCD1	15	40
COCC1(O)CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872493786	FC	On-Demand	Anodyne	TRPV4	53	41
CN(C1(CO)CCC1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872493796	FE	On-Demand	Anodyne	PKM	28	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](CCCO)C2)c(C#N)c1	ZINC000872493906	DD	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2CC[C@@H](CCCO)C2)c(C#N)c1	ZINC000872493906	DD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2CC[C@H](CCCO)C2)c(C#N)c1	ZINC000872493907	DD	On-Demand	Mild	EPHX2	15	40
Cc1ccc(S(=O)(=O)N2CC[C@H](CCCO)C2)c(C#N)c1	ZINC000872493907	DD	On-Demand	Mild	TRPV4	43	35
CS(=O)(=O)C1CN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872493911	ED	On-Demand	Anodyne	PKM	43	36
CC(C)CN(Cc1cnn(C)c1)S(=O)(=O)c1cccc(Br)n1	ZINC000872493930	GE	On-Demand	Anodyne	RORC	30	43
O=CN1CCCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872493959	GD	On-Demand	Anodyne	PKM	19	41
COC[C@@H]1CCCCN1S(=O)(=O)CC1CC2(CCC2)C1	ZINC000872493969	DE	On-Demand	Anodyne	CASP7	48	39
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCC3CC(F)(F)C3)cc2N1	ZINC000872493979	GG	On-Demand	Anodyne	PKM	37	45
COC[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493991	EF	On-Demand	Anodyne	CASP3	125	57
COC[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872493991	EF	On-Demand	Anodyne	CASP7	140	57
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](C)O	ZINC000872494011	DE	On-Demand	Anodyne	LEF	41	45
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](C)O	ZINC000872494012	DE	On-Demand	Anodyne	LEF	41	45
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](C)O	ZINC000872494013	DE	On-Demand	Anodyne	LEF	41	45
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](C)O	ZINC000872494014	DE	On-Demand	Anodyne	LEF	41	45
O=S(=O)(NCCN1C[C@@H]2CC[C@H](C1)O2)c1ccc(F)c(C(F)F)c1	ZINC000872494038	FD	On-Demand	Anodyne	HTR7	26	40
Cc1ccc(S(=O)(=O)N2CCN(c3cccc(F)n3)CC2)c(C#N)c1	ZINC000872494039	FD	On-Demand	Mild	TRPV4	43	34
Cc1ncsc1CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872494077	GF	On-Demand	Anodyne	PKM	38	46
CN1CCO[C@@H]2CN(S(=O)(=O)c3cc4c(cc3Cl)CCCC(=O)N4)C[C@@H]21	ZINC000872494116	GD	On-Demand	Anodyne	PKM	17	40
Cc1cccc(C#N)c1S(=O)(=O)N1CC(C)(CC(F)(F)F)C1	ZINC000872494187	EF	On-Demand	Mild	TRPV4	41	32
CC[C@@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)NC	ZINC000872494218	CC	On-Demand	Mild	LEF	15	42
CC[C@H](NS(=O)(=O)c1ccc(C)cc1C#N)C(=O)NC	ZINC000872494219	CC	On-Demand	Mild	LEF	15	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C[C@H](O)C3)cc2N1	ZINC000872494234	ED	On-Demand	Anodyne	PKM	38	47
O=CN1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872494279	ED	On-Demand	Anodyne	PKM	52	45
O=S(=O)(NC[C@@H](O)C1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872494281	DE	On-Demand	Anodyne	LEF	23	42
O=S(=O)(NC[C@H](O)C1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872494282	DE	On-Demand	Anodyne	LEF	23	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H]3O)cc2N1	ZINC000872494283	FD	On-Demand	Anodyne	PKM	38	46
Cc1ncsc1CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872494327	FG	On-Demand	Anodyne	TBXA2R	42	34
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CC34CCOCC4)cc2N1	ZINC000872494351	GE	On-Demand	Anodyne	PKM	28	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC34CCOCC4)cc2N1	ZINC000872494352	GE	On-Demand	Anodyne	PKM	28	43
C=C[C@@H]1OCCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872494381	GF	On-Demand	Mild	PKM	23	40
Cc1ccc(S(=O)(=O)N2CCN(c3ccnc(F)c3)CC2)c(C#N)c1	ZINC000872494401	FD	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2C[C@H](C)N(CCO)[C@H](C)C2)c(C#N)c1	ZINC000872494403	EC	On-Demand	Mild	TRPV4	45	37
Oc1nnc(Cl)cc1N1CCCC[C@H]1CCc1ccccc1	ZINC000872494413	DH	On-Demand	Anodyne	SLC18A2	53	42
Oc1nnc(Cl)cc1N1CCCC[C@@H]1CCc1ccccc1	ZINC000872494415	DH	On-Demand	Anodyne	SLC18A2	53	42
CCOC[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872494429	DE	On-Demand	Mild	CASP3	51	43
CCOC[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872494429	DE	On-Demand	Mild	CASP7	65	53
CCOC[C@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872494482	DE	On-Demand	Mild	CASP3	51	41
CCOC[C@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872494482	DE	On-Demand	Mild	CASP7	61	46
C[C@H]1CC[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)O1	ZINC000872494579	FE	On-Demand	Anodyne	PKM	36	46
C[C@H]1CC[C@@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)O1	ZINC000872494580	FE	On-Demand	Anodyne	PKM	36	46
O=S(=O)(N[C@@H]1CCC[C@H]1O)c1ccc(F)c(C(F)F)c1	ZINC000872494594	DD	On-Demand	Anodyne	LEF	22	40
COC[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872494623	DE	On-Demand	Mild	CASP3	77	44
COC[C@@H]1CCCCN1S(=O)(=O)c1c(C)cccc1C#N	ZINC000872494623	DE	On-Demand	Mild	CASP7	83	44
Cc1c(F)ncnc1NCc1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000872494634	FE	On-Demand	Anodyne	MTNN	44	34
CN1CC[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872494638	FD	On-Demand	Anodyne	PKM	36	45
OC[C@H](CC1CC1)Nc1cc(-c2ccccc2)ncn1	ZINC000872494692	CF	On-Demand	Anodyne	VCP	43	34
OC[C@@H](CC1CC1)Nc1cc(-c2ccccc2)ncn1	ZINC000872494693	CF	On-Demand	Anodyne	VCP	43	34
Cc1ccc(S(=O)(=O)N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(C#N)c1	ZINC000872494700	DD	On-Demand	Mild	TRPV4	43	36
Cc1ccc(S(=O)(=O)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(C#N)c1	ZINC000872494701	DD	On-Demand	Mild	TRPV4	43	36
c1ccc2[nH]c(CN3CCN(c4ccncc4C4CC4)CC3)nc2c1	ZINC000872494757	EG	On-Demand	Anodyne	DRD4	29	60
CC[C@@H]1CN(C(C)=O)CC[C@H]1Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872494765	FG	On-Demand	Anodyne	ADORA2B	19	43
CC[C@@H]1CN(C(C)=O)CC[C@@H]1Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872494767	FG	On-Demand	Anodyne	ADORA2B	19	43
CC[C@H]1CN(C(C)=O)CC[C@H]1Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872494769	FG	On-Demand	Anodyne	ADORA2B	19	43
CC[C@H]1CN(C(C)=O)CC[C@@H]1Nc1nc2c(OC)ccc(OC)c2s1	ZINC000872494771	FG	On-Demand	Anodyne	ADORA2B	19	43
CC(=O)CCCCCNS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872494777	DF	On-Demand	Anodyne	PAOX	43	38
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1F	ZINC000872494785	FD	On-Demand	Anodyne	DRD4	34	45
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1F	ZINC000872494785	FD	On-Demand	Anodyne	KCNQ2	44	39
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccccc1F	ZINC000872494785	FD	On-Demand	Anodyne	SLC27A1	51	40
C[C@@H](CCCc1cccnc1)NS(=O)(=O)CC1CC2(CCC2)C1	ZINC000872494817	EG	On-Demand	Anodyne	PTAFR	26	41
COC[C@@H]1CCCCN1S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872494926	ED	On-Demand	Anodyne	CASP3	38	41
COC[C@@H]1CCCCN1S(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872494926	ED	On-Demand	Anodyne	CASP7	52	41
COC[C@@H]1CCCCN1S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872494928	ED	On-Demand	Anodyne	CASP3	38	41
COC[C@@H]1CCCCN1S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872494928	ED	On-Demand	Anodyne	CASP7	52	41
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](O)C2)c(C#N)c1	ZINC000872494934	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](O)C2)c(C#N)c1	ZINC000872494935	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](O)C2)c(C#N)c1	ZINC000872494936	CD	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@@H](O)C[C@@H](C)C2)c(C#N)c1	ZINC000872494937	CD	On-Demand	Mild	TRPV4	43	35
CCOC[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872495008	FE	On-Demand	Anodyne	CASP3	64	43
CCOC[C@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872495008	FE	On-Demand	Anodyne	CASP7	73	48
CN1[C@H]2CC[C@H]1CC(N1CCN(c3cc(-c4ccccc4)ncn3)CC1)C2	ZINC000872495022	FF	On-Demand	Anodyne	HRH4	16	64
CN1[C@H]2CC[C@H]1CC(N1CCN(c3cc(-c4ccccc4)ncn3)CC1)C2	ZINC000872495022	FF	On-Demand	Anodyne	EBP	27	40
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000872495025	ED	On-Demand	Anodyne	DRD4	18	45
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000872495025	ED	On-Demand	Anodyne	ABCC1	51	33
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000872495025	ED	On-Demand	Anodyne	SLC27A1	61	39
Cc1ccc(S(=O)(=O)N2CCO[C@H](CF)C2)c(C#N)c1	ZINC000872495036	CD	On-Demand	Mild	TRPV4	42	33
Cc1ccc(S(=O)(=O)N2CCO[C@@H](CF)C2)c(C#N)c1	ZINC000872495038	CD	On-Demand	Mild	TRPV4	42	33
Nc1nc(C(F)F)nc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)n1	ZINC000872495067	FD	On-Demand	Anodyne	DRD4	23	63
C#CC[C@@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872495069	DC	On-Demand	Mild	ITGAV	40	34
C#CC[C@H](NS(=O)(=O)c1c(C)cccc1C#N)C(=O)OC	ZINC000872495070	DC	On-Demand	Mild	ITGAV	40	34
Cc1c(F)ncnc1N1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000872495075	EE	On-Demand	Anodyne	DRD4	27	66
Nc1nc(C(F)F)nc(N2CCCC[C@@H]2CCc2ccccc2)n1	ZINC000872495132	EG	On-Demand	Anodyne	SLC18A2	66	46
Nc1nc(C(F)F)nc(N2CCCC[C@H]2CCc2ccccc2)n1	ZINC000872495133	EG	On-Demand	Anodyne	SLC18A2	66	46
CN1[C@H]2CC[C@H]1CC(N1CCN(c3ccnc4ncccc34)CC1)C2	ZINC000872495160	EE	On-Demand	Anodyne	ADRA1D	15	41
C=C(C)CCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872495166	CG	On-Demand	Mild	TBXA2R	44	36
O=S(=O)(N[C@H](C1CC1)[C@@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872495214	FF	On-Demand	Anodyne	LEF	32	44
O=S(=O)(N[C@@H](C1CC1)[C@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872495217	FF	On-Demand	Anodyne	LEF	32	44
O=S(=O)(N[C@H](C1CC1)[C@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872495220	FF	On-Demand	Anodyne	LEF	32	44
O=S(=O)(N[C@@H](C1CC1)[C@@H](CO)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872495223	FF	On-Demand	Anodyne	LEF	32	44
Nc1nc(NC[C@H]2CC(=O)N(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872495297	ED	On-Demand	Anodyne	VCP	42	33
Nc1nc(NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)nc(C(F)F)n1	ZINC000872495298	ED	On-Demand	Anodyne	VCP	42	33
CN1CC[C@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872495328	DD	On-Demand	Anodyne	HTR7	19	46
Cc1c(F)ncnc1N1CCc2c([nH]c3ccccc23)C1	ZINC000872495331	CF	On-Demand	Anodyne	DRD5	22	43
COC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872495336	DE	On-Demand	Mild	CASP3	76	52
COC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1C#N	ZINC000872495336	DE	On-Demand	Mild	CASP7	85	52
C[C@@H](CCCc1cccnc1)NS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872495361	FF	On-Demand	Anodyne	PTAFR	29	43
C[C@@H](CCCc1cccnc1)NS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872495363	FF	On-Demand	Anodyne	PTAFR	29	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H](O)C3CCC3)cc2N1	ZINC000872495395	FE	On-Demand	Anodyne	PKM	39	45
c1ccc2[nH]c(CN3CCN(c4ccnc5ncccc45)CC3)nc2c1	ZINC000872495396	EF	On-Demand	Anodyne	HTR1A	20	46
c1ccc2[nH]c(CN3CCN(c4ccnc5ncccc45)CC3)nc2c1	ZINC000872495396	EF	On-Demand	Anodyne	DRD2	18	66
c1ccc2[nH]c(CN3CCN(c4ccnc5ncccc45)CC3)nc2c1	ZINC000872495396	EF	On-Demand	Anodyne	DRD4	42	69
c1ccc2[nH]c(CN3CCN(c4ccnc5ncccc45)CC3)nc2c1	ZINC000872495396	EF	On-Demand	Anodyne	DRD3	15	40
c1ccc2[nH]c(CN3CCN(c4ccnc5ncccc45)CC3)nc2c1	ZINC000872495396	EF	On-Demand	Anodyne	HTR7	15	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H](O)C3CCC3)cc2N1	ZINC000872495398	FE	On-Demand	Anodyne	PKM	39	45
Cc1ccc(S(=O)(=O)N2CC[C@@H](O)[C@H](C3CCCC3)C2)c(C#N)c1	ZINC000872495405	EE	On-Demand	Mild	EPHX2	19	42
O=C(CO)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872495417	ED	On-Demand	Anodyne	GRM5	19	48
NC(=O)[C@H]1CCCN1S(=O)(=O)CCCc1ccc(C(F)(F)F)cc1	ZINC000872495495	FD	On-Demand	Anodyne	FKBP1A	43	42
C[C@H]1[C@@H](O)CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495509	FE	On-Demand	Anodyne	PKM	31	43
C[C@H]1[C@H](O)CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495510	FE	On-Demand	Anodyne	PKM	31	43
C[C@@H]1[C@@H](O)CCCN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495512	FE	On-Demand	Anodyne	PKM	31	43
CC[C@@](C)(CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)OC	ZINC000872495526	FF	On-Demand	Anodyne	PKM	39	46
C[C@@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC(=O)N1	ZINC000872495542	FD	On-Demand	Anodyne	PKM	24	41
C[C@H]1CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC(=O)N1	ZINC000872495543	FD	On-Demand	Anodyne	PKM	24	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccc(F)n2)CC1	ZINC000872495568	GF	On-Demand	Anodyne	PKM	50	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2cccc(F)n2)CC1	ZINC000872495568	GF	On-Demand	Anodyne	GCK	43	37
NC(=O)[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872495595	ED	On-Demand	Anodyne	SFRP1	43	34
Cc1cccc(C#N)c1S(=O)(=O)NC1CCC1	ZINC000872495596	CD	On-Demand	Mild	CCR8	44	32
CCC(=O)c1c(Cl)cccc1NCc1ncoc1C	ZINC000872495617	CH	On-Demand	Anodyne	TYK2	18	40
O=S(=O)(NC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872495640	CF	On-Demand	Anodyne	ADRA1D	23	41
O=S(=O)(NC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872495640	CF	On-Demand	Anodyne	ADRA1A	16	41
O=S(=O)(NC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872495640	CF	On-Demand	Anodyne	ADRA1B	18	41
O=S(=O)(NC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872495640	CF	On-Demand	Anodyne	LEF	22	43
O=S(=O)(NC1CCC1)c1ccc(F)c(C(F)F)c1	ZINC000872495640	CF	On-Demand	Anodyne	BRD4	19	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCC3)cc2N1	ZINC000872495651	EE	On-Demand	Anodyne	PKM	39	49
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC3CCC3)cc2N1	ZINC000872495651	EE	On-Demand	Anodyne	BRD4	17	42
Cc1cc(N2CCc3c([nH]c4ccccc34)C2)c2cnn(C)c2n1	ZINC000872495695	DG	On-Demand	Anodyne	DRD5	21	41
CN(C)CC(C)(C)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495723	FE	On-Demand	Anodyne	PKM	39	47
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872495725	FG	On-Demand	Anodyne	CASP3	64	41
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872495725	FG	On-Demand	Anodyne	CASP7	81	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@H]3C[C@H]4CC[C@H]3O4)cc2N1	ZINC000872495732	GF	On-Demand	Anodyne	PKM	27	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCC[C@@H]3C[C@H]4CC[C@H]3O4)cc2N1	ZINC000872495733	GF	On-Demand	Anodyne	PKM	27	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCOCC2)CC1	ZINC000872495737	GF	On-Demand	Anodyne	PKM	45	40
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(N2CCCOCC2)CC1	ZINC000872495737	GF	On-Demand	Anodyne	L3MBTL3	32	45
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]2COC[C@@H]21	ZINC000872495750	EF	On-Demand	Anodyne	CASP7	46	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H](C)CCCc1cccnc1	ZINC000872495758	EF	On-Demand	Mild	PTAFR	31	43
Cc1cccc(C#N)c1S(=O)(=O)N[C@H](C)CCCc1cccnc1	ZINC000872495759	EF	On-Demand	Mild	PTAFR	31	43
C#CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872495768	ED	On-Demand	Mild	LEF	39	43
C#CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)OC	ZINC000872495769	ED	On-Demand	Mild	LEF	39	43
C[C@@H](Nc1ncc(Br)c(N[C@H](C)c2ccc[nH]2)n1)c1ccc[nH]1	ZINC000872495786	GI	On-Demand	Anodyne	NTRK1	18	50
CCN1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1=O	ZINC000872495846	GD	On-Demand	Anodyne	PKM	35	44
COc1ccc2c(c1)CN(S(=O)(=O)c1cccc(Br)n1)CCO2	ZINC000872495854	GE	On-Demand	Anodyne	PKM	27	44
COc1ccc2c(c1)CN(S(=O)(=O)c1cccc(Br)n1)CCO2	ZINC000872495854	GE	On-Demand	Anodyne	AKR1C3	20	42
C=C[C@@H]1OCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495873	FE	On-Demand	Mild	PKM	27	42
C=C(C)CCNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495885	EF	On-Demand	Mild	PKM	40	49
Cc1cccc(C#N)c1S(=O)(=O)N1CC(C)(CO)C1	ZINC000872495886	CC	On-Demand	Mild	TRPV4	42	32
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(Cl)cc1	ZINC000872495895	GE	On-Demand	Anodyne	DRD4	27	41
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(Cl)cc1	ZINC000872495895	GE	On-Demand	Anodyne	IMDH_CRYPV	30	47
O=C(CN1CCN(c2cc(Cl)nnc2O)CC1)Nc1ccc(Cl)cc1	ZINC000872495895	GE	On-Demand	Anodyne	SLC27A1	42	36
Cc1ccc(S(=O)(=O)N2C[C@H](F)[C@H](F)C2)c(C#N)c1	ZINC000872495902	CD	On-Demand	Mild	TRPV4	45	37
Cc1ccncc1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872495907	GF	On-Demand	Anodyne	PKM	40	49
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H](C)O	ZINC000872495935	FE	On-Demand	Anodyne	PKM	40	47
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H](C)O	ZINC000872495939	FE	On-Demand	Anodyne	PKM	40	47
COC[C@@H](Nc1nc2c(OC)ccc(OC)c2s1)C(N)=O	ZINC000872496099	DD	On-Demand	Anodyne	ADORA2B	17	41
COC[C@H](Nc1nc2c(OC)ccc(OC)c2s1)C(N)=O	ZINC000872496100	DD	On-Demand	Anodyne	ADORA2B	17	41
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@H]3COCO3)cc2N1	ZINC000872496124	FD	On-Demand	Anodyne	PKM	36	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)NC[C@@H]3COCO3)cc2N1	ZINC000872496126	FD	On-Demand	Anodyne	PKM	36	44
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CC=CC1	ZINC000872496141	CE	On-Demand	Anodyne	PKM	40	38
C=C(CC)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872496159	EF	On-Demand	Mild	PKM	39	47
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)NC	ZINC000872496164	DD	On-Demand	Anodyne	LEF	46	61
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)C(=O)NC	ZINC000872496165	DD	On-Demand	Anodyne	LEF	46	61
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@H](C)O	ZINC000872496198	FE	On-Demand	Anodyne	PKM	40	47
CC[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)[C@@H](C)O	ZINC000872496199	FE	On-Demand	Anodyne	PKM	40	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3C[C@H](F)[C@H](F)C3)cc2N1	ZINC000872496218	FE	On-Demand	Anodyne	PKM	28	41
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccnc(F)c2)CC1	ZINC000872496220	GF	On-Demand	Anodyne	PKM	42	38
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCN(c2ccnc(F)c2)CC1	ZINC000872496220	GF	On-Demand	Anodyne	GCK	41	35
CC[C@H]1CN(C(C)=O)CC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872496237	DG	On-Demand	Anodyne	P2RY12	104	36
CC[C@@H]1CN(C(C)=O)CC[C@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872496238	DG	On-Demand	Anodyne	P2RY12	104	36
CC[C@H]1CN(C(C)=O)CC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872496239	DG	On-Demand	Anodyne	P2RY12	104	36
CC[C@@H]1CN(C(C)=O)CC[C@@H]1Nc1cc(-c2ccccc2)ncn1	ZINC000872496240	DG	On-Demand	Anodyne	P2RY12	104	36
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1F	ZINC000872496245	FF	On-Demand	Anodyne	HTR1A	28	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1F	ZINC000872496245	FF	On-Demand	Anodyne	DRD4	28	45
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1F	ZINC000872496245	FF	On-Demand	Anodyne	HTR2A	15	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1F	ZINC000872496245	FF	On-Demand	Anodyne	HTR7	24	43
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1ccccc1F	ZINC000872496245	FF	On-Demand	Anodyne	SLC27A1	57	43
COCC(COC)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872496251	GD	On-Demand	Anodyne	PKM	39	47
NC(=O)C[C@@H]1CCCCN1c1cc(-c2ccccc2)ncn1	ZINC000872496333	CE	On-Demand	Anodyne	CPT1A	57	37
NC(=O)C[C@@H]1CCCCN1c1cc(-c2ccccc2)ncn1	ZINC000872496333	CE	On-Demand	Anodyne	NOS2	22	40
NC(=O)C[C@H]1CCCCN1c1cc(-c2ccccc2)ncn1	ZINC000872496334	CE	On-Demand	Anodyne	CPT1A	57	37
NC(=O)C[C@H]1CCCCN1c1cc(-c2ccccc2)ncn1	ZINC000872496334	CE	On-Demand	Anodyne	NOS2	22	40
Cn1ncc2c(N3CCN(Cc4nc5ccccc5[nH]4)CC3)nc(Cl)nc21	ZINC000872496344	GE	On-Demand	Anodyne	DRD4	20	57
Cn1cnc(CCNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)c1	ZINC000872496351	GD	On-Demand	Anodyne	PKM	34	44
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872496452	DE	On-Demand	Mild	EPHX2	18	46
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872496452	DE	On-Demand	Mild	TRPV4	45	37
COC[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872496452	DE	On-Demand	Mild	CASP7	51	38
CCO[C@H]1C[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872496465	FE	On-Demand	Anodyne	PKM	37	44
O=C1C[C@@H](CNc2ccnc3ncccc23)CN1Cc1ccccc1	ZINC000872496490	EG	On-Demand	Anodyne	HRP1_PLAFA	41	31
O=C1C[C@H](CNc2ccnc3ncccc23)CN1Cc1ccccc1	ZINC000872496491	EG	On-Demand	Anodyne	HRP1_PLAFA	41	31
C[C@@H]1[C@@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496538	DE	On-Demand	Anodyne	CASP3	52	36
C[C@@H]1[C@@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496538	DE	On-Demand	Anodyne	CASP7	67	36
C[C@H]1[C@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496540	DE	On-Demand	Anodyne	CASP3	52	36
C[C@H]1[C@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496540	DE	On-Demand	Anodyne	CASP7	67	36
C[C@H]1[C@@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496542	DE	On-Demand	Anodyne	CASP3	52	36
C[C@H]1[C@@H](O)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496542	DE	On-Demand	Anodyne	CASP7	67	36
Oc1nnc(Cl)cc1N1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000872496549	EE	On-Demand	Anodyne	DRD4	34	67
CC(=O)CCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496550	EG	On-Demand	Anodyne	TBXA2R	45	36
CC(=O)CCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496550	EG	On-Demand	Anodyne	LEF	32	44
O=C1CCCc2cc(Cl)c(S(=O)(=O)N3CC=CC3)cc2N1	ZINC000872496553	EE	On-Demand	Anodyne	PKM	31	44
CC1(CO)CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872496627	FD	On-Demand	Anodyne	PKM	30	41
CC1(CO)CN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872496627	FD	On-Demand	Anodyne	TRPV4	41	32
COC[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872496628	EE	On-Demand	Anodyne	CASP3	85	47
COC[C@@H]1CCCCN1S(=O)(=O)c1cccc(Br)n1	ZINC000872496628	EE	On-Demand	Anodyne	CASP7	93	47
CN(C)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872496649	GE	On-Demand	Anodyne	GCKR	46	33
CN(C)C(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872496653	GE	On-Demand	Anodyne	GCKR	46	33
CC1=NO[C@@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872496669	FE	On-Demand	Anodyne	PKM	37	47
CC1=NO[C@H](CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872496670	FE	On-Demand	Anodyne	PKM	37	47
CC(=O)CCCCCNS(=O)(=O)N=[S@@](C)(=O)C(C)(C)C	ZINC000872496700	ED	On-Demand	Anodyne	PAOX	43	39
CC(=O)CCCCCNS(=O)(=O)N=[S@](C)(=O)C(C)(C)C	ZINC000872496701	ED	On-Demand	Anodyne	PAOX	43	39
Cc1ccc(S(=O)(=O)N2C[C@H]3CCCC[C@H]3C2)c(C#N)c1	ZINC000872496717	DF	On-Demand	Mild	TRPV4	43	36
NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496719	DD	On-Demand	Anodyne	CASP3	45	38
NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496719	DD	On-Demand	Anodyne	ITGA4	29	40
NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872496719	DD	On-Demand	Anodyne	CASP7	61	35
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@H](CO)C3)cc2N1	ZINC000872496790	GE	On-Demand	Anodyne	PKM	31	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@@H](CO)C3)cc2N1	ZINC000872496791	GE	On-Demand	Anodyne	PKM	31	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CCC[C@H](CO)C3)cc2N1	ZINC000872496792	GE	On-Demand	Anodyne	PKM	31	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@H]3CCC[C@@H](CO)C3)cc2N1	ZINC000872496793	GE	On-Demand	Anodyne	PKM	31	42
C[C@@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CS1	ZINC000872496796	FF	On-Demand	Anodyne	PKM	36	46
C[C@H]1C[C@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CS1	ZINC000872496798	FF	On-Demand	Anodyne	PKM	36	46
Cc1cc(N2CC[C@H](NC(N)=O)C2)c2cnn(C)c2n1	ZINC000872496802	CC	On-Demand	Anodyne	HRH4	40	33
COc1ccc(CN(C)S(=O)(=O)N=[S@](C)(=O)C(C)(C)C)cc1Cl	ZINC000872496835	GF	On-Demand	Anodyne	PDE6A	45	36
COc1ccc(CN(C)S(=O)(=O)N=[S@@](C)(=O)C(C)(C)C)cc1Cl	ZINC000872496836	GF	On-Demand	Anodyne	PDE6A	45	36
Cc1cccc(C#N)c1S(=O)(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872496847	GE	On-Demand	Mild	SIGMAR1	45	40
Cc1cccc(C#N)c1S(=O)(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872496847	GE	On-Demand	Mild	NPFFR1	43	37
CC(C)(C)OC(=O)N1CC(CNc2ccnc3ncccc23)C1	ZINC000872496848	DF	On-Demand	Anodyne	GPR119	38	41
CC[C@@H](NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2)c1ccccn1	ZINC000872496873	GG	On-Demand	Anodyne	PKM	36	43
Cc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)N(C)C)C2)c(C#N)c1	ZINC000872496978	DC	On-Demand	Mild	EPHX2	29	46
Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)N(C)C)C2)c(C#N)c1	ZINC000872496979	DC	On-Demand	Mild	EPHX2	29	46
c1cnc2nccc(NCCCc3nnc4n3CCCC4)c2c1	ZINC000872497010	DF	On-Demand	Anodyne	HRP1_PLAFA	46	32
c1cnc2nccc(NCCCc3nnc4n3CCCC4)c2c1	ZINC000872497010	DF	On-Demand	Anodyne	HNMT	70	42
NC(=O)N[C@@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872497026	DE	On-Demand	Anodyne	PDPK1	15	40
NC(=O)N[C@H]1CCN(c2cc(-c3cccc(Cl)c3)ncn2)C1	ZINC000872497027	DE	On-Demand	Anodyne	PDPK1	15	40
COC[C@@H](O)CCNc1nc2c(OC)ccc(OC)c2s1	ZINC000872497049	DE	On-Demand	Anodyne	ADORA2B	15	40
COCC(COC)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497099	GD	On-Demand	Anodyne	PKM	46	40
C[C@H]1CN(c2cc(C(C)(C)C)nc(Cl)n2)CC[C@@H]1N1CCN(C)CC1	ZINC000872497110	FF	On-Demand	Anodyne	HRH4	34	49
C[C@H]1CN(c2cc(C(C)(C)C)nc(Cl)n2)CC[C@H]1N1CCN(C)CC1	ZINC000872497112	FF	On-Demand	Anodyne	HRH4	34	49
Cc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](CO)C2)c(C#N)c1	ZINC000872497124	DD	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2C[C@@H](CO)C[C@@H](C)C2)c(C#N)c1	ZINC000872497125	DD	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](CO)C2)c(C#N)c1	ZINC000872497126	DD	On-Demand	Mild	TRPV4	44	36
Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](CO)C2)c(C#N)c1	ZINC000872497127	DD	On-Demand	Mild	TRPV4	44	36
CC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2C#N)C[C@@H](CC)O1	ZINC000872497130	DE	On-Demand	Mild	TRPV4	45	38
Cc1ccc(S(=O)(=O)N2C[C@H](CO)OC(C)(C)C2)c(C#N)c1	ZINC000872497143	DD	On-Demand	Mild	TRPV4	47	38
Cc1ccc(S(=O)(=O)N2C[C@@H](CO)OC(C)(C)C2)c(C#N)c1	ZINC000872497144	DD	On-Demand	Mild	TRPV4	47	38
Cc1cc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)cc(C)n1	ZINC000872497184	GG	On-Demand	Anodyne	PKM	39	48
Nc1nc(N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)nc(C(F)F)n1	ZINC000872497196	FF	On-Demand	Anodyne	HRH4	56	36
Nc1nc(N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)nc(C(F)F)n1	ZINC000872497198	FF	On-Demand	Anodyne	HRH4	56	36
Cc1cccc(C#N)c1S(=O)(=O)N(C)C[C@@H]1CCCN1C	ZINC000872497249	DD	On-Demand	Mild	CHRNA10	65	43
Cc1cccc(C#N)c1S(=O)(=O)N(C)C[C@H]1CCCN1C	ZINC000872497251	DD	On-Demand	Mild	CHRNA10	65	43
COc1ccc(OC)c2sc(N3CC[C@@H](NC(N)=O)C3)nc12	ZINC000872497280	DD	On-Demand	Anodyne	HRH4	47	34
COc1ccc(OC)c2sc(N3CC[C@@H](NC(N)=O)C3)nc12	ZINC000872497280	DD	On-Demand	Anodyne	PARE	63	33
COc1ccc(OC)c2sc(N3CC[C@H](NC(N)=O)C3)nc12	ZINC000872497283	DD	On-Demand	Anodyne	HRH4	47	34
COc1ccc(OC)c2sc(N3CC[C@H](NC(N)=O)C3)nc12	ZINC000872497283	DD	On-Demand	Anodyne	PARE	63	33
Cc1cccc(C#N)c1S(=O)(=O)N[C@@H]1CCN(CC(F)F)C1	ZINC000872497296	ED	On-Demand	Mild	CCR8	59	34
Cc1cccc(C#N)c1S(=O)(=O)N[C@H]1CCN(CC(F)F)C1	ZINC000872497298	ED	On-Demand	Mild	CCR8	59	34
O=S(=O)(CC1CC2(CCC2)C1)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872497299	GF	On-Demand	Anodyne	SIGMAR1	58	38
O=S(=O)(CC1CC2(CCC2)C1)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000872497299	GF	On-Demand	Anodyne	NPFFR1	41	36
COC1([C@@H](C)NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872497305	GF	On-Demand	Anodyne	PKM	37	45
COC1([C@H](C)NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872497307	GF	On-Demand	Anodyne	PKM	37	45
NC(=O)N[C@@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872497369	CD	On-Demand	Anodyne	PDPK1	19	42
NC(=O)N[C@H]1CCN(c2cc(-c3ccccc3)ncn2)C1	ZINC000872497371	CD	On-Demand	Anodyne	PDPK1	19	42
NC(=O)N[C@@H]1CCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872497387	DE	On-Demand	Anodyne	HRH4	44	35
NC(=O)N[C@H]1CCN(c2nc3c(F)cc(Cl)cc3s2)C1	ZINC000872497389	DE	On-Demand	Anodyne	HRH4	44	35
CNC(=O)[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497406	GD	On-Demand	Anodyne	EPHX2	34	42
CNC(=O)[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497406	GD	On-Demand	Anodyne	PKM	24	41
CNC(=O)[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497407	GD	On-Demand	Anodyne	EPHX2	34	42
CNC(=O)[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497407	GD	On-Demand	Anodyne	PKM	24	41
Cc1ccc(S(=O)(=O)N2CC[C@H](C3CCC3)C2)c(C#N)c1	ZINC000872497449	DF	On-Demand	Mild	EPHX2	17	44
Cc1ccc(S(=O)(=O)N2CC[C@@H](C3CCC3)C2)c(C#N)c1	ZINC000872497451	DF	On-Demand	Mild	EPHX2	17	44
O=C(NCCNc1cc(Cl)nnc1O)NC1CCCCC1	ZINC000872497480	DD	On-Demand	Anodyne	EPHX2	17	44
Cn1ncc2c1CCCN(S(=O)(=O)c1cccc(Br)n1)C2	ZINC000872497519	FD	On-Demand	Anodyne	AKR1C3	49	35
COCC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497525	FG	On-Demand	Anodyne	ADRA1D	31	43
COCC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497525	FG	On-Demand	Anodyne	ADRA1A	22	42
COCC1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497525	FG	On-Demand	Anodyne	ADRA1B	24	43
C[C@@H]1O[C@H](C)C[C@H]1CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497549	GF	On-Demand	Anodyne	PKM	33	43
COC1(C(F)(F)F)CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872497592	FF	On-Demand	Mild	TRPV4	49	43
CN(C)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497624	FF	On-Demand	Anodyne	ADRA1D	25	42
CN(C)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497624	FF	On-Demand	Anodyne	ADRA1A	17	42
CN(C)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497624	FF	On-Demand	Anodyne	ADRA1B	19	42
CN(C)C1CCC(NS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872497624	FF	On-Demand	Anodyne	SFRP1	75	35
Oc1nnc(Cl)cc1N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000872497638	FG	On-Demand	Anodyne	SIGMAR1	31	40
Oc1nnc(Cl)cc1N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000872497638	FG	On-Demand	Anodyne	NPFFR1	40	36
Cn1ncc2c(NC3CCC(F)(F)CC3)nc(Cl)nc21	ZINC000872497653	DG	On-Demand	Anodyne	Q4VQ11_PIG	43	33
Cc1c(F)ncnc1N1CCO[C@H](c2cccc(C#N)c2)C1	ZINC000872497676	CE	On-Demand	Mild	STK3	27	49
Cc1c(F)ncnc1N1CCO[C@H](c2cccc(C#N)c2)C1	ZINC000872497676	CE	On-Demand	Mild	LRRK2	23	50
Cc1c(F)ncnc1N1CCO[C@@H](c2cccc(C#N)c2)C1	ZINC000872497678	CE	On-Demand	Mild	STK3	27	49
Cc1c(F)ncnc1N1CCO[C@@H](c2cccc(C#N)c2)C1	ZINC000872497678	CE	On-Demand	Mild	LRRK2	23	50
CNC(=O)[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872497705	DC	On-Demand	Mild	EPHX2	39	52
CNC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872497707	DC	On-Demand	Mild	EPHX2	39	52
Nc1nc(C(F)F)nc(N2CCC3(CCN(Cc4ccccc4)C3)CC2)n1	ZINC000872497726	FF	On-Demand	Anodyne	SIGMAR1	16	41
COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872497735	GD	On-Demand	Anodyne	GCKR	40	32
COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872497736	GD	On-Demand	Anodyne	GCKR	40	32
Cc1ccc(S(=O)(=O)N2CCSC3(CCC3)CC2)c(C#N)c1	ZINC000872497737	EF	On-Demand	Mild	TRPV4	46	41
CC(=O)N[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497786	GE	On-Demand	Anodyne	SLC6A5	37	42
CC(=O)N[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497786	GE	On-Demand	Anodyne	EPHX2	20	55
CC(=O)N[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497786	GE	On-Demand	Anodyne	MCHR1	23	47
CC(=O)N[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497786	GE	On-Demand	Anodyne	BIRC2	18	43
CC(=O)N[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497787	GE	On-Demand	Anodyne	SLC6A5	37	42
CC(=O)N[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497787	GE	On-Demand	Anodyne	EPHX2	20	55
CC(=O)N[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497787	GE	On-Demand	Anodyne	MCHR1	23	47
CC(=O)N[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872497787	GE	On-Demand	Anodyne	BIRC2	18	43
C[C@@H]1[C@@H](CO)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872497805	EF	On-Demand	Anodyne	CASP3	56	37
C[C@@H]1[C@@H](CO)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872497805	EF	On-Demand	Anodyne	CASP7	70	37
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC(OC2CCC2)CC1	ZINC000872497806	FG	On-Demand	Anodyne	PKM	43	38
C[C@H]1[C@H](CO)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872497807	EF	On-Demand	Anodyne	CASP3	56	37
C[C@H]1[C@H](CO)CCCN1S(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872497807	EF	On-Demand	Anodyne	CASP7	70	37
C[C@H]1CC[C@@H](O)CN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497853	FE	On-Demand	Anodyne	PKM	34	41
C[C@H]1CC[C@H](O)CN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497855	FE	On-Demand	Anodyne	PKM	34	41
C[C@@H]1CC[C@H](O)CN1S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497857	FE	On-Demand	Anodyne	PKM	34	41
N#CC1(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCC1	ZINC000872497861	FF	On-Demand	Mild	PKM	35	44
COCC[C@@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497868	FF	On-Demand	Anodyne	PKM	39	46
COCC[C@H](C)CNS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872497871	FF	On-Demand	Anodyne	PKM	39	46
CC(=O)N[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497891	GD	On-Demand	Anodyne	EPHX2	19	40
CC(=O)N[C@@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497891	GD	On-Demand	Anodyne	PKM	24	41
CC(=O)N[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497893	GD	On-Demand	Anodyne	EPHX2	19	40
CC(=O)N[C@H]1CCN(S(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)C1	ZINC000872497893	GD	On-Demand	Anodyne	PKM	24	41
COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872497933	FC	On-Demand	Mild	EPHX2	15	41
COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872497935	FC	On-Demand	Mild	EPHX2	15	41
Cc1c(F)ncnc1NCC1CN(C(=O)OC(C)(C)C)C1	ZINC000872498009	CE	On-Demand	Anodyne	GPR119	58	46
CCn1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)n1	ZINC000872498022	GE	On-Demand	Anodyne	PKM	36	44
CC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498029	ED	On-Demand	Anodyne	GCKR	53	32
CC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498030	ED	On-Demand	Anodyne	GCKR	53	32
CNC(=O)[C@@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872498032	GE	On-Demand	Anodyne	EPHX2	32	48
CNC(=O)[C@H]1CCN(S(=O)(=O)CCCc2ccc(C(F)(F)F)cc2)C1	ZINC000872498034	GE	On-Demand	Anodyne	EPHX2	32	48
O=S(=O)(N[C@H](CO)[C@@H]1CCCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872498095	FD	On-Demand	Anodyne	LEF	33	51
O=S(=O)(N[C@@H](CO)[C@@H]1CCCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872498097	FD	On-Demand	Anodyne	LEF	33	51
O=S(=O)(N[C@H](CO)[C@H]1CCCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872498099	FD	On-Demand	Anodyne	LEF	33	51
O=S(=O)(N[C@@H](CO)[C@H]1CCCOC1)c1ccc(F)c(C(F)F)c1	ZINC000872498101	FD	On-Demand	Anodyne	LEF	33	51
C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CC[C@@H]1N1CCN(C)CC1	ZINC000872498102	GG	On-Demand	Anodyne	HRH4	25	50
C[C@H]1CN(c2cc(-c3cccc(Cl)c3)ncn2)CC[C@H]1N1CCN(C)CC1	ZINC000872498104	GG	On-Demand	Anodyne	HRH4	25	50
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498118	ED	On-Demand	Anodyne	TGM2	39	41
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498118	ED	On-Demand	Anodyne	F13A1	41	45
O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498118	ED	On-Demand	Anodyne	NOD2	19	40
NC(=O)c1cc(N2CCC3(CCN(Cc4ccccc4)C3)CC2)nc(Cl)n1	ZINC000872498166	GF	On-Demand	Anodyne	NPFFR1	47	39
Cc1ccc(S(=O)(=O)N2CC[C@]3(CC(=O)c4ccccc4O3)C2)c(C#N)c1	ZINC000872498181	GF	On-Demand	Mild	ACACA	40	38
Cc1ccc(S(=O)(=O)N2CC[C@@]3(CC(=O)c4ccccc4O3)C2)c(C#N)c1	ZINC000872498182	GF	On-Demand	Mild	ACACA	40	38
Cc1c(F)ncnc1N1CCN(CC(F)(F)F)[C@H](C)C1	ZINC000872498206	CD	On-Demand	Anodyne	LIMK2	42	33
Cc1c(F)ncnc1N1CCN(CC(F)(F)F)[C@@H](C)C1	ZINC000872498207	CD	On-Demand	Anodyne	LIMK2	42	33
Cc1cccc(C#N)c1S(=O)(=O)N1CCCc2c(cnn2C)C1	ZINC000872498260	ED	On-Demand	Mild	AKR1C3	41	36
NC(=O)[C@@H]1CC[C@@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872498261	FE	On-Demand	Anodyne	NPY5R	22	42
NC(=O)[C@@H]1CC[C@@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872498261	FE	On-Demand	Anodyne	LEF	29	40
NC(=O)[C@@H]1CC[C@@H](CNS(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872498261	FE	On-Demand	Anodyne	VCP	42	39
Cn1ncc2c1CCCN(S(=O)(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC000872498268	FF	On-Demand	Anodyne	AKR1C3	52	34
Cc1ccc(S(=O)(=O)N2C[C@@H]3CC[C@@H](O)C[C@H]3C2)c(C#N)c1	ZINC000872498285	DD	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@@H](O)CC[C@H]3C2)c(C#N)c1	ZINC000872498287	DD	On-Demand	Mild	TRPV4	42	35
CNC(=O)[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498303	ED	On-Demand	Anodyne	EPHX2	36	41
CNC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498304	ED	On-Demand	Anodyne	EPHX2	36	41
CC[C@@H]1C[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872498355	GF	On-Demand	Anodyne	PKM	37	44
CC[C@H]1C[C@@H](NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CCO1	ZINC000872498356	GF	On-Demand	Anodyne	PKM	37	44
CN(C)C1CCC(NS(=O)(=O)c2cc3c(cc2Cl)CCCC(=O)N3)CC1	ZINC000872498358	GF	On-Demand	Anodyne	PKM	36	46
Cc1ccc(S(=O)(=O)N2C[C@H]3C[C@H](O)CC[C@H]3C2)c(C#N)c1	ZINC000872498360	DD	On-Demand	Mild	TRPV4	42	35
Cc1ccc(S(=O)(=O)N2C[C@@H]3CC[C@H](O)C[C@H]3C2)c(C#N)c1	ZINC000872498361	DD	On-Demand	Mild	TRPV4	42	35
CN(Cc1ccc(Cl)c(F)c1)c1nc(N)nc(C(F)F)n1	ZINC000872498381	DF	On-Demand	Anodyne	DRTS_TOXGO	18	40
CN(Cc1ccc(Cl)c(F)c1)c1nc(N)nc(C(F)F)n1	ZINC000872498381	DF	On-Demand	Anodyne	DYR_PNECA	15	40
COCC(COC)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872498401	FC	On-Demand	Mild	TRPV4	45	37
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(C)C	ZINC000872498415	EF	On-Demand	Anodyne	LEF	43	47
CC[C@@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(C)C	ZINC000872498416	EF	On-Demand	Anodyne	LEF	43	47
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@H](O)C(C)C	ZINC000872498417	EF	On-Demand	Anodyne	LEF	43	47
CC[C@H](NS(=O)(=O)c1ccc(F)c(C(F)F)c1)[C@@H](O)C(C)C	ZINC000872498418	EF	On-Demand	Anodyne	LEF	43	47
O=C1CCCc2cc(Cl)c(S(=O)(=O)NCCCC3(O)CCC3)cc2N1	ZINC000872498482	GF	On-Demand	Anodyne	PKM	38	46
CNC(=O)[C@@H]1CCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872498525	DC	On-Demand	Mild	EPHX2	33	41
CNC(=O)[C@H]1CCN(S(=O)(=O)c2c(C)cccc2C#N)C1	ZINC000872498526	DC	On-Demand	Mild	EPHX2	33	41
CC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872498559	DC	On-Demand	Mild	EPHX2	32	47
COC(=O)[C@@]1(C)CCCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872498585	ED	On-Demand	Mild	TRPV4	46	38
COC(=O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872498597	FE	On-Demand	Anodyne	TRY2_BOVIN	43	32
COC(=O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872498597	FE	On-Demand	Anodyne	ST14	66	34
COC(=O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872498597	FE	On-Demand	Anodyne	LEF	41	59
CC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872498703	DC	On-Demand	Mild	EPHX2	32	47
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)c(C#N)c1	ZINC000872498792	DD	On-Demand	Mild	EPHX2	18	43
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C[C@H]3c3ccco3)cc2N1	ZINC000872498801	GG	On-Demand	Anodyne	PKM	37	45
O=S(=O)(N[C@@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498803	FE	On-Demand	Anodyne	HTR7	16	54
O=S(=O)(N[C@@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498803	FE	On-Demand	Anodyne	SFRP1	95	35
O=S(=O)(N[C@@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498803	FE	On-Demand	Anodyne	WNT3	61	33
O=S(=O)(N[C@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498804	FE	On-Demand	Anodyne	HTR7	16	54
O=S(=O)(N[C@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498804	FE	On-Demand	Anodyne	SFRP1	95	35
O=S(=O)(N[C@H]1CCN(CC(F)F)C1)c1ccc(F)c(C(F)F)c1	ZINC000872498804	FE	On-Demand	Anodyne	WNT3	61	33
C[C@H]1CN(c2cc(-c3ccccc3)ncn2)CC[C@H]1N1CCN(C)CC1	ZINC000872498822	FF	On-Demand	Anodyne	HRH4	25	65
C[C@H]1CN(c2cc(-c3ccccc3)ncn2)CC[C@@H]1N1CCN(C)CC1	ZINC000872498823	FF	On-Demand	Anodyne	HRH4	25	65
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000872498855	GE	On-Demand	Mild	PLG	56	32
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000872498855	GE	On-Demand	Mild	TRYP_PIG	46	31
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000872498855	GE	On-Demand	Mild	EPHX2	36	62
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000872498855	GE	On-Demand	Mild	TMPRSS11D	64	37
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000872498856	GE	On-Demand	Mild	PLG	56	32
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000872498856	GE	On-Demand	Mild	TRYP_PIG	46	31
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000872498856	GE	On-Demand	Mild	EPHX2	36	62
Cc1cccc(C#N)c1S(=O)(=O)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000872498856	GE	On-Demand	Mild	TMPRSS11D	64	37
c1cncc(CC2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872498871	DG	On-Demand	Anodyne	CHRNA7	46	37
c1cncc(CC2CCN(c3ccnc4ncccc34)CC2)c1	ZINC000872498871	DG	On-Demand	Anodyne	ACHP_LYMST	25	42
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)cc2N1	ZINC000872498900	FE	On-Demand	Anodyne	PKM	33	46
C#CC1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000872498915	DF	On-Demand	Mild	PKM	41	38
COC(=O)[C@@H](CCF)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872498939	ED	On-Demand	Anodyne	LEF	43	49
CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C#N)C1	ZINC000872498950	DD	On-Demand	Mild	TRPV4	43	35
CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872498953	ED	On-Demand	Anodyne	NOD2	19	46
COc1ccc(OC)c2sc(N3CCC(CCC(N)=O)CC3)nc12	ZINC000872498984	EF	On-Demand	Anodyne	SIRT3	64	35
COc1ccc(OC)c2sc(N3CCC(CCC(N)=O)CC3)nc12	ZINC000872498984	EF	On-Demand	Anodyne	SIRT2	55	34
COc1ccc(OC)c2sc(N3CCC(CCC(N)=O)CC3)nc12	ZINC000872498984	EF	On-Demand	Anodyne	SIRT1	53	33
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)c(C#N)c1	ZINC000872499012	GE	On-Demand	Mild	GPR119	45	46
NC(=O)CCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872499028	EG	On-Demand	Anodyne	SIRT3	64	37
NC(=O)CCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872499028	EG	On-Demand	Anodyne	SIRT2	56	35
NC(=O)CCC1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872499028	EG	On-Demand	Anodyne	SIRT1	55	35
C[C@@H]1SCC[C@@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499050	FF	On-Demand	Anodyne	PKM	36	45
C[C@@H]1SCC[C@H]1NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499051	FF	On-Demand	Anodyne	PKM	36	45
CC#CC[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499055	DD	On-Demand	Mild	LEF	34	41
CC#CC[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499056	DD	On-Demand	Mild	LEF	34	41
CS(=O)(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499065	FD	On-Demand	Anodyne	ADRA1D	24	40
CS(=O)(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499065	FD	On-Demand	Anodyne	ADRA1A	17	40
CS(=O)(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499065	FD	On-Demand	Anodyne	ADRA1B	18	40
CS(=O)(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499066	FD	On-Demand	Anodyne	ADRA1D	24	40
CS(=O)(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499066	FD	On-Demand	Anodyne	ADRA1A	17	40
CS(=O)(=O)N1CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499066	FD	On-Demand	Anodyne	ADRA1B	18	40
CC[C@@H](C)C[C@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499068	EF	On-Demand	Anodyne	LEF	35	42
CC[C@@H](C)C[C@@H](CO)NS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499071	EF	On-Demand	Anodyne	LEF	35	42
CC#CC[C@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499109	FD	On-Demand	Mild	PKM	36	43
CC#CC[C@@H](CO)NS(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499110	FD	On-Demand	Mild	PKM	36	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC2(CC1)C(F)(F)C2(F)F	ZINC000872499117	GH	On-Demand	Mild	PKM	46	38
CNC(=O)Cn1nc(Nc2nc3c(OC)ccc(OC)c3s2)cc1C	ZINC000872499152	FE	On-Demand	Anodyne	ADORA2B	21	42
NC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872499272	CE	On-Demand	Anodyne	SIRT3	65	42
NC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872499272	CE	On-Demand	Anodyne	SIRT2	57	42
NC(=O)CCC1CCN(c2ccnc3ncccc23)CC1	ZINC000872499272	CE	On-Demand	Anodyne	SIRT1	56	34
C#CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872499318	CD	On-Demand	Mild	EPHX2	26	46
C#CC1CCN(S(=O)(=O)c2ccc(C)cc2C#N)CC1	ZINC000872499318	CD	On-Demand	Mild	TRPV4	43	35
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	DCK	46	37
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	SIRT3	62	32
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	SIRT2	52	32
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	SIRT1	51	31
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	SCD1	22	40
Cc1c(F)ncnc1N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000872499319	ED	On-Demand	Anodyne	GPR119	54	38
COC(=O)c1ccc2c(c1)CN(c1nc(N)nc(C(F)F)n1)CC2	ZINC000872499339	ED	On-Demand	Anodyne	SRD5A1	16	40
O=S(=O)(N[C@H](C1CCOCC1)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872499364	FG	On-Demand	Anodyne	LEF	33	52
O=S(=O)(N[C@@H](C1CCOCC1)C1CC1)c1ccc(F)c(C(F)F)c1	ZINC000872499365	FG	On-Demand	Anodyne	LEF	33	52
Cc1ccc(S(=O)(=O)N2C[C@@H](C)OC3(CCC3)C2)c(C#N)c1	ZINC000872499378	DE	On-Demand	Mild	TRPV4	43	35
Cc1ccc(S(=O)(=O)N2C[C@H](C)OC3(CCC3)C2)c(C#N)c1	ZINC000872499379	DE	On-Demand	Mild	TRPV4	43	35
C[C@@H](O)C(=O)N1CCN(c2ccnc3ncccc23)CC1	ZINC000872499419	CC	On-Demand	Anodyne	AKT1	15	44
Cc1c(F)ncnc1N1CCN(CC(=O)Nc2nncs2)CC1	ZINC000872499470	EC	On-Demand	Anodyne	SLC27A1	45	44
N#CC[C@@]1(O)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499543	ED	On-Demand	Mild	TRPV4	42	38
N#CC[C@]1(O)CCN(S(=O)(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000872499548	ED	On-Demand	Mild	TRPV4	42	38
COc1ccccc1COC1CCN(c2cc(C(N)=O)nc(Cl)n2)CC1	ZINC000872499586	GE	On-Demand	Anodyne	SCD1	38	50
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@@H]1CCCOC1	ZINC000872499591	FG	On-Demand	Anodyne	CASP7	42	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@@H]1CCCOC1	ZINC000872499594	FG	On-Demand	Anodyne	CASP7	42	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@H]1[C@H]1CCCOC1	ZINC000872499597	FG	On-Demand	Anodyne	CASP7	42	34
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCC[C@@H]1[C@H]1CCCOC1	ZINC000872499598	FG	On-Demand	Anodyne	CASP7	42	34
Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccccc3)C2)c(C#N)c1	ZINC000872499601	EF	On-Demand	Mild	EPHX2	17	43
Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3ccccc3)C2)c(C#N)c1	ZINC000872499601	EF	On-Demand	Mild	TRPV4	42	35
Nc1nc(C(F)F)nc(N2CCC(OCc3ccc(F)cc3)CC2)n1	ZINC000872499627	FF	On-Demand	Anodyne	LIPG	20	42
CC(=O)NCCN(C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499651	FD	On-Demand	Anodyne	PKM	34	43
O=S(=O)(c1ccc(F)c(C(F)F)c1)N1CCc2cc(Cl)nnc2C1	ZINC000872499665	GF	On-Demand	Anodyne	AKR1C3	59	42
Cc1c(F)ncnc1N1CCC(Cc2cccnc2)CC1	ZINC000872499695	CF	On-Demand	Anodyne	CHRNA7	43	36
Cc1ccc(S(=O)(=O)N2CCOC3(CCN(C)CC3)C2)c(C#N)c1	ZINC000872499734	ED	On-Demand	Mild	TRPV4	41	34
C[C@H]1C[C@H](CNc2cc(-c3ccccc3)ncn2)CCO1	ZINC000872499747	CG	On-Demand	Anodyne	VCP	50	34
CN(C(C)(C)C)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2	ZINC000872499765	EG	On-Demand	Anodyne	PKM	36	45
CN1C(=O)CC[C@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872499798	FD	On-Demand	Anodyne	F10	27	41
CN1C(=O)CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(F)F)c2)C1=O	ZINC000872499799	FD	On-Demand	Anodyne	F10	27	41
C[C@@H](O)C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872499813	DD	On-Demand	Anodyne	P2RY12	121	37
C[C@@H](O)C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872499813	DD	On-Demand	Anodyne	PRNP	49	38
C[C@@H](O)C(=O)N1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000872499813	DD	On-Demand	Anodyne	SORD	50	42
C[C@@H](O)C(=O)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872499832	ED	On-Demand	Anodyne	MC4R	41	38
C[C@@H](O)C(=O)N1CCN(c2cc(-c3cccc(Cl)c3)ncn2)CC1	ZINC000872499832	ED	On-Demand	Anodyne	GRM5	17	40
O=C(CN1CCN(c2cc(-c3ccccc3)ncn2)CC1)Nc1nncs1	ZINC000872499841	GD	On-Demand	Anodyne	SLC27A1	56	43
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@H]2CCN(C)C2=O)CC1	ZINC000872499867	GC	On-Demand	Mild	CCR8	63	32
Cc1cccc(C#N)c1S(=O)(=O)NC1CCN([C@@H]2CCN(C)C2=O)CC1	ZINC000872499869	GC	On-Demand	Mild	CCR8	63	32
O=C(CN1CCN(c2ccnc3ncccc23)CC1)Nc1nncs1	ZINC000872499881	FD	On-Demand	Anodyne	SLC27A1	48	45
O=C1CCCc2cc(Cl)c(S(=O)(=O)N[C@@H]3CC[C@H]3O)cc2N1	ZINC000872499898	ED	On-Demand	Anodyne	PKM	39	47
Cc1ccc(S(=O)(=O)N2CCN3CC(F)(F)C[C@H]3C2)c(C#N)c1	ZINC000872499942	ED	On-Demand	Mild	TRPV4	45	36
CC(=O)CCCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499943	FH	On-Demand	Anodyne	TBXA2R	45	36
CC(=O)CCCCCCNS(=O)(=O)c1ccc(F)c(C(F)F)c1	ZINC000872499943	FH	On-Demand	Anodyne	LEF	32	44
COc1ccccc1COC1CCN(c2ncnc(F)c2C)CC1	ZINC000872499978	EG	On-Demand	Anodyne	PDE3A	45	42
COc1ccccc1COC1CCN(c2ncnc(F)c2C)CC1	ZINC000872499978	EG	On-Demand	Anodyne	DCK	41	37
COc1ccccc1COC1CCN(c2ncnc(F)c2C)CC1	ZINC000872499978	EG	On-Demand	Anodyne	PDE3B	49	42